%chk=000160154.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160154

0 1
 O  -0.9876000       3.498300       1.181400    
 O   -1.305300       3.557400      -1.082600    
 N    2.252100      -1.800400      0.2929000    
 N  -0.6904000      0.4851000      7.6099999E-02
 C    2.186700      0.7287000     -0.2006000    
 C    1.580400     -0.5003000      0.5459000    
 C    2.495100      0.3821000      -1.675300    
 C   0.1069000     -0.6079000      0.3125000    
 C    2.472100      -2.074900      -1.131600    
 C    3.237300     -0.9437000      -1.813000    
 C    3.483400       1.159800      0.5186000    
 C    1.520300      -2.912600      0.9556000    
 C  -0.6265000      -1.760800      0.3547000    
 C    1.209600       1.911600     -0.1870000    
 C   3.3300001E-02  -3.083100      0.5378000    
 C  -0.1275000       1.763300     -6.0800001E-02
 C   -1.977000      -1.385700      0.1639000    
 C   -2.006000      1.4300000E-02 -1.5900001E-02
 C    3.202400       1.525300       1.956800    
 C   -3.181900      -2.118000      0.1073000    
 C   -3.221100      0.6690000     -0.2880000    
 C  -0.8700000       3.028200     -7.7299997E-02
 C   -4.385300      -1.454800     -0.1356000    
 C   -4.401200     -8.1100002E-02 -0.3357000    
 H    1.643900     -0.3420000       1.627700    
 H    3.085600       1.179400      -2.144900    
 H    1.562300      0.3143000      -2.252200    
 H    1.528100      -2.235900      -1.666200    
 H    3.059200      -2.995300      -1.237200    
 H    3.359800      -1.179500      -2.876900    
 H    4.247600     -0.8657000      -1.395300    
 H    3.923800       2.027000      9.3000000E-03
 H    4.242200      0.3698000      0.4975000    
 H    1.558100      -2.734000       2.039000    
 H    2.053600      -3.858900      0.8013000    
 H    1.635100       2.903700     -0.3317000    
 H  -0.4935000      -3.671100       1.297500    
 H  -1.9900000E-02  -3.638300     -0.4063000    
 H    2.328500       2.166200       2.099300    
 H    3.108600      0.6475000       2.602600    
 H    4.061300       2.081700       2.351800    
 H   -3.179100      -3.195900      0.2457000    
 H   -3.263300       1.740400     -0.4508000    
 H   -5.312400      -2.019500     -0.1787000    
 H   -5.344200      0.4218000     -0.5347000    
 H   -1.480400       4.345900       1.213900    


%chk=000160154-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160154

0 1
O -1.990212 2.938208 1.085817
O -0.489493 4.215146 -0.140165
N 2.240738 -1.790344 0.352294
N -0.710808 0.538606 0.193540
C 2.207907 0.732479 -0.159296
C 1.608807 -0.465976 0.656960
C 2.314310 0.337669 -1.677367
C 0.117265 -0.576085 0.460026
C 2.325803 -2.112846 -1.098740
C 3.056910 -1.001429 -1.869833
C 3.618908 1.127103 0.382511
C 1.540288 -2.863021 1.119273
C -0.617820 -1.747115 0.460312
C 1.260082 1.916483 -0.060929
C 0.038764 -3.083602 0.711573
C -0.103272 1.817961 0.085849
C -1.984157 -1.382526 0.124916
C -2.024829 0.050788 -0.056238
C 3.653983 1.668612 1.828806
C -3.160338 -2.147347 -0.071192
C -3.207335 0.702415 -0.463292
C -0.852323 3.090359 0.282799
C -4.345559 -1.493185 -0.462679
C -4.362156 -0.084908 -0.664144
H 1.817724 -0.266801 1.728454
H 2.818571 1.156113 -2.224881
H 1.294472 0.246472 -2.100635
H 1.319373 -2.255096 -1.563102
H 2.871021 -3.071637 -1.188243
H 3.084446 -1.260756 -2.945339
H 4.103034 -0.927544 -1.521089
H 4.038372 1.894401 -0.300121
H 4.278867 0.243372 0.318694
H 1.585447 -2.586026 2.189870
H 2.105046 -3.805405 0.993814
H 1.679027 2.927191 -0.113067
H -0.473643 -3.640432 1.521034
H -0.028539 -3.722720 -0.192844
H 2.979731 2.534330 1.962356
H 3.364151 0.898111 2.565897
H 4.677091 1.996966 2.087940
H -3.142635 -3.234108 0.068349
H -3.245867 1.781742 -0.617409
H -5.262521 -2.071205 -0.622566
H -5.290756 0.403144 -0.980887
H -2.403173 3.833843 1.223768


