towhee_ff Version
          14
Number of Nonbonded Types
          29
Potential Type
12-6 plus solvation           
Classical Mixrule
Explicit                      
Atom Type Number
           1
Nonbond Coefficients
    0.3741774603E+01
    0.6038599200E+02
    0.3385415117E+01
    0.5032166000E+02
    0.1470000000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.3500000000E+01
    0.2100000000E+01
Nonbond Coefficients
    0.3799683020E+01
    0.7418307086E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3977862763E+01
    0.3842940999E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3862045930E+01
    0.5890859084E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3799683020E+01
    0.7418307086E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3741774603E+01
    0.6038599200E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.1402052118E+03
    0.3118145503E+01
    0.1279892619E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3554685873E+01
    0.3614762847E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3554685873E+01
    0.3614762847E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4089225102E+01
    0.2821605075E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4089225102E+01
    0.2821605075E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2583606274E+01
    0.3890095413E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2405426531E+01
    0.3890095413E+02
    0.2227246788E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2583606274E+01
    0.3890095413E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3178726615E+01
    0.3697871700E+02
    0.3000546872E+01
    0.3375679575E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3420872886E+01
    0.4799325271E+02
    0.3242693143E+01
    0.4381164519E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2449971466E+01
    0.0000000000E+00
    0.2271791723E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1201100000E+02
Element
 C
Bond Pattern
sp2  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
C         
C         
C         
C         
Atom Type Number
           2
Nonbond Coefficients
    0.3857591436E+01
    0.9113252626E+02
    0.3385415117E+01
    0.5032166000E+02
    0.8300000000E+01
   -0.8900000000E+00
   -0.1400000000E+01
    0.2220000000E+01
    0.6900000000E+01
    0.3500000000E+01
    0.2100000000E+01
Nonbond Coefficients
    0.4035771179E+01
    0.4720981721E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3919954346E+01
    0.7236811094E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3857591436E+01
    0.9113252626E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3799683020E+01
    0.7418307086E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1722395015E+03
    0.3118145503E+01
    0.1279892619E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3612594290E+01
    0.4440669094E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3612594290E+01
    0.4440669094E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4147133519E+01
    0.3466289486E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4147133519E+01
    0.3466289486E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2641514690E+01
    0.4778910044E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2463334947E+01
    0.4778910044E+02
    0.2227246788E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2641514690E+01
    0.4778910044E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3236635032E+01
    0.4542766779E+02
    0.3000546872E+01
    0.3375679575E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3478781303E+01
    0.5895882055E+02
    0.3242693143E+01
    0.4381164519E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2507879883E+01
    0.0000000000E+00
    0.2271791723E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1201100000E+02
Element
 C
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
CR        
CR        
CR        
CR        
Atom Type Number
           3
Nonbond Coefficients
    0.4213950922E+01
    0.2445632676E+02
    0.3385415117E+01
    0.5032166000E+02
    0.2370000000E+02
   -0.1870000000E+00
   -0.2500000000E+00
    0.8760000000E+00
    0.0000000000E+00
    0.3500000000E+01
    0.2365000000E+01
Nonbond Coefficients
    0.4098134089E+01
    0.3748919765E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4035771179E+01
    0.4720981721E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3977862763E+01
    0.3842940999E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.5416593188E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.5416593188E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.5416593188E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.5416593188E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.5416593188E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.5416593188E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.4424948123E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.4424948123E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.8922605039E+02
    0.3118145503E+01
    0.1279892619E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3790774033E+01
    0.2300420989E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3790774033E+01
    0.2300420989E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4325313262E+01
    0.1795658474E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4325313262E+01
    0.1795658474E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2819694433E+01
    0.2475641562E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2641514690E+01
    0.2475641562E+02
    0.2227246788E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2819694433E+01
    0.2475641562E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3414814775E+01
    0.2353311140E+02
    0.3000546872E+01
    0.3375679575E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.5416593188E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3656961046E+01
    0.3054271900E+02
    0.3242693143E+01
    0.4381164519E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.4424948123E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.4424948123E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3532413405E+01
    0.4424948123E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2686059626E+01
    0.0000000000E+00
    0.2271791723E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1201100000E+02
Element
 C
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
CH1E      
CH1E      
CH1E      
CH1E      
Atom Type Number
           4
Nonbond Coefficients
    0.3982317256E+01
    0.5746733572E+02
    0.3385415117E+01
    0.5032166000E+02
    0.2240000000E+02
    0.3720000000E+00
    0.5200000000E+00
   -0.6100000000E+00
    0.1860000000E+02
    0.3500000000E+01
    0.2235000000E+01
Nonbond Coefficients
    0.3919954346E+01
    0.7236811094E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3862045930E+01
    0.5890859084E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.8303116597E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.8303116597E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.8303116597E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.8303116597E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.8303116597E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.8303116597E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.6783020051E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.6783020051E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.1367749569E+03
    0.3118145503E+01
    0.1279892619E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3674957200E+01
    0.3526324210E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3674957200E+01
    0.3526324210E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4209496429E+01
    0.2752571803E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4209496429E+01
    0.2752571803E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2703877600E+01
    0.3794920501E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2525697857E+01
    0.3794920501E+02
    0.2227246788E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2703877600E+01
    0.3794920501E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3298997942E+01
    0.3607399726E+02
    0.3000546872E+01
    0.3375679575E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.8303116597E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3541144213E+01
    0.4681905179E+02
    0.3242693143E+01
    0.4381164519E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.6783020051E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.6783020051E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3416596572E+01
    0.6783020051E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2570242793E+01
    0.0000000000E+00
    0.2271791723E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1201100000E+02
Element
 C
