%chk=000287799.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287799

0 1
O -2.101914 1.758643 -0.804627
N -0.464385 0.478035 0.161590
N 2.437493 0.012078 0.570118
N -2.651848 -0.445688 -0.396831
N 4.675010 0.885980 0.655781
N 4.011527 -0.635491 -1.126393
C 0.093996 -0.857312 0.529038
C -0.800498 -1.998968 0.016010
C 1.527643 -1.023035 -0.025154
C 0.545532 1.519383 -0.189389
C -2.271099 -1.691650 0.321094
C 1.778813 1.353325 0.711849
C -1.763547 0.662693 -0.369904
C -4.106969 -0.132149 -0.453560
C 3.747740 0.047591 -0.053561
C -4.720304 0.194490 0.906475
H 0.124456 -0.880197 1.653593
H -0.504316 -2.956809 0.482108
H -0.667957 -2.138300 -1.077889
H 1.939818 -2.017670 0.256218
H 1.522480 -0.991607 -1.140781
H 0.076763 2.521933 -0.038454
H 0.825255 1.458414 -1.265366
H -2.923497 -2.517374 -0.040257
H -2.434446 -1.599668 1.418002
H 2.488868 2.185154 0.511498
H 1.481157 1.431680 1.784798
H -4.233469 0.738088 -1.146492
H -4.620219 -1.000379 -0.921120
H -4.666076 -0.646307 1.604356
H -4.213208 1.049153 1.375376
H -5.776679 0.468941 0.801394
H 5.650953 0.638455 0.554062
H 4.450664 1.093394 1.622164
H 4.960658 -0.680224 -1.479248


%chk=000287799-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287799

0 1
O -2.203508 1.990822 -0.528248
N -0.398996 0.521803 -0.324888
N 2.442174 0.147845 -0.088523
N -2.634629 -0.267022 -0.062466
N 4.360564 0.863189 1.096857
N 3.996482 -1.484397 0.600829
C 0.163215 -0.819655 -0.009293
C -0.807057 -1.893977 -0.526701
C 1.574773 -0.923544 -0.616141
C 0.534433 1.581029 -0.749155
C -2.187409 -1.664238 0.112616
C 1.855872 1.500470 0.034375
C -1.769828 0.808277 -0.311768
C -4.079332 0.009508 0.063412
C 3.637011 -0.211857 0.552193
C -4.600720 -0.103241 1.513351
H 0.260792 -0.933203 1.093435
H -0.438951 -2.900790 -0.258520
H -0.877795 -1.831783 -1.629006
H 2.052851 -1.877530 -0.336397
H 1.509709 -0.875669 -1.722341
H 0.039921 2.550849 -0.575585
H 0.745421 1.508176 -1.836567
H -2.942323 -2.327824 -0.354010
H -2.144858 -1.931126 1.190603
H 2.536412 2.270051 -0.389156
H 1.665809 1.758427 1.099295
H -4.238831 1.031489 -0.317595
H -4.630712 -0.695007 -0.592979
H -4.447464 -1.115952 1.930011
H -4.086609 0.624039 2.165972
H -5.684762 0.112607 1.544081
H 5.232289 0.668140 1.578933
H 4.075376 1.833442 0.997349
H 4.909076 -1.638745 1.062524


