%chk=000218171.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218171

0 1
S -0.887246 0.977392 1.957414
S 3.717404 0.346590 0.879953
S 3.574100 -1.693283 1.103867
O 2.671370 -1.712807 2.503332
O 2.757637 -2.198536 0.043809
O 4.822178 -2.274997 1.470294
N 1.171463 2.144446 -0.385315
N 0.696015 -0.212038 -0.848617
C -2.676635 0.714054 1.755530
C -0.591393 2.634419 1.279825
C -2.968983 0.376991 0.332707
C -0.222578 2.576191 -0.202085
C -2.697834 -0.911457 -0.157795
C -3.512328 1.344649 -0.527808
C 1.520204 0.909237 -0.600366
C 3.002727 0.657757 -0.761330
C -2.954766 -1.219930 -1.495469
C -3.769006 1.028324 -1.864675
C -3.488881 -0.251631 -2.352305
H -1.460358 3.293479 1.446703
H 0.249746 3.061211 1.871777
H -3.247070 1.590894 2.114400
H -2.941528 -0.119314 2.441745
H -0.264255 3.611525 -0.627983
H -0.964580 1.981595 -0.781348
H -2.287222 -1.672236 0.504608
H -3.737268 2.342181 -0.156833
H 3.514850 1.570130 -1.156342
H 3.217336 -0.155052 -1.485683
H -2.737377 -2.218736 -1.872739
H -4.189446 1.782683 -2.528417
H -3.685485 -0.494519 -3.394613
H -0.247230 -0.182507 -0.470248
H 1.113806 -1.138413 -0.758823
H 3.001232 -2.269791 3.233128


%chk=000218171-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218171

0 1
S -1.113501 1.555995 2.190928
S 3.750967 0.295602 1.313019
S 3.711912 -2.162438 0.721319
O 2.903343 -2.773399 2.287209
O 2.611015 -2.261233 -0.486268
O 5.072490 -3.026002 0.541622
N 1.208126 2.397139 -0.201332
N 0.817845 0.001330 -0.406384
C -2.920639 1.104862 1.737541
C -0.832477 3.066460 1.084789
C -3.081820 0.507918 0.358668
C -0.216189 2.757408 -0.303331
C -2.628350 -0.811088 0.082485
C -3.686350 1.252115 -0.687195
C 1.594426 1.136143 -0.309970
C 3.088080 0.892566 -0.344865
C -2.765886 -1.364929 -1.209250
C -3.824590 0.699358 -1.981878
C -3.361500 -0.609080 -2.248003
H -1.805386 3.577518 0.970726
H -0.150426 3.718893 1.654586
H -3.525931 2.017038 1.869799
H -3.188715 0.387356 2.531849
H -0.263281 3.704807 -0.878633
H -0.847371 2.017500 -0.841425
H -2.172154 -1.403254 0.885748
H -4.055879 2.265464 -0.485994
H 3.615312 1.836660 -0.562204
H 3.352538 0.140017 -1.110622
H -2.412858 -2.383308 -1.406011
H -4.294253 1.287638 -2.778074
H -3.466698 -1.038310 -3.250216
H -0.186519 0.033552 -0.221221
H 1.281538 -0.919588 -0.470717
H 3.291777 -3.682210 2.463603


