%chk=000298312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298312

0 1
S -3.548004 -0.415044 0.756138
S -1.835719 1.793120 0.301735
O -0.017479 -1.048256 -2.096846
O 2.130956 -1.944303 -1.265714
O -0.387564 -0.265480 1.405311
O 3.946874 -0.573953 0.226040
O 2.895777 2.275233 0.930599
C 0.287656 -0.429441 -0.846925
C 1.621944 -1.003614 -0.310160
C -0.888544 -0.695413 0.131695
C 2.699757 0.075221 -0.071367
C -2.133409 0.094618 -0.250252
C 2.400229 0.953732 1.155099
C -4.075839 -1.972600 0.010377
C -2.992208 2.747010 -0.702474
H 0.363467 0.653891 -1.110767
H 1.481897 -1.632001 0.603249
H -1.101718 -1.789717 0.189733
H 2.865493 0.704046 -0.976891
H -2.340793 0.021406 -1.341744
H 1.309531 1.107774 1.313216
H 2.856350 0.525189 2.066625
H 0.087124 -2.032590 -2.033731
H 2.214804 -1.519468 -2.157318
H -1.097177 -0.298093 2.092713
H 4.019761 -1.423739 -0.273486
H 3.878028 2.264307 0.911059
H -4.327329 -1.857892 -1.049300
H -4.984035 -2.299053 0.537812
H -3.324919 -2.761442 0.113842
H -2.761810 2.684896 -1.771120
H -2.903338 3.799281 -0.395243
H -4.032163 2.436173 -0.544105


%chk=000298312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298312

0 1
S -3.619757 -0.414326 0.952083
S -1.966263 2.029836 0.147798
O -0.076183 -0.596909 -2.148257
O 2.062582 -1.897378 -1.337726
O -0.432541 -0.289937 1.536063
O 4.011424 -0.640594 0.184788
O 3.755069 1.850274 1.322926
C 0.281997 -0.219010 -0.769530
C 1.618393 -0.903621 -0.318816
C -0.886606 -0.578477 0.175511
C 2.762271 0.098032 -0.080654
C -2.179879 0.184231 -0.156777
C 2.574783 1.002033 1.149292
C -3.993209 -2.084724 0.145679
C -3.340881 2.626092 -0.994900
H 0.390909 0.877198 -0.808979
H 1.465113 -1.508536 0.588905
H -1.094917 -1.669847 0.065140
H 2.895500 0.729962 -0.989774
H -2.457986 0.024268 -1.212490
H 1.720838 1.686425 1.027530
H 2.396984 0.365697 2.039811
H -0.007109 -1.588171 -2.208108
H 2.160916 -1.411466 -2.201632
H -1.225739 -0.354587 2.135751
H 4.007091 -1.450160 -0.391738
H 4.543460 1.246887 1.291499
H -4.118351 -1.950726 -0.940812
H -4.942601 -2.430744 0.583222
H -3.200887 -2.818886 0.357528
H -3.077007 2.429884 -2.045705
H -3.438415 3.709547 -0.826551
H -4.281398 2.121528 -0.723277


