%chk=000091882.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091882

0 1
 O   -1.609300     -0.6130000       1.699100    
 N   -2.277400     -0.7992000     -0.5230000    
 C  -0.2149000      0.3296000     -1.1100000E-02
 C   0.4757000     -0.4897000      -1.148200    
 C   0.6653000      0.7047000       1.204600    
 C  -0.7506000       1.656200     -0.6030000    
 C    1.969400     -0.1530000      -1.347100    
 C    1.611300     -0.3734000       1.728100    
 C    2.953700     -0.8605000     -0.4157000    
 C    2.963500     -0.3646000       1.023500    
 C   -1.436000     -0.4015000      0.5017000    
 C   0.2444000      -2.009700      -1.090600    
 C   -1.491500       2.442300      0.4682000    
 C   0.3972000       2.466900      -1.186000    
 C   -3.500900      -1.535100     -0.3006000    
 H   4.3000001E-03 -0.1930000      -2.097700    
 H   3.3700000E-02  0.9824000       2.059700    
 H    1.276400       1.593900       1.044000    
 H   -1.463200       1.476100      -1.417900    
 H    2.205900      0.9072000      -1.312600    
 H    2.229900     -0.4651000      -2.368800    
 H    1.154400      -1.366600       1.701800    
 H    1.802600     -0.1611000       2.788500    
 H    3.964500     -0.7214000     -0.8213000    
 H    2.786300      -1.942900     -0.4234000    
 H    3.655300     -0.9969000       1.594500    
 H    3.387800      0.6470000       1.054200    
 H  -0.7329000      -2.314600      -1.470800    
 H   0.9592000      -2.526000      -1.743300    
 H   0.3701000      -2.418400     -8.4899999E-02
 H  -0.8348000       2.831800       1.252200    
 H   -1.955300       3.324500      8.6000003E-03
 H   -2.310000       1.889000      0.9363000    
 H    1.242000       2.676300     -0.5311000    
 H   1.1200000E-02   3.459600      -1.458000    
 H   0.7435000       2.057400      -2.139200    
 H   -2.083700     -0.5319000      -1.482100    
 H   -3.606400      -2.276600      -1.096000    
 H   -4.335400     -0.8310000     -0.3439000    
 H   -3.486700      -2.030300      0.6734000    


%chk=000091882-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091882

0 1
O -1.448468 -1.045149 1.588536
N -2.448784 -0.673469 -0.461175
C -0.181338 0.342439 -0.054523
C 0.582480 -0.468927 -1.200296
C 0.690190 0.659340 1.202553
C -0.752237 1.705673 -0.653423
C 2.116590 -0.169228 -1.309177
C 1.618748 -0.450657 1.762655
C 3.059028 -0.945412 -0.355025
C 3.023885 -0.482683 1.118833
C -1.401529 -0.509227 0.437275
C 0.354161 -2.006769 -1.183788
C -1.576415 2.510102 0.384500
C 0.301028 2.636821 -1.307243
C -3.631027 -1.486401 -0.152866
H 0.141356 -0.107830 -2.157171
H -0.007085 0.951653 2.007117
H 1.317381 1.547360 0.988193
H -1.444879 1.430255 -1.479766
H 2.306313 0.913156 -1.190653
H 2.410924 -0.421627 -2.349694
H 1.122862 -1.434828 1.692494
H 1.746854 -0.261072 2.847079
H 4.095972 -0.834231 -0.733485
H 2.832564 -2.027631 -0.407674
H 3.683687 -1.147310 1.713469
H 3.464436 0.535019 1.189191
H -0.696792 -2.267267 -1.394456
H 0.981442 -2.484894 -1.960132
H 0.616841 -2.459337 -0.213082
H -0.923055 2.943997 1.162586
H -2.101446 3.347398 -0.112206
H -2.334452 1.883615 0.887700
H 1.075349 2.956583 -0.586755
H -0.201329 3.551600 -1.674630
H 0.804203 2.166438 -2.169448
H -2.388338 -0.231292 -1.378355
H -3.706234 -2.364764 -0.822188
H -4.559939 -0.892394 -0.238059
H -3.524346 -1.839651 0.885190