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
CH2E      
CH2E      
CH2E      
CH2E      
Atom Type Number
           5
Nonbond Coefficients
    0.3857591436E+01
    0.9113252626E+02
    0.3385415117E+01
    0.5032166000E+02
    0.3000000000E+02
    0.1089000000E+01
    0.1500000000E+01
   -0.1779000000E+01
    0.3560000000E+02
    0.3500000000E+01
    0.2165000000E+01
Nonbond Coefficients
    0.3799683020E+01
    0.7418307086E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1722395015E+03
    0.3118145503E+01
    0.1279892619E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3612594290E+01
    0.4440669094E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3612594290E+01
    0.4440669094E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4147133519E+01
    0.3466289486E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4147133519E+01
    0.3466289486E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2641514690E+01
    0.4778910044E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2463334947E+01
    0.4778910044E+02
    0.2227246788E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2641514690E+01
    0.4778910044E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3236635032E+01
    0.4542766779E+02
    0.3000546872E+01
    0.3375679575E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.1045604178E+03
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3478781303E+01
    0.5895882055E+02
    0.3242693143E+01
    0.4381164519E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3354233662E+01
    0.8541797552E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2507879883E+01
    0.0000000000E+00
    0.2271791723E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1201100000E+02
Element
 C
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
CH3E      
CH3E      
CH3E      
CH3E      
Atom Type Number
           6
Nonbond Coefficients
    0.3741774603E+01
    0.6038599200E+02
    0.3385415117E+01
    0.5032166000E+02
    0.1840000000E+02
    0.5700000000E-01
    0.8000000000E-01
   -0.9730000000E+00
    0.6900000000E+01
    0.3500000000E+01
    0.2100000000E+01
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.1402052118E+03
    0.3118145503E+01
    0.1279892619E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3554685873E+01
    0.3614762847E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3554685873E+01
    0.3614762847E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4089225102E+01
    0.2821605075E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4089225102E+01
    0.2821605075E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2583606274E+01
    0.3890095413E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2405426531E+01
    0.3890095413E+02
    0.2227246788E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2583606274E+01
    0.3890095413E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3178726615E+01
    0.3697871700E+02
    0.3000546872E+01
    0.3375679575E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.8511355054E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3420872886E+01
    0.4799325271E+02
    0.3242693143E+01
    0.4381164519E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3296325246E+01
    0.6953135165E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2449971466E+01
    0.0000000000E+00
    0.2271791723E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1201100000E+02
Element
 C
Bond Pattern
sp2  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
CR1E      
CR1E      
CR1E      
CR1E      
Atom Type Number
           7
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.4400000000E+01
   -0.5950000000E+01
   -0.8900000000E+01
   -0.9059000000E+01
   -0.8800000000E+01
    0.3500000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1976180730E+03
    0.2850875888E+01
    0.1976180730E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.5483056941E+02
    0.1959977173E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.5212119226E+02
    0.2733277258E+01
    0.5212119226E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.6764608819E+02
    0.2975423529E+01
    0.6764608819E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1400700000E+02
Element
 N
Bond Pattern
sp2  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
NH1       
NH1       
NH1       
NH1       
Atom Type Number
           8
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.4400000000E+01
   -0.3820000000E+01
   -0.4000000000E+01
   -0.4654000000E+01
   -0.8800000000E+01
    0.3500000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1976180730E+03
    0.2850875888E+01
    0.1976180730E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.5483056941E+02
    0.1959977173E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.5212119226E+02
    0.2733277258E+01
    0.5212119226E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.6764608819E+02
    0.2975423529E+01
    0.6764608819E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1400700000E+02
Element
 N
Bond Pattern
sp2  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
NR        
NR        
NR        
NR        
Atom Type Number
           9
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.1120000000E+02
   -0.5450000000E+01
   -0.7800000000E+01
   -0.9028000000E+01
   -0.7000000000E+01
    0.3500000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1976180730E+03
    0.2850875888E+01
    0.1976180730E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.5483056941E+02
    0.1959977173E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.5212119226E+02
    0.2733277258E+01
    0.5212119226E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.6764608819E+02
    0.2975423529E+01
    0.6764608819E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1400700000E+02
Element
 N
Bond Pattern
sp2  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
NH2       
NH2       
NH2       
NH2       
Atom Type Number
          10
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.1120000000E+02
   -0.2000000000E+02
   -0.2000000000E+02
   -0.2500000000E+02
   -0.1800000000E+02
    0.6000000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1976180730E+03
    0.2850875888E+01
    0.1976180730E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.5483056941E+02
    0.1959977173E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.5212119226E+02
    0.2733277258E+01
    0.5212119226E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.6764608819E+02
    0.2975423529E+01
    0.6764608819E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1400700000E+02
Element
 N
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
NH3       
NH3       
NH3       
NH3       
Atom Type Number
          11
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.1120000000E+02
   -0.1000000000E+02
   -0.1000000000E+02
   -0.1200000000E+02
   -0.7000000000E+01
    0.6000000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1976180730E+03
    0.2850875888E+01
    0.1976180730E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.5483056941E+02
    0.1959977173E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.5212119226E+02
    0.2733277258E+01
    0.5212119226E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.6764608819E+02
    0.2975423529E+01
    0.6764608819E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1400700000E+02
Element
 N
Bond Pattern
sp2  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
NC2       
NC2       
NC2       
NC2       
Atom Type Number
          12
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
   -0.1000000000E+01
   -0.1550000000E+01
   -0.1250000000E+01
    0.8800000000E+01
    0.3500000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1976180730E+03
    0.2850875888E+01
    0.1976180730E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.5483056941E+02
    0.1959977173E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.5212119226E+02
    0.2733277258E+01
    0.5212119226E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.6764608819E+02
    0.2975423529E+01
    0.6764608819E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1400700000E+02
Element
 N
Bond Pattern
sp2  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
N         
N         
N         
N         
Atom Type Number
          13
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.1080000000E+02
   -0.5920000000E+01
   -0.6700000000E+01
   -0.9264000000E+01
   -0.1120000000E+02
    0.3500000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1614390616E+03
    0.2850875888E+01
    0.1614390616E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.4479243997E+02
    0.1959977173E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.4257908317E+02
    0.2733277258E+01
    0.4257908317E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.5526175228E+02
    0.2975423529E+01
