%chk=000237644.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237644

0 1
S 6.248206 0.046100 -0.203823
O -5.076253 -1.093039 -0.628485
C 0.141056 -0.408564 -0.375595
C -0.648019 0.794075 0.216515
C -2.081155 0.739152 -0.323741
C -2.785361 -0.579032 0.115325
C 1.587838 -0.453293 0.226879
C -0.591314 -1.758738 -0.202357
C -2.078492 -1.736768 -0.595880
C -3.080966 1.849935 0.054271
C 0.039384 2.111992 -0.187314
C 2.227682 0.931047 0.148504
C 2.414711 -1.470582 -0.607031
C -4.241643 -0.288513 -0.304911
C -4.460157 1.220738 -0.231783
C 1.524935 2.058723 -0.022760
C -2.837290 -0.807001 1.632459
C 1.562588 -0.869117 1.710196
C 3.722573 0.996907 0.353404
C 3.919019 -1.428428 -0.309666
C 4.445506 -0.014937 -0.530434
H 0.245142 -0.223020 -1.474316
H -0.654707 0.719855 1.328684
H -2.012931 0.733127 -1.444585
H -0.505035 -2.094385 0.852365
H -0.075688 -2.530821 -0.805512
H -2.188861 -1.640401 -1.692408
H -2.555262 -2.701500 -0.336229
H -2.918986 2.765292 -0.535399
H -2.983882 2.139085 1.113962
H -0.377346 2.945287 0.413591
H -0.192504 2.361796 -1.244812
H 2.251592 -1.274813 -1.685210
H 2.035840 -2.493700 -0.423155
H -4.892918 1.587533 -1.179571
H -5.203147 1.465275 0.546432
H 2.014083 3.032012 -0.063225
H -3.280619 0.041665 2.164140
H -3.427118 -1.700344 1.873079
H -1.832363 -0.958633 2.045739
H 1.048527 -0.118249 2.321074
H 1.043004 -1.823916 1.851990
H 2.574845 -0.982722 2.111242
H 4.105855 2.019538 0.151849
H 3.933765 0.813668 1.428635
H 4.105318 -1.767722 0.728014
H 4.449019 -2.150764 -0.962511
H 4.341754 0.274350 -1.606169
H 6.268471 -0.338352 1.089037


%chk=000237644-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237644

0 1
S 6.398896 0.100729 -0.362816
O -5.128865 -1.104997 -0.743655
C 0.132107 -0.426032 -0.280135
C -0.659167 0.808517 0.267399
C -2.107645 0.749038 -0.252867
C -2.845663 -0.569398 0.117719
C 1.610873 -0.474121 0.268604
C -0.627067 -1.774730 -0.084988
C -2.110370 -1.750312 -0.546442
C -3.119338 1.869846 0.109331
C 0.035153 2.115916 -0.179474
C 2.258046 0.923018 0.175949
C 2.440335 -1.460136 -0.626173
C -4.270885 -0.264209 -0.383240
C -4.475822 1.269630 -0.361653
C 1.540278 2.058857 -0.039867
C -3.002341 -0.795316 1.655914
C 1.656239 -0.949265 1.755464
C 3.773930 0.996589 0.351096
C 3.968213 -1.422032 -0.380142
C 4.505288 0.004793 -0.579575
H 0.217912 -0.257945 -1.379052
H -0.662205 0.780571 1.376827
H -2.032611 0.747538 -1.367010
H -0.594551 -2.070029 0.980229
H -0.100750 -2.574240 -0.640176
H -2.162389 -1.636737 -1.648161
H -2.600682 -2.711382 -0.301607
H -2.890880 2.826314 -0.391552
H -3.124836 2.062263 1.198822
H -0.358616 2.973621 0.402663
H -0.228726 2.330172 -1.239800
H 2.250290 -1.210444 -1.690777
H 2.077650 -2.493706 -0.469428
H -4.730194 1.591837 -1.390105
H -5.341821 1.533660 0.271802
H 2.078518 3.015647 -0.118039
H -3.529780 0.039196 2.152129
H -3.588116 -1.715552 1.830996
H -2.023320 -0.911271 2.149654
H 0.944944 -0.374656 2.375746
H 1.408762 -2.022648 1.847224
H 2.658697 -0.807521 2.194909
H 4.129535 2.025353 0.163769
H 4.053338 0.750128 1.397868
H 4.203007 -1.761624 0.648714
H 4.478620 -2.118860 -1.070125
H 4.370530 0.311539 -1.634176
H 6.394175 -0.287811 0.968713


