%chk=000181986.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181986

0 1
S 2.284352 1.098937 0.952305
O 2.610610 -0.929029 -0.686424
N 0.690892 -1.058161 0.591861
C 0.186068 -2.318354 -0.073122
C -0.259807 -0.393259 1.520324
C 1.208368 -3.440582 0.116597
C -0.108750 -2.058891 -1.551895
C -1.440433 0.203615 0.786272
C 1.853813 -0.469816 0.142043
C -1.273103 1.330848 -0.030374
C -2.712270 -0.369633 0.928841
C -2.371001 1.878486 -0.699014
C -3.808168 0.183773 0.260227
C 3.920545 1.451260 0.210389
C -3.639642 1.307144 -0.554988
C 3.895748 2.859175 -0.335591
H -0.768861 -2.598661 0.447047
H 0.242076 0.390276 2.136967
H -0.596044 -1.156587 2.263835
H 0.840834 -4.383381 -0.300349
H 2.158412 -3.206454 -0.392020
H 1.444152 -3.605025 1.173283
H -0.827705 -1.240816 -1.683012
H -0.520646 -2.949310 -2.036873
H 0.805057 -1.782591 -2.100664
H -0.286057 1.781498 -0.145804
H -2.853317 -1.244592 1.560175
H -2.237054 2.753731 -1.333115
H -4.794660 -0.262338 0.374850
H 4.685200 1.320236 0.998540
H 4.135660 0.700255 -0.584215
H -4.493367 1.736525 -1.075619
H 3.145478 2.981801 -1.129847
H 3.675059 3.607516 0.437381
H 4.869060 3.125904 -0.772308


%chk=000181986-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181986

0 1
S 2.265020 1.203132 1.291621
O 2.806776 -0.804004 -0.532122
N 0.685510 -0.926906 0.447136
C 0.289592 -2.148072 -0.343874
C -0.300256 -0.445185 1.444433
C 1.153503 -3.370681 0.041178
C 0.282584 -1.878149 -1.864708
C -1.556862 0.158123 0.819141
C 1.927047 -0.364634 0.258075
C -1.455720 1.215785 -0.120953
C -2.839541 -0.315930 1.185677
C -2.618564 1.788430 -0.679277
C -4.006697 0.257635 0.628695
C 3.999779 1.561041 0.617601
C -3.898478 1.311427 -0.306165
C 3.972617 2.467238 -0.619625
H -0.755081 -2.343049 -0.033616
H 0.192078 0.298803 2.095449
H -0.581125 -1.296948 2.094894
H 0.771732 -4.273403 -0.469920
H 2.201562 -3.212312 -0.260540
H 1.122948 -3.551904 1.131128
H -0.359511 -1.012100 -2.103020
H -0.118073 -2.762624 -2.393102
H 1.302396 -1.681236 -2.232276
H -0.464731 1.588786 -0.405997
H -2.927989 -1.134879 1.911275
H -2.530030 2.607769 -1.401673
H -4.993714 -0.118394 0.920577
H 4.538511 2.014394 1.466326
H 4.433359 0.575151 0.381716
H -4.800350 1.757126 -0.740520
H 3.435744 1.972085 -1.446509
H 3.480150 3.432270 -0.406776
H 5.006311 2.674717 -0.958548