    0.5526175228E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1599900000E+02
Element
 O
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
OH1       
OH1       
OH1       
OH1       
Atom Type Number
          14
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.1080000000E+02
   -0.5330000000E+01
   -0.5850000000E+01
   -0.5787000000E+01
   -0.8800000000E+01
    0.3500000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.2850875888E+01
    0.1614390616E+03
    0.2850875888E+01
    0.1614390616E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.4479243997E+02
    0.1959977173E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.4257908317E+02
    0.2733277258E+01
    0.4257908317E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.5526175228E+02
    0.2975423529E+01
    0.5526175228E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1599900000E+02
Element
 O
Bond Pattern
s    
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
O         
O         
O         
O         
Atom Type Number
          15
Nonbond Coefficients
    0.2850875888E+01
    0.3255308185E+03
    0.2850875888E+01
    0.3255308185E+03
    0.1080000000E+02
   -0.1000000000E+02
   -0.1000000000E+02
   -0.1200000000E+02
   -0.9400000000E+01
    0.6000000000E+01
    0.1600000000E+01
Nonbond Coefficients
    0.3109236516E+01
    0.8392817169E+02
    0.3109236516E+01
    0.8392817169E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.8392817169E+02
    0.3109236516E+01
    0.8392817169E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.6551250115E+02
    0.3118145503E+01
    0.1279892619E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.6551250115E+02
    0.3118145503E+01
    0.1279892619E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.9032088951E+02
    0.2138156916E+01
    0.9032088951E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.9032088951E+02
    0.1959977173E+01
    0.9032088951E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.9032088951E+02
    0.2138156916E+01
    0.9032088951E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.8585780702E+02
    0.2733277258E+01
    0.8585780702E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1976180730E+03
    0.2850875888E+01
    0.1976180730E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.1114315413E+03
    0.2975423529E+01
    0.1114315413E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1614390616E+03
    0.2850875888E+01
    0.1614390616E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1614390616E+03
    0.2850875888E+01
    0.1614390616E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.1614390616E+03
    0.2850875888E+01
    0.1614390616E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1599900000E+02
Element
 O
Bond Pattern
s    
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
OC        
OC        
OC        
OC        
Atom Type Number
          16
Nonbond Coefficients
    0.3367597143E+01
    0.2163831380E+02
    0.3367597143E+01
    0.2163831380E+02
    0.1470000000E+02
   -0.3240000000E+01
   -0.4100000000E+01
   -0.4475000000E+01
   -0.3990000000E+02
    0.3500000000E+01
    0.1890000000E+01
Nonbond Coefficients
    0.3367597143E+01
    0.2163831380E+02
    0.3367597143E+01
    0.2163831380E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3902136372E+01
    0.1689039603E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3902136372E+01
    0.1689039603E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2396517544E+01
    0.2328648070E+02
    0.2396517544E+01
    0.2328648070E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2218337801E+01
    0.2328648070E+02
    0.2218337801E+01
    0.2328648070E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2396517544E+01
    0.2328648070E+02
    0.2396517544E+01
    0.2328648070E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2991637885E+01
    0.2213581129E+02
    0.2991637885E+01
    0.2213581129E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3233784156E+01
    0.2872921700E+02
    0.3233784156E+01
    0.2872921700E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2262882736E+01
    0.0000000000E+00
    0.2262882736E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.3206600000E+02
Element
 S
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
S         
S         
S         
S         
Atom Type Number
          17
Nonbond Coefficients
    0.3367597143E+01
    0.2163831380E+02
    0.3367597143E+01
    0.2163831380E+02
    0.2140000000E+02
   -0.2050000000E+01
   -0.2700000000E+01
   -0.4475000000E+01
   -0.3990000000E+02
    0.3500000000E+01
    0.1890000000E+01
Nonbond Coefficients
    0.3902136372E+01
    0.1689039603E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3902136372E+01
    0.1689039603E+02
    0.3376506130E+01
    0.3299811919E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2396517544E+01
    0.2328648070E+02
    0.2396517544E+01
    0.2328648070E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2218337801E+01
    0.2328648070E+02
    0.2218337801E+01
    0.2328648070E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2396517544E+01
    0.2328648070E+02
    0.2396517544E+01
    0.2328648070E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2991637885E+01
    0.2213581129E+02
    0.2991637885E+01
    0.2213581129E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.5094977992E+02
    0.3109236516E+01
    0.5094977992E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3233784156E+01
    0.2872921700E+02
    0.3233784156E+01
    0.2872921700E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3109236516E+01
    0.4162212764E+02
    0.3109236516E+01
    0.4162212764E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2262882736E+01
    0.0000000000E+00
    0.2262882736E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.3206600000E+02
Element
 S
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
SH1E      
SH1E      
SH1E      
SH1E      
Atom Type Number
          18
Nonbond Coefficients
    0.4436675601E+01
    0.1318427492E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.4436675601E+01
    0.1318427492E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2931056773E+01
    0.1817691918E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2752877030E+01
    0.1817691918E+02
    0.2227246788E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2931056773E+01
    0.1817691918E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3526177114E+01
    0.1727873172E+02
    0.3000546872E+01
    0.3375679575E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3768323385E+01
    0.2242540048E+02
    0.3242693143E+01
    0.4381164519E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2797421965E+01
    0.0000000000E+00
    0.2271791723E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1201100000E+02
Element
 C
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
CT        
CT        
CT        
CT        
Atom Type Number
          19
Nonbond Coefficients
    0.4436675601E+01
    0.1318427492E+02
    0.3385415117E+01
    0.5032166000E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2931056773E+01
    0.1817691918E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2752877030E+01
    0.1817691918E+02
    0.2227246788E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2931056773E+01
    0.1817691918E+02
    0.2405426531E+01
    0.3551155014E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3526177114E+01
    0.1727873172E+02
    0.3000546872E+01
    0.3375679575E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3977028748E+02
    0.3118145503E+01
    0.7769768597E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3768323385E+01
    0.2242540048E+02
    0.3242693143E+01
    0.4381164519E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.3643775745E+01
    0.3248932545E+02
    0.3118145503E+01
    0.6347314959E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2797421965E+01
    0.0000000000E+00
    0.2271791723E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1201100000E+02
Element
 C
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
CM        
CM        
CM        
CM        
Atom Type Number
          20
Nonbond Coefficients
    0.1425437944E+01
    0.2506018668E+02
    0.1425437944E+01
    0.2506018668E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1247258201E+01
    0.2506018668E+02
    0.1247258201E+01
    0.2506018668E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1425437944E+01
    0.2506018668E+02
    0.1425437944E+01
    0.2506018668E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2020558286E+01
    0.2382187203E+02
    0.2020558286E+01
    0.2382187203E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2262704557E+01
    0.3091749031E+02
    0.2262704557E+01
    0.3091749031E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1291803137E+01
    0.0000000000E+00
    0.1291803137E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1008000000E+01
