%chk=000206630.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206630

0 1
O -2.875243 -0.240810 1.924434
N -1.512191 -3.107534 -0.872371
C -1.136507 0.514775 0.391745
C -1.377697 1.855893 -0.390215
C -1.541500 -0.684679 -0.496859
C 0.317608 0.369789 0.834357
C -2.882889 2.089684 -0.647368
C -1.334635 -2.051835 0.179281
C -0.750740 3.053853 0.327204
C -2.055814 0.597416 1.629483
C 1.414970 0.407363 -0.106878
C 0.599354 0.168846 2.170885
C -3.125302 3.045149 -1.812449
C 2.746508 0.286882 0.378948
C 1.934241 0.045055 2.647825
C 1.243763 0.545089 -1.522100
C 2.988708 0.111778 1.777839
C -2.119914 -4.341423 -0.291631
C -0.209390 -3.431365 -1.527612
C 3.850402 0.330216 -0.533125
C 2.312551 0.577246 -2.381321
C 3.641065 0.472807 -1.880523
H -0.873744 1.748948 -1.388522
H -2.613205 -0.588904 -0.778342
H -0.984157 -0.650595 -1.454974
H -3.384110 1.120071 -0.860791
H -3.374678 2.484442 0.262595
H -0.346573 -2.101488 0.681836
H -2.099813 -2.171516 0.981275
H -1.164680 3.210436 1.328406
H -0.919135 3.978276 -0.238915
H 0.335393 2.936690 0.435232
H -1.927970 1.511937 2.235119
H -0.186120 0.084038 2.921940
H -4.198309 3.210369 -1.967505
H -2.717763 2.653109 -2.751393
H -2.665922 4.024986 -1.637502
H 2.093588 -0.102669 3.715539
H 0.224403 0.623679 -1.921079
H 4.015712 0.026566 2.128086
H -3.114027 -4.090217 0.113861
H -1.530796 -4.819880 0.503700
H -2.276597 -5.076796 -1.096519
H 0.531139 -3.913068 -0.872513
H 0.238250 -2.506073 -1.924530
H -0.400145 -4.096870 -2.384044
H 4.859174 0.244463 -0.131152
H 2.162448 0.681393 -3.454694
H 4.474189 0.505782 -2.580464


%chk=000206630-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206630

0 1
O -3.047477 -0.075491 1.810668
N -1.619513 -3.217879 -0.805732
C -1.126488 0.503633 0.336224
C -1.433293 1.868835 -0.469449
C -1.540302 -0.732298 -0.527988
C 0.345784 0.381451 0.819345
C -2.963590 2.165804 -0.570891
C -1.316137 -2.110074 0.136937
C -0.671569 3.093438 0.091672
C -2.047211 0.638051 1.563082
C 1.498439 0.439146 -0.068927
C 0.583760 0.132673 2.182827
C -3.317274 3.103442 -1.746399
C 2.833682 0.284294 0.492198
C 1.892821 -0.020170 2.728503
C 1.414719 0.627524 -1.493059
C 3.005048 0.063683 1.897216
C -2.006642 -4.462522 -0.111500
C -0.538386 -3.457742 -1.782729
C 3.984263 0.344174 -0.363329
C 2.551467 0.676670 -2.302987
C 3.855513 0.538909 -1.737597
H -1.089686 1.698144 -1.508034
H -2.613930 -0.664499 -0.775989
H -0.985047 -0.695725 -1.482249
H -3.527554 1.222331 -0.692329
H -3.320636 2.617995 0.376460
H -0.272420 -2.186184 0.531293
H -2.002253 -2.195901 0.997425
H -0.942392 3.295126 1.144956
H -0.921014 3.997794 -0.491927
H 0.421410 2.957847 0.044211
H -1.802946 1.505444 2.227770
H -0.260031 0.026123 2.873310
H -4.407393 3.279678 -1.791980
H -3.007892 2.659550 -2.711831
H -2.825711 4.088950 -1.654998
H 2.009641 -0.207674 3.801214
H 0.439950 0.733440 -1.969708
H 4.019123 -0.048566 2.298419
H -2.869524 -4.266960 0.549018
H -1.185044 -4.902752 0.510787
H -2.309642 -5.222477 -0.855111
H 0.412749 -3.809501 -1.305490
H -0.310761 -2.534525 -2.343102
H -0.860542 -4.222993 -2.512020
H 4.975963 0.228621 0.090552
H 2.441036 0.820777 -3.383519
H 4.740834 0.581688 -2.381014


