%chk=000242525.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242525

0 1
S -1.882897 0.565166 0.825566
S 0.375583 1.455242 2.341003
O 2.102508 -0.878170 -0.194590
O -0.741303 -2.902175 -0.165724
O 0.829751 -0.956234 2.792559
O 0.535562 -4.666258 -1.793860
O 2.648424 -4.516475 1.021268
O 3.453455 -0.582234 1.595707
C 1.264808 -1.809744 0.563889
C 0.607447 -2.619743 -0.569783
C 0.274194 -1.050786 1.480056
C 1.351137 -3.950615 -0.846167
C -0.091114 0.347580 0.979001
C 1.418691 -4.888904 0.370885
C -2.268925 -0.245589 -0.762459
C 0.158831 3.113004 1.621456
C 3.205721 -0.325801 0.441542
C -3.746116 -0.097699 -0.909533
C 1.262810 3.415037 0.668464
C 3.918467 0.553151 -0.514757
C -4.281305 0.930643 -1.702309
C 1.053558 3.302215 -0.716158
C -4.611885 -0.989844 -0.254738
C 2.516321 3.839237 1.143031
C -5.665765 1.059022 -1.841445
C 2.078061 3.624000 -1.610348
C -5.994653 -0.854612 -0.397044
C 3.534865 4.162818 0.244535
C -6.524739 0.167412 -1.191583
C 3.318512 4.059273 -1.134312
H 1.943463 -2.444385 1.197158
H 0.552230 -2.002835 -1.499547
H -0.637731 -1.689613 1.657348
H 2.372021 -3.766415 -1.249279
H 0.429815 0.615121 0.031812
H 0.561590 -4.757123 1.054990
H 1.489373 -5.945255 0.048301
H -1.075480 -3.692567 -0.669675
H 1.797564 -0.698121 2.773032
H 0.820297 -4.478827 -2.710559
H -1.955983 -1.314108 -0.723056
H -1.707435 0.223936 -1.588310
H 0.152235 3.811927 2.485390
H -0.843384 3.209627 1.154977
H 2.649101 -4.829553 1.949910
H 3.652152 0.354457 -1.563752
H 5.010026 0.456091 -0.406077
H 3.666760 1.615863 -0.317237
H -3.619793 1.633749 -2.203726
H 0.085475 2.978075 -1.095247
H -4.204017 -1.781044 0.373426
H 2.693075 3.917003 2.215385
H -6.075982 1.858409 -2.456073
H 1.904622 3.545196 -2.682357
H -6.661646 -1.546024 0.115408
H 4.498987 4.503932 0.619474
H -7.602057 0.270158 -1.300514
H 4.108917 4.326009 -1.831955


%chk=000242525-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242525

0 1
S -2.118211 0.787815 1.318663
S 0.600050 1.562205 2.562587
O 2.340470 -0.896924 0.745787
O -0.524320 -2.911582 -0.366737
O 0.267857 -1.239706 3.247207
O 1.122658 -3.405431 -2.494116
O 3.262553 -3.868809 0.435441
O 3.028574 -1.164725 2.952595
C 1.141253 -1.771965 0.979784
C 0.719424 -2.138212 -0.453423
C 0.025705 -1.095833 1.816056
C 1.777316 -2.964630 -1.231896
C -0.256075 0.375151 1.382806
C 2.226119 -4.258237 -0.539783
C -2.491785 0.029391 -0.412555
C 0.468045 3.156187 1.504476
C 3.251749 -0.758972 1.784045
C -3.968784 0.129031 -0.704615
C 1.217764 3.101247 0.196196
C 4.510646 -0.079068 1.312236
C -4.491947 1.216603 -1.451088
C 0.519034 2.874769 -1.019263
C -4.864322 -0.863861 -0.226715
C 2.626563 3.277330 0.146133
C -5.875917 1.308033 -1.721326
C 1.209092 2.820217 -2.252762
C -6.247851 -0.774417 -0.494248
C 3.317759 3.227857 -1.083691
C -6.758530 0.311600 -1.243895
C 2.611224 2.996079 -2.289060
H 1.479905 -2.669848 1.526642
H 0.541160 -1.200197 -1.027983
H -0.888826 -1.683708 1.623510
H 2.668892 -2.342724 -1.433668
H 0.136429 0.572691 0.368608
H 1.363476 -4.748114 -0.043212
H 2.639185 -4.934603 -1.312245
H -0.619422 -3.361362 -1.252152
H 1.258078 -1.214281 3.408878
H 1.165189 -2.675426 -3.161235
H -2.149988 -1.019518 -0.378840
H -1.891370 0.593026 -1.148861
H 0.872525 3.924015 2.185590
H -0.609843 3.331187 1.355735
H 3.523584 -4.657808 0.972050
H 5.117484 -0.800516 0.735306
H 5.091763 0.271948 2.176968
H 4.259279 0.762322 0.645732
H -3.811264 1.994587 -1.818783
H -0.572894 2.765692 -0.991234
H -4.471179 -1.701397 0.361598
H 3.176475 3.456595 1.078491
H -6.264675 2.153151 -2.300745
H 0.652764 2.656394 -3.183034
H -6.926979 -1.548166 -0.118803
H 4.403033 3.381385 -1.107591
H -7.832178 0.381187 -1.451918
H 3.147485 2.964946 -3.244249