Element
 H
Bond Pattern
s    
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
H         
H         
H         
H         
Atom Type Number
          21
Nonbond Coefficients
    0.1069078458E+01
    0.2506018668E+02
    0.1069078458E+01
    0.2506018668E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1247258201E+01
    0.2506018668E+02
    0.1247258201E+01
    0.2506018668E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1842378543E+01
    0.2382187203E+02
    0.1842378543E+01
    0.2382187203E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.5483056941E+02
    0.1959977173E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2084524814E+01
    0.3091749031E+02
    0.2084524814E+01
    0.3091749031E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.4479243997E+02
    0.1959977173E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.4479243997E+02
    0.1959977173E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1959977173E+01
    0.4479243997E+02
    0.1959977173E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1113623394E+01
    0.0000000000E+00
    0.1113623394E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1008000000E+01
Element
 H
Bond Pattern
s    
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
HC        
HC        
HC        
HC        
Atom Type Number
          22
Nonbond Coefficients
    0.4490000010E+00
    0.2313789927E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2020558286E+01
    0.2382187203E+02
    0.2020558286E+01
    0.2382187203E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.5483056941E+02
    0.2138156916E+01
    0.5483056941E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2262704557E+01
    0.3091749031E+02
    0.2262704557E+01
    0.3091749031E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1992700000E+01
    0.4208400426E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2138156916E+01
    0.4479243997E+02
    0.2138156916E+01
    0.4479243997E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1291803137E+01
    0.0000000000E+00
    0.1291803137E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1008000000E+01
Element
 H
Bond Pattern
s    
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
HT        
HT        
HT        
HT        
Atom Type Number
          23
Nonbond Coefficients
    0.2615678627E+01
    0.2264474700E+02
    0.2615678627E+01
    0.2264474700E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.5212119226E+02
    0.2733277258E+01
    0.5212119226E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2857824898E+01
    0.2938974506E+02
    0.2857824898E+01
    0.2938974506E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.4257908317E+02
    0.2733277258E+01
    0.4257908317E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.4257908317E+02
    0.2733277258E+01
    0.4257908317E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2733277258E+01
    0.4257908317E+02
    0.2733277258E+01
    0.4257908317E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.1886923479E+01
    0.0000000000E+00
    0.1886923479E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1008000000E+01
Element
 H
Bond Pattern
s    
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
HA        
HA        
HA        
HA        
Atom Type Number
          24
Nonbond Coefficients
    0.2850875888E+01
    0.1199668374E+03
    0.2850875888E+01
    0.1199668374E+03
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.6764608819E+02
    0.2975423529E+01
    0.6764608819E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.9800385847E+02
    0.2850875888E+01
    0.9800385847E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1400700000E+02
Element
 N
Bond Pattern
sp2  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
NP        
NP        
NP        
NP        
Atom Type Number
          25
Nonbond Coefficients
    0.3099971169E+01
    0.3814381828E+02
    0.3099971169E+01
    0.3814381828E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.5526175228E+02
    0.2975423529E+01
    0.5526175228E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.5526175228E+02
    0.2975423529E+01
    0.5526175228E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2975423529E+01
    0.5526175228E+02
    0.2975423529E+01
    0.5526175228E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2129069749E+01
    0.0000000000E+00
    0.2129069749E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1599900000E+02
Element
 O
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
OH2       
OH2       
OH2       
OH2       
Atom Type Number
          26
Nonbond Coefficients
    0.3536500000E+01
    0.7652565801E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1599900000E+02
Element
 O
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
OT        
OT        
OT        
OT        
Atom Type Number
          27
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1599900000E+02
Element
 O
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
OS        
OS        
OS        
OS        
Atom Type Number
          28
Nonbond Coefficients
    0.2850875888E+01
    0.8006176106E+02
    0.2850875888E+01
    0.8006176106E+02
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Nonbond Coefficients
    0.2004522109E+01
    0.0000000000E+00
    0.2004522109E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.1599900000E+02
Element
 O
Bond Pattern
sp3  
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
OM        
OM        
OM        
OM        
Atom Type Number
          29
Nonbond Coefficients
    0.1158168330E+01
    0.0000000000E+00
    0.1158168330E+01
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
    0.0000000000E+00
Mass
    0.3206600000E+02
Element
Fe
Bond Pattern
sp   
Base Charge 
    0.0000000000E+00
Polarizability
    0.1000000000E+01
Force Field Name
C19eef1   
Atom Names
FE        
FE        
FE        
FE        
Number of Bonded Terms
          37
Bond Type Number
           1
Bond Style
           2
Bond Coefficients
    0.1520000000E+01
    0.2038027230E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           6
Atom Names
C          CH1E      
C          CH2E      
C          CH3E      
CR         CH1E      
CR         CH2E      
CR         CH3E      
Bond Type Number
           2
Bond Style
           2
Bond Coefficients
    0.1380000000E+01
    0.2264474700E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           8
Atom Names
C          C         
C          CR1E      
C          OH1       
CR1E       CR1E      
CR         CR        
CR         C         
CR         CR1E      
CR         OH1       
Bond Type Number
           3
Bond Style
           2
Bond Coefficients
    0.1530000000E+01
    0.2038027230E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          CT        
CR         CT        
Bond Type Number
           4
Bond Style
           2
Bond Coefficients
    0.1330000000E+01
    0.2370150186E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
          10
Atom Names
C          N         
C          NH1       
C          NH2       
C          NR        
C          NP        
CR         N         
CR         NH1       
CR         NH2       
CR         NR        
CR         NP        
Bond Type Number
           5
Bond Style
           2
Bond Coefficients
    0.1330000000E+01
    0.2012866400E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          NC2       
CR         NC2       
Bond Type Number
           6
Bond Style
           2
Bond Coefficients
    0.1230000000E+01
    0.2918656280E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
C          O         
C          OC        
CR         O         
CR         OC        
Bond Type Number
           7
Bond Style
           2
Bond Coefficients
    0.1430000000E+01
    0.1469392472E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          OS        
CR         OS        
Bond Type Number
           8
Bond Style
           2
Bond Coefficients
    0.1530000000E+01
    0.1132237350E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH1E       CH1E      
Bond Type Number
           9
Bond Style
           2
Bond Coefficients
    0.1520000000E+01
    0.1132237350E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH1E       CH2E      
CH1E       CH3E      
CH2E       CH2E      
Bond Type Number
          10
Bond Style
           2
Bond Coefficients
    0.1450000000E+01
    0.2123574052E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
          13
Atom Names
CH1E       N         
CH1E       NH1       
CH1E       NH2       
CH1E       NH3       
CH2E       N         
CH2E       NH1       
CH2E       NH2       
CH2E       NH3       
CT         N         
CT         NH1       
CT         NH2       
CT         NH3       
CT         NC2       
Bond Type Number
          11
Bond Style
           2
Bond Coefficients
    0.1420000000E+01
