%chk=000201335.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201335

0 1
S -1.392937 -1.779120 0.312922
O 0.422519 1.572491 0.888429
N -4.881200 2.627576 -0.504388
C 5.082983 0.246366 0.392855
C 6.177154 -0.302200 -0.532832
C 3.742211 0.379175 -0.341976
C 7.517808 -0.433886 0.201952
C 2.653087 0.926014 0.586487
C 8.614085 -0.982723 -0.722122
C 1.322603 1.062965 -0.149369
C 9.950833 -1.115476 0.004223
C -0.880671 1.788213 0.443799
C -1.874347 0.845154 0.783141
C -1.507540 -0.404977 1.502759
C -1.190479 2.977014 -0.227600
C -3.200685 1.123832 0.441354
C -3.522517 2.317764 -0.237536
C -2.511757 3.244618 -0.574911
C -3.071148 -2.124251 -0.106871
C -3.968917 -2.575968 0.862855
C -3.450298 -1.994847 -1.444552
C -5.275171 -2.900721 0.482690
C -4.756707 -2.331177 -1.817333
C -5.667589 -2.780164 -0.855410
H 4.966336 -0.416805 1.271998
H 5.390057 1.230304 0.797420
H 6.293759 0.360088 -1.412229
H 5.870778 -1.287019 -0.935467
H 3.435815 -0.606425 -0.744527
H 3.860019 1.043082 -1.220446
H 7.825893 0.549669 0.605743
H 7.403218 -1.096155 1.081568
H 2.947792 1.910020 1.003889
H 2.521121 0.266558 1.467952
H 8.308296 -1.968308 -1.124550
H 8.731281 -0.320154 -1.601888
H 1.358705 1.793306 -0.973119
H 0.926591 0.099650 -0.512340
H 10.301946 -0.149038 0.383381
H 10.726658 -1.507802 -0.662589
H 9.879128 -1.796044 0.860260
H -2.212283 -0.641811 2.320757
H -0.494665 -0.317871 1.965977
H -0.396767 3.685470 -0.459861
H -3.986500 0.417486 0.703066
H -2.762536 4.170568 -1.084855
H -5.511385 1.839283 -0.554099
H -5.045275 3.285439 -1.252804
H -3.660171 -2.685663 1.902113
H -2.741793 -1.636194 -2.192245
H -5.985251 -3.254329 1.228502
H -5.062704 -2.242919 -2.858322
H -6.683487 -3.040357 -1.148353


%chk=000201335-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201335

0 1
S -1.212432 -1.559012 0.976029
O 0.278191 1.689124 0.922608
N -4.990927 2.848702 -0.809464
C 5.007072 0.145720 0.381574
C 6.116995 -0.350392 -0.572342
C 3.666769 0.424717 -0.335441
C 7.460782 -0.623069 0.140427
C 2.564617 0.923340 0.627339
C 8.571652 -1.114952 -0.815588
C 1.243678 1.194468 -0.094602
C 9.912497 -1.381092 -0.097622
C -1.026963 1.966313 0.438265
C -2.110981 1.179628 0.921865
C -1.853006 0.039406 1.864647
C -1.273297 3.037150 -0.447696
C -3.425256 1.493375 0.504659
C -3.684016 2.561723 -0.399511
C -2.584655 3.334913 -0.870534
C -2.779655 -2.156917 0.205261
C -3.542334 -3.152045 0.863857
C -3.199542 -1.658044 -1.051822
C -4.724577 -3.647286 0.265513
C -4.385389 -2.152720 -1.644173
C -5.148614 -3.147187 -0.988425
H 4.844514 -0.608175 1.179674
H 5.348318 1.070358 0.892274
H 6.274436 0.401653 -1.374030
H 5.776741 -1.277720 -1.079258
H 3.324883 -0.501297 -0.842898
H 3.831661 1.177166 -1.135238
H 7.801421 0.303115 0.649340
H 7.306456 -1.377409 0.940302
H 2.893437 1.852942 1.131635
H 2.388781 0.171713 1.420998
H 8.231751 -2.041369 -1.322305
H 8.722436 -0.361334 -1.615662
H 1.376517 1.960596 -0.887447
H 0.834618 0.270191 -0.551491
H 10.287099 -0.463440 0.394339
H 10.689746 -1.727268 -0.803781
H 9.796689 -2.155734 0.683932
H -2.753447 -0.264068 2.420667
H -1.028426 0.261549 2.559355
H -0.435213 3.654005 -0.791260
H -4.260357 0.888068 0.879419
H -2.760912 4.172954 -1.556004
H -5.773924 2.296309 -0.474308
H -5.180679 3.622538 -1.438424
H -3.203170 -3.536634 1.831503
H -2.601170 -0.893465 -1.556701
H -5.308192 -4.422335 0.775047
H -4.705996 -1.765118 -2.617790
H -6.062732 -3.533951 -1.453213


