%chk=000127811.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127811

0 1
 P    1.093100       1.023400     -0.7028000    
 P   -1.346000      0.4872000      0.3953000    
 P   0.5793000      -1.446400      0.3660000    
 N    1.588300       2.098300      0.4442000    
 N   -2.763300     -0.1404000     -0.1648000    
 N  -0.5043000       1.061300     -0.8444000    
 N    1.621200     -0.4422000     -0.3238000    
 N  -0.5442000     -0.6525000       1.190600    
 N    1.756200       1.460800      -2.147400    
 N   -1.696500       1.719300       1.432300    
 N    1.404400      -2.419200       1.410500    
 N  -0.1189000      -2.394200     -0.7872000    
 C    3.027400       2.183800      0.6932000    
 C    2.109900       1.544200       1.693900    
 C   -3.656700      0.7775000     -0.8687000    
 C   -2.897600     -0.2814000      -1.613500    
 C    1.446600      0.6506000      -3.314300    
 C   -2.459500       1.407900       2.630200    
 C    2.460900      -3.260000      0.8709000    
 C   -1.100400      -3.378300     -0.3602000    
 H    3.404500       3.173900      0.9089000    
 H    3.678200       1.544900      0.1125000    
 H    2.188800      0.4792000       1.840300    
 H    1.862700       2.107300       2.584700    
 H   -3.341300       1.805600     -0.9797000    
 H   -4.712900      0.6218000     -0.6982000    
 H   -3.443600      -1.156400      -1.942400    
 H   -2.099600      2.5800001E-02  -2.271800    
 H    1.654700       2.442800      -2.403200    
 H  -0.9097000       2.310700       1.699200    
 H    1.752900      -1.969100       2.256500    
 H  -0.4900000      -1.902400      -1.599600    
 H    2.029800      0.9969000      -4.172700    
 H   0.3850000      0.7207000      -3.568400    
 H    1.699800     -0.3993000      -3.140900    
 H   -1.890500      0.7534000       3.296800    
 H   -3.407900      0.9232000       2.382400    
 H   -2.690700       2.330200       3.171400    
 H    2.087200      -3.907600      7.2999999E-02
 H    2.859200      -3.904900       1.659900    
 H    3.281700      -2.652400      0.4788000    
 H  -0.6710000      -4.072800      0.3674000    
 H   -1.432000      -3.966500      -1.221100    
 H   -1.977000      -2.902000      8.5800000E-02


%chk=000127811-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127811

0 1
P 1.039725 1.214985 -0.775542
P -1.485689 0.664836 0.680980
P 0.456447 -1.518602 0.248234
N 2.287147 2.198269 0.077104
N -3.046150 0.336447 -0.153168
N -0.488823 1.753937 -0.200142
N 1.340134 -0.476447 -0.815807
N -0.842523 -0.852542 1.153507
N 1.390331 1.791663 -2.350767
N -2.045749 1.549842 2.034372
N 1.335685 -2.278743 1.524083
N 0.164229 -2.848247 -0.821059
C 3.630285 1.539544 0.327391
C 2.661834 1.769905 1.475997
C -3.502158 1.341483 -1.189680
C -2.981962 -0.023312 -1.616656
C 0.864889 1.174014 -3.571674
C -3.076087 1.071783 2.965919
C 2.518848 -3.122494 1.336327
C -0.556742 -4.064100 -0.425149
H 4.488468 2.204245 0.188465
H 3.751141 0.507778 -0.027690
H 2.172206 0.881808 1.900211
H 2.824935 2.594278 2.176261
H -2.845985 2.202436 -1.370495
H -4.578143 1.541417 -1.180406
H -3.679955 -0.806700 -1.926782
H -1.996886 -0.046196 -2.104462
H 1.736126 2.751512 -2.394582
H -1.468963 2.350141 2.295740
H 1.084730 -1.958326 2.460294
H 0.244909 -2.620642 -1.813265
H 1.568381 1.344044 -4.406347
H -0.133459 1.559625 -3.867219
H 0.795900 0.083509 -3.413021
H -2.648757 0.570242 3.857390
H -3.725350 0.351746 2.441092
H -3.705984 1.917890 3.297653
H 2.517568 -3.508516 0.301937
H 2.489311 -3.989832 2.022590
H 3.470333 -2.576426 1.498151
H -0.405607 -4.231859 0.655616
H -0.152275 -4.939671 -0.966130
H -1.648114 -4.002020 -0.609671