    0.2012866400E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH1E       OH1       
CH2E       OH1       
CT         OH1       
Bond Type Number
          12
Bond Style
           2
Bond Coefficients
    0.1540000000E+01
    0.1132237350E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       CH3E      
Bond Type Number
          13
Bond Style
           2
Bond Coefficients
    0.1450000000E+01
    0.1258041500E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       CR1E      
Bond Type Number
          14
Bond Style
           2
Bond Coefficients
    0.1810000000E+01
    0.2264474700E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH2E       SH1E      
CH2E       S         
CT         S         
Bond Type Number
          15
Bond Style
           2
Bond Coefficients
    0.1490000000E+01
    0.2123574052E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CH3E       NH1       
CH3E       NR        
Bond Type Number
          16
Bond Style
           2
Bond Coefficients
    0.1770000000E+01
    0.2264474700E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH3E       S         
Bond Type Number
          17
Bond Style
           2
Bond Coefficients
    0.1380000000E+01
    0.1469392472E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH3E       OS        
Bond Type Number
          18
Bond Style
           2
Bond Coefficients
    0.1128000000E+01
    0.5610865090E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CM         OM        
Bond Type Number
          19
Bond Style
           2
Bond Coefficients
    0.1305000000E+01
    0.2264474700E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CR1E       NH1       
CR1E       NR        
Bond Type Number
          20
Bond Style
           2
Bond Coefficients
    0.1530000000E+01
    0.1006433200E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CT         CT        
Bond Type Number
          21
Bond Style
           2
Bond Coefficients
    0.1790000000E+01
    0.1298298828E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
FE         CM        
Bond Type Number
          22
Bond Style
           2
Bond Coefficients
    0.2090000000E+01
    0.2516083000E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
FE         NP        
Bond Type Number
          23
Bond Style
           2
Bond Coefficients
    0.1980000000E+01
    0.3270907900E+05
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
FE         NR        
Bond Type Number
          24
Bond Style
           2
Bond Coefficients
    0.1800000000E+01
    0.1258041500E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
FE         OM        
Bond Type Number
          25
Bond Style
           2
Bond Coefficients
    0.9600000000E+00
    0.2264474700E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
H          OH1       
Bond Type Number
          26
Bond Style
           2
Bond Coefficients
    0.1000000000E+01
    0.2264474700E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
H          OH2       
Bond Type Number
          27
Bond Style
           2
Bond Coefficients
    0.1632993100E+01
    0.0000000000E+00
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
H          H         
Bond Type Number
          28
Bond Style
           2
Bond Coefficients
    0.9800000000E+00
    0.2038027230E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
HC         NH1       
H          NH1       
H          NH2       
Bond Type Number
          29
Bond Style
           2
Bond Coefficients
    0.1040000000E+01
    0.2038027230E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
HC         NH3       
Bond Type Number
          30
Bond Style
           2
Bond Coefficients
    0.1000000000E+01
    0.2038027230E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
HC         NC2       
Bond Type Number
          31
Bond Style
           2
Bond Coefficients
    0.9572000000E+00
    0.2264474700E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
HT         OT        
Bond Type Number
          32
Bond Style
           2
Bond Coefficients
    0.1513900000E+01
    0.0000000000E+00
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
HT         HT        
Bond Type Number
          33
Bond Style
           2
Bond Coefficients
    0.1080000000E+01
    0.1761258100E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
HA         C         
Bond Type Number
          34
Bond Style
           2
Bond Coefficients
    0.1080000000E+01
    0.1509649800E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
HA         CT        
Bond Type Number
          35
Bond Style
           2
Bond Coefficients
    0.1230000000E+01
    0.3019299600E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
OM         OM        
Bond Type Number
          36
Bond Style
           2
Bond Coefficients
    0.1430000000E+01
    0.2012866400E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
OC         S         
Bond Type Number
          37
Bond Style
           2
Bond Coefficients
    0.2020000000E+01
    0.2516083000E+06
Vibration Order
wild      
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
S          S         
Number of Angle Terms
          81
Angle Type Number
           1
Angle Style
           1
Angle Coefficients
    0.1065000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
C          C          C         
C          CH1E       CH3E      
CR         CR         CR        
Angle Type Number
           2
Angle Style
           1
Angle Coefficients
    0.1265000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
C          C          CH2E      
CR         CR         CH2E      
C          C          CH3E      
Angle Type Number
           3
Angle Style
           1
Angle Coefficients
    0.1225000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          C          CR1E      
CR         CR         CR1E      
Angle Type Number
           4
Angle Style
           1
Angle Coefficients
    0.1265000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
C          C          CT        
Angle Type Number
           5
Angle Style
           1
Angle Coefficients
    0.1090000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          C          NH1       
CR         CR         NH1       
Angle Type Number
           6
Angle Style
           1
Angle Coefficients
    0.1125000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          C          NR        
C          C          NP        
Angle Type Number
           7
Angle Style
           1
Angle Coefficients
    0.1190000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
C          C          OH1       
C          C          O         
CR1E       C          OH1       
Angle Type Number
           8
Angle Style
           1
Angle Coefficients
    0.1100000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
C          CH1E       CH1E      
Angle Type Number
           9
Angle Style
           1
Angle Coefficients
    0.1095000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           7
Atom Names
C          CH1E       CH2E      
C          NR         CR1E      
CH3E       NR         C         
CH3E       NR         CR1E      
C          CT         CT        
C          CT         HA        
CR         NR         CR1E      
Angle Type Number
          10
Angle Style
           1
Angle Coefficients
    0.1116000000E+03
    0.2264474700E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
C          CH1E       N         
C          CH1E       NH1       
C          CH1E       NH2       
C          CH1E       NH3       
Angle Type Number
          11
Angle Style
           1
Angle Coefficients
    0.1125000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          CH2E       CH1E      
CR         CH2E       CH1E      
Angle Type Number
          12
Angle Style
           1
Angle Coefficients
    0.1130000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
C          CH2E       CH2E      
Angle Type Number
          13
Angle Style
           1
Angle Coefficients
    0.1116000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           7
Atom Names
C          CH2E       NH1       
C          CH2E       NH2       
C          CH2E       NH3       
C          CT         N         
C          CT         NH1       
C          CT         NH2       
C          CT         NH3       
Angle Type Number
          14
Angle Style
           1
Angle Coefficients
    0.1265000000E+03
    0.4528949400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
C          CR1E       C         
Angle Type Number
          15
Angle Style
           1
Angle Coefficients
    0.1220000000E+03
    0.4528949400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
C          CR1E       CH2E      
Angle Type Number
          16
Angle Style
           1
Angle Coefficients
    0.1190000000E+03
    0.4528949400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          CR1E       CR1E      
