%chk=000274349.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274349

0 1
S 1.906722 0.718321 0.081453
O 1.246696 -0.215024 -1.154453
O 1.028498 0.582798 1.224776
O 2.138129 2.025222 -0.483044
C -1.758315 -0.051042 -0.046880
C -1.177171 -0.570388 -1.388107
C 0.059149 0.244273 -1.827358
C -2.937204 -0.862371 0.452110
C -2.164417 1.407767 -0.142864
C -0.819720 -2.055765 -1.306604
C -3.024215 -1.149575 1.824788
C -1.532914 2.347358 0.687091
C -3.948685 -1.318047 -0.407234
C -3.155386 1.836675 -1.038284
C -4.103133 -1.881374 2.325672
C -1.885385 3.696884 0.617168
C -5.025916 -2.051425 0.097803
C -3.505918 3.188053 -1.104613
C 3.366493 -0.143313 0.318921
C -5.106657 -2.336057 1.464002
C -2.871738 4.121421 -0.279234
C 4.509402 0.196754 -0.416453
C 3.421222 -1.190044 1.248415
C 5.757517 -1.556458 0.704668
C 5.699287 -0.503926 -0.226666
C 4.608270 -1.894311 1.442150
C 7.024267 -2.318611 0.898146
H -0.927971 -0.140189 0.718288
H -1.951761 -0.430906 -2.185585
H -0.075873 1.332807 -1.686519
H 0.295226 0.047092 -2.892646
H -0.476415 -2.436550 -2.274212
H -0.005033 -2.224753 -0.589818
H -1.673129 -2.664732 -0.987667
H -2.249154 -0.794081 2.503319
H -0.756813 2.019693 1.387191
H -3.898721 -1.101454 -1.472207
H -3.664248 1.116863 -1.675445
H -4.163013 -2.096328 3.391085
H -1.386778 4.419397 1.261227
H -5.805901 -2.399947 -0.576466
H -4.277235 3.513198 -1.799796
H -5.946037 -2.905254 1.855237
H -3.144347 5.172505 -0.333006
H 4.472302 1.020845 -1.138834
H 2.530664 -1.452977 1.831534
H 6.584076 -0.235097 -0.801342
H 4.644447 -2.707163 2.165553
H 7.128253 -2.713580 1.918800
H 7.066027 -3.182474 0.215057
H 7.918354 -1.710808 0.698983


%chk=000274349-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274349

0 1
S 1.865774 0.547200 0.376721
O 1.201077 -0.570745 -0.963271
O 1.079071 0.275492 1.772562
O 1.958709 2.052904 -0.219857
C -1.891010 -0.156548 -0.038836
C -1.283970 -0.733597 -1.362277
C 0.045440 -0.044528 -1.744053
C -3.165709 -0.882979 0.422888
C -2.159366 1.359268 -0.143927
C -1.093750 -2.267794 -1.320173
C -3.351564 -1.137452 1.805677
C -1.537737 2.258184 0.759370
C -4.197110 -1.270350 -0.472253
C -3.038805 1.889938 -1.125363
C -4.530180 -1.751919 2.284807
C -1.784938 3.648226 0.684868
C -5.377171 -1.885909 0.000184
C -3.285328 3.277542 -1.204151
C 3.560680 -0.237268 0.465414
C -5.551358 -2.128125 1.382518
C -2.658751 4.164864 -0.297438
C 4.555401 0.241534 -0.401668
C 3.770849 -1.255621 1.407672
C 6.104715 -1.387443 0.616427
C 5.835839 -0.345152 -0.311161
C 5.060954 -1.825364 1.474495
C 7.477012 -2.031251 0.677109
H -1.131078 -0.302338 0.754802
H -1.975768 -0.486242 -2.196997
H -0.004603 1.058090 -1.645819
H 0.320282 -0.288754 -2.787877
H -0.652087 -2.632334 -2.266605
H -0.407849 -2.547986 -0.501985
H -2.052639 -2.787459 -1.161704
H -2.564374 -0.845076 2.511673
H -0.849767 1.867130 1.517657
H -4.081060 -1.103132 -1.549979
H -3.550937 1.218831 -1.825418
H -4.650712 -1.937050 3.358430
H -1.287353 4.324855 1.388725
H -6.159944 -2.178012 -0.709593
H -3.969470 3.666899 -1.967250
H -6.467171 -2.604936 1.749699
H -2.849779 5.242354 -0.357617
H 4.342397 1.053460 -1.103954
H 2.963395 -1.574698 2.073830
H 6.635432 0.011107 -0.970247
H 5.257855 -2.620020 2.202745
H 7.703966 -2.410878 1.688128
H 7.536412 -2.891140 -0.017936
H 8.271878 -1.321875 0.389107