CR         CR1E       CR1E      
Angle Type Number
          17
Angle Style
           1
Angle Coefficients
    0.1095000000E+03
    0.4528949400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          CR1E       NH1       
CR         CR1E       NH1       
Angle Type Number
          18
Angle Style
           1
Angle Coefficients
    0.1065000000E+03
    0.4528949400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          CR1E       NR        
CR         CR1E       NR        
Angle Type Number
          19
Angle Style
           1
Angle Coefficients
    0.1200000000E+03
    0.4025732800E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           5
Atom Names
C          N          CH1E      
C          N          CH2E      
C          N          CT        
C          NC2        CT        
C          NH1        CT        
Angle Type Number
          20
Angle Style
           1
Angle Coefficients
    0.1200000000E+03
    0.3899928650E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
C          NH1        CH1E      
C          NH1        CH2E      
C          NH1        CH3E      
CR         NH1        CH2E      
Angle Type Number
          21
Angle Style
           1
Angle Coefficients
    0.1080000000E+03
    0.3019299600E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          NH1        CR1E      
CR         NH1        CR1E      
Angle Type Number
          22
Angle Style
           1
Angle Coefficients
    0.1200000000E+03
    0.1509649800E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
C          NH1        H         
C          NH2        H         
CR         NH1        H         
Angle Type Number
          23
Angle Style
           1
Angle Coefficients
    0.1200000000E+03
    0.1761258100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
          10
Atom Names
C          NC2        HC        
CH1E       NH1        H         
CH1E       NH2        H         
CH2E       NH1        H         
CH2E       NH2        H         
CH3E       NH1        H         
CR1E       NH1        H         
CR         NC2        HC        
CT         NC2        HC        
CT         NH1        H         
Angle Type Number
          24
Angle Style
           1
Angle Coefficients
    0.1025000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          NR         C         
C          NP         C         
Angle Type Number
          25
Angle Style
           1
Angle Coefficients
    0.1095000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           8
Atom Names
C          OH1        H         
CH1E       CH1E       NH2       
CT         CT         OH1       
HA         CT         N         
HA         CT         NC2       
HA         CT         NH1       
HA         CT         NH3       
HA         CT         OH1       
Angle Type Number
          26
Angle Style
           1
Angle Coefficients
    0.1175000000E+03
    0.1006433200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
          12
Atom Names
CH1E       C          N         
CH1E       C          NH1       
CH2E       C          N         
CH2E       C          NH1       
CH2E       C          NH2       
CH2E       C          NC2       
CH3E       C          N         
CH3E       C          NH1       
CT         C          N         
CT         C          NH1       
CT         C          NH2       
CH2E       CR         NH1       
Angle Type Number
          27
Angle Style
           1
Angle Coefficients
    0.1215000000E+03
    0.4277341100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
CH1E       C          O         
CH3E       C          O         
CT         C          O         
HA         C          O         
Angle Type Number
          28
Angle Style
           1
Angle Coefficients
    0.1175000000E+03
    0.4277341100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH1E       C          OC        
Angle Type Number
          29
Angle Style
           1
Angle Coefficients
    0.1200000000E+03
    0.4277341100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
CH1E       C          OH1       
CH2E       C          OH1       
O          C          OH1       
CT         C          OH1       
Angle Type Number
          30
Angle Style
           1
Angle Coefficients
    0.1125000000E+03
    0.2264474700E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CH1E       CH1E       CH2E      
CH1E       CH2E       CH2E      
Angle Type Number
          31
Angle Style
           1
Angle Coefficients
    0.1110000000E+03
    0.2264474700E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           5
Atom Names
CH1E       CH1E       CH3E      
CH1E       CH2E       OH1       
CH2E       CH2E       CH3E      
CH3E       CH2E       OH1       
CT         CT         CT        
Angle Type Number
          32
Angle Style
           1
Angle Coefficients
    0.1100000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH1E       CH1E       NH1       
Angle Type Number
          33
Angle Style
           1
Angle Coefficients
    0.1075000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH1E       CH1E       NH3       
Angle Type Number
          34
Angle Style
           1
Angle Coefficients
    0.1045000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH1E       CH1E       OH1       
Angle Type Number
          35
Angle Style
           1
Angle Coefficients
    0.1170000000E+03
    0.2264474700E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH1E       CH2E       CH1E      
Angle Type Number
          36
Angle Style
           1
Angle Coefficients
    0.1130000000E+03
    0.2264474700E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH1E       CH2E       CH3E      
Angle Type Number
          37
Angle Style
           1
Angle Coefficients
    0.1125000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
CH1E       CH2E       S         
CH1E       CH2E       SH1E      
CH2E       CH2E       S         
CT         CT         S         
Angle Type Number
          38
Angle Style
           1
Angle Coefficients
    0.1100000000E+03
    0.3019299600E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH1E       N          CH2E      
CH1E       N          CH3E      
CT         N          CT        
Angle Type Number
          39
Angle Style
           1
Angle Coefficients
    0.1200000000E+03
    0.3019299600E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH1E       NH1        CH3E      
CH1E       NH2        CH2E      
CH2E       NH1        CH3E      
Angle Type Number
          40
Angle Style
           1
Angle Coefficients
    0.1095000000E+03
    0.1761258100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           7
Atom Names
CH1E       NH3        HC        
CH1E       NH3        CH2E      
CH1E       OH1        H         
CH2E       OH1        H         
CH2E       NH3        HC        
CT         NH3        HC        
CT         OH1        H         
Angle Type Number
          41
Angle Style
           1
Angle Coefficients
    0.1215000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CH2E       C          CR1E      
CH2E       CR         CR1E      
Angle Type Number
          42
Angle Style
           1
Angle Coefficients
    0.1160000000E+03
    0.3019299600E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CH2E       C          NR        
CH2E       CR         NR        
Angle Type Number
          43
Angle Style
           1
Angle Coefficients
    0.1216000000E+03
    0.4277341100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       C          O         
Angle Type Number
          44
Angle Style
           1
Angle Coefficients
    0.1185000000E+03
    0.4277341100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CH2E       C          OC        
CT         C          OC        
Angle Type Number
          45
Angle Style
           1
Angle Coefficients
    0.1115000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       CH1E       CH3E      
Angle Type Number
          46
Angle Style
           1
Angle Coefficients
    0.1040000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       CH1E       N         
Angle Type Number
          47
Angle Style
           1
Angle Coefficients
    0.1100000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           9
Atom Names
CH2E       CH1E       NH1       
CH2E       CH1E       NH2       
CH2E       CH1E       NH3       
CR1E       NH1        CR1E      
CR1E       NR         CR1E      
CT         CT         NC2       
CT         CT         NH1       
CT         CT         NH2       
CT         CT         NH3       
Angle Type Number
          48
Angle Style
           1
Angle Coefficients
    0.1100000000E+03
    0.2264474700E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       CH2E       CH2E      
Angle Type Number
          49
Angle Style
           1
Angle Coefficients
    0.1050000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CH2E       CH2E       N         
CT         CT         N         
Angle Type Number
          50
Angle Style
           1
Angle Coefficients
    0.1110000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       CH2E       NH1       
Angle Type Number
          51
Angle Style
           1
Angle Coefficients
    0.1095000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH2E       CH2E       NH2       
CH3E       CH1E       NH2       
CH3E       CH1E       NH3       
Angle Type Number
          52
Angle Style
           1
Angle Coefficients
    0.1105000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH2E       CH2E       NH3       
CR1E       C          NH1       
CR1E       CR         NH1       
Angle Type Number
          53
Angle Style
           1
Angle Coefficients
    0.1095000000E+03
    0.3019299600E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       N          CH3E      
Angle Type Number
          54
Angle Style
           1
Angle Coefficients
    0.9950000000E+02
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       S          CH3E      
Angle Type Number
          55
Angle Style
           1
Angle Coefficients
    0.1042000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH2E       S          S         
Angle Type Number
          56
Angle Style
           1
Angle Coefficients
    0.1110000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH3E       CH1E       CH3E      
Angle Type Number
          57
Angle Style
           1
Angle Coefficients
    0.1085000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH3E       CH1E       NH1       
Angle Type Number
          58
Angle Style
           1
Angle Coefficients
    0.1105000000E+03
    0.3019299600E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CH3E       CH1E       OH1       
Angle Type Number
          59
Angle Style
           1
Angle Coefficients
    0.1205000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CR1E       C          CR1E      
CR1E       CR         CR1E      
Angle Type Number
          60
Angle Style
           1
Angle Coefficients
    0.1225000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CR1E       C          NR        
CR1E       C          NP        
CR1E       CR         NR        
Angle Type Number
          61
Angle Style
           1
Angle Coefficients
    0.1205000000E+03
    0.4528949400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CR1E       CR1E       CR1E      
Angle Type Number
          62
Angle Style
           1
Angle Coefficients
    0.1250000000E+03
    0.2012866400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
H          NH2        H         
Angle Type Number
          63
Angle Style
           1
Angle Coefficients
    0.1200000000E+03
    0.2012866400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           6
Atom Names
HC         NC2        HC        
C          C          HA        
HA         C          NR        
HA         C          NH2       
HA         C          NH1       
HC         NC2        HC        
Angle Type Number
          64
Angle Style
           1
Angle Coefficients
    0.1095000000E+03
    0.2012866400E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
HC         NH3        HC        
CT         CT         HA        
HA         CT         HA        
HA         CT         S         
Angle Type Number
          65
Angle Style
           1
Angle Coefficients
    0.1045200000E+03
    0.2767691300E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
HT         OT         HT        
Angle Type Number
          66
Angle Style
           1
Angle Coefficients
    0.1210000000E+03
    0.4277341100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
N          C          O         
Angle Type Number
          67
Angle Style
           1
Angle Coefficients
    0.1200000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           6
Atom Names
NH1        C          NR        
NC2        C          NH1       
NC2        C          NC2       
NC2        CR         NH1       
NC2        CR         NC2       
OS         C          O         
Angle Type Number
          68
Angle Style
           1
Angle Coefficients
    0.1253000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
OS         C          CH1E      
OS         C          CH2E      
Angle Type Number
          69
Angle Style
           1
Angle Coefficients
    0.1210000000E+03
    0.3270907900E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
NH1        C          O         
NH2        C          O         
Angle Type Number
          70
Angle Style
           1
Angle Coefficients
    0.1090000000E+03
    0.3522516200E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
NH1        CR1E       NH1       
NH1        CR1E       NR        
Angle Type Number
          71
Angle Style
           1
Angle Coefficients
    0.1225000000E+03
    0.4277341100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
OC         C          OC        
Angle Type Number
          72
Angle Style
           1
Angle Coefficients
    0.1095000000E+03
    0.4277341100E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
OC         S          OC        
Angle Type Number
          73
Angle Style
           1
Angle Coefficients
    0.9000000000E+02
    0.2516083000E+04
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
FE         CM         OM        
Angle Type Number
          74
Angle Style
           1
Angle Coefficients
    0.1800000000E+03
    0.0000000000E+00
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
FE         OM         OM        
Angle Type Number
          75
Angle Style
           1
Angle Coefficients
    0.1280000000E+03
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
C          NP         FE        
Angle Type Number
          76
Angle Style
           1
Angle Coefficients
    0.1248000000E+03
    0.1509649800E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
CR1E       NR         FE        
Angle Type Number
          77
Angle Style
           1
Angle Coefficients
    0.9000000000E+02
    0.2516083000E+04
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
NP         FE         CM        
NP         FE         OM        
Angle Type Number
          78
Angle Style
           1
Angle Coefficients
    0.9000000000E+02
    0.2516083000E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
NP         FE         NP        
Angle Type Number
          79
Angle Style
           1
Angle Coefficients
    0.1150000000E+03
    0.2516083000E+04
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
NP         FE         NR        
Angle Type Number
          80
Angle Style
           1
Angle Coefficients
    0.1205000000E+03
    0.2339957190E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
C          OS         CH3E      
Angle Type Number
          81
Angle Style
           1
Angle Coefficients
    0.1094712200E+03
    0.2767691300E+05
Angle Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
H          OH2        H         
Number of Torsion Terms
          17
Torsion Type Number
           1
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.5032166000E+04
    0.2000000000E+01
    0.3141592654E+01
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH1E       C          N          CH1E      
CH2E       C          N          CH1E      
wild       C          CR1E       wild      
Torsion Type Number
           2
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.1258041500E+04
    0.2000000000E+01
    0.3141592654E+01
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
CR1E       C          C          C         
CR1E       C          C          NH1       
CR1E       CR         CR         CR        
CR1E       CR         CR         NH1       
Torsion Type Number
           3
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.2516083000E+04
    0.2000000000E+01
    0.3141592654E+01
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
CR1E       C          C          CR1E      
CR1E       CR         CR         CR1E      
Torsion Type Number
           4
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.0000000000E+00
    0.3000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           5
Atom Names
wild       C          CH1E       wild      
wild       C          CH2E       wild      
wild       CR         CH2E       wild      
wild       C          CT         wild      
null       null       null       null      
Torsion Type Number
           5
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.4126376120E+04
    0.2000000000E+01
    0.3141592654E+01
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           6
Atom Names
wild       C          N          wild      
wild       C          NH1        wild      
wild       C          NH2        wild      
wild       C          NC2        wild      
wild       CR         NC2        wild      
wild       CR         NH1        wild      
Torsion Type Number
           6
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.9057898800E+03
    0.2000000000E+01
    0.3141592654E+01
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
wild       C          OH1        wild      
wild       C          OS         wild      
Torsion Type Number
           7
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.8051465600E+03
    0.3000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
wild       CH1E       CH1E       wild      
wild       CH1E       CH2E       wild      
wild       CH2E       CH2E       wild      
wild       CT         CT         wild      
Torsion Type Number
           8
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.1509649800E+03
    0.3000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           7
Atom Names
wild       CH1E       N          wild      
wild       CH1E       NH1        wild      
wild       CH2E       N          wild      
wild       CH2E       NH1        wild      
wild       CT         N          wild      
wild       CT         NC2        wild      
wild       CT         NH1        wild      
Torsion Type Number
           9
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.9057898800E+03
    0.3000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
wild       CH1E       NH2        wild      
Torsion Type Number
          10
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.3019299600E+03
    0.3000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           5
Atom Names
wild       CH1E       NH3        wild      
wild       CH2E       NH2        wild      
wild       CH2E       NH3        wild      
wild       CT         NH2        wild      
wild       CT         NH3        wild      
Torsion Type Number
          11
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.2516083000E+03
    0.3000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
wild       CH1E       OH1        wild      
wild       CH2E       OH1        wild      
wild       CT         OH1        wild      
Torsion Type Number
          12
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.6038599200E+03
    0.2000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
wild       CH2E       S          wild      
wild       CT         S          wild      
Torsion Type Number
          13
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.2012866400E+04
    0.2000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
wild       S          S          wild      
Torsion Type Number
          14
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.2516083000E+02
    0.4000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
wild       FE         NR         wild      
wild       FE         CM         wild      
Torsion Type Number
          15
Torsion Style
           3
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Number of Torsion Loops
           1
Torsion Coefficients
    0.0000000000E+00
    0.4000000000E+01
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
wild       FE         OM         wild      
Torsion Type Number
          16
Torsion Style
           1
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Torsion Coefficients
    0.5032166000E+05
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           4
Atom Names
CR         NH1        CR1E       NH1       
CR         NR         CR1E       NH1       
CR         CR         CR         NH1       
CR         CR         CR1E       NH1       
Torsion Type Number
          17
Torsion Style
           1
One-Four Nonbond Logical
 T
One-Four Coulombic Scaling
    0.4000000000E+00
Torsion Coefficients
    0.1258041500E+05
    0.0000000000E+00
Torsion Order
wild           
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
          21
Atom Names
NH1        CR1E       NH1        CR1E      
CR1E       NH1        CR1E       CR        
NH1        CR1E       CR         NH1       
CR1E       CR         NH1        CR1E      
CR         NH1        CR1E       NR        
NH1        CR1E       NR         CR1E      
CR1E       NR         CR1E       CR        
NR         CR1E       CR         NH1       
NR         CR1E       NH1        CR1E      
NH1        CR1E       CR         NR        
CR1E       CR         NR         CR1E      
CR         CR1E       CR1E       CR1E      
CR1E       CR1E       CR1E       CR1E      
CR1E       CR         CR1E       CR1E      
CR         CR1E       NH1        CR        
CR         CR         CR         CR1E      
CR1E       CR1E       CR         CR        
CR1E       CR         CR         CR1E      
C          CR1E       CR1E       CR        
CR1E       NH1        CR         CR        
CR1E       C          CR1E       CR1E      
Number of Improper Terms
           8
Improper Type Number
           1
Improper Form
           2
Improper Style
           1
Improper Coefficients
    0.1006433200E+05
    0.0000000000E+00
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           1
Atom Names
FE         wild       wild       NP        
Improper Type Number
           2
Improper Form
           2
Improper Style
           1
Improper Coefficients
    0.4528949400E+05
    0.0000000000E+00
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           9
Atom Names
C          C          CR1E       CH2E      
C          CR1E       C          CH2E      
C          CR1E       CR1E       CH2E      
C          CR1E       NH1        CH2E      
C          NH1        CR1E       CH2E      
C          wild       wild       CH2E      
C          wild       wild       CH3E      
CR         CR1E       CR         CH2E      
CR         wild       wild       CH2E      
Improper Type Number
           3
Improper Form
           2
Improper Style
           1
Improper Coefficients
    0.7548249000E+05
    0.0000000000E+00
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          CR1E       CR1E       OH1       
C          wild       wild       OH1       
Improper Type Number
           4
Improper Form
           2
Improper Style
           1
Improper Coefficients
    0.2264474700E+05
    0.0000000000E+00
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
          13
Atom Names
C          H          H          NH2       
H          wild       wild       O         
N          CH1E       CH2E       C         
N          wild       wild       CH2E      
NH1        wild       wild       CH1E      
NH1        wild       wild       CH2E      
NH1        wild       wild       CH3E      
NH1        wild       wild       H         
NH2        wild       wild       H         
NC2        wild       wild       HC        
N          wild       wild       CT        
NC2        wild       wild       CT        
NH1        wild       wild       CT        
Improper Type Number
           5
Improper Form
           2
Improper Style
           1
Improper Coefficients
    0.5032166000E+05
    0.0000000000E+00
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           6
Atom Names
C          OC         OC         CH1E      
C          OC         OC         CH2E      
C          wild       wild       NH1       
C          wild       wild       O         
C          wild       wild       OC        
CR         wild       wild       NH1       
Improper Type Number
           6
Improper Form
           2
Improper Style
           1
Improper Coefficients
    0.1258041500E+05
    0.0000000000E+00
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
          14
Atom Names
C          wild       wild       C         
C          wild       wild       CR1E      
CR1E       wild       wild       CR1E      
CR1E       wild       wild       NH1       
NH1        wild       wild       NH1       
NH1        wild       wild       NR        
NR         wild       wild       C         
NR         wild       wild       CR1E      
NR         wild       wild       CH3E      
CR         wild       wild       CR        
CR         wild       wild       C         
CR         wild       wild       CR1E      
NR         wild       wild       CR        
NR         wild       wild       CT        
Improper Type Number
           7
Improper Form
           2
Improper Style
           1
Improper Coefficients
    0.3774124500E+05
    0.0000000000E+00
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           2
Atom Names
C          wild       wild       H         
C          wild       wild       HA        
Improper Type Number
           8
Improper Form
           2
Improper Style
           1
Improper Coefficients
    0.2767691300E+05
    0.6154797142E+00
Force Field Name
C19eef1   
Number of Atoms with Same Parameters  
           3
Atom Names
CH1E       wild       wild       CH1E      
CH1E       wild       wild       CH2E      
CH1E       wild       wild       CH3E      
Number of Angle-Angle Terms
           0
Number of One-Five Types
           0
Number of Bond Increments
           0
