%chk=000265281.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265281

0 1
S -0.499103 1.426933 -2.184212
S -3.466256 1.519042 1.686446
S 3.799905 -1.017840 0.392357
O 0.968684 3.149613 0.603968
O -1.874518 1.128205 1.178773
O 0.015366 2.240601 2.511989
O 2.535610 -0.018845 -0.147088
O -3.371441 2.099021 2.997131
O -3.965470 2.317072 0.589628
O 4.862544 -0.115461 0.764783
O 3.223057 -1.899606 1.372464
N -2.799806 -0.235323 -2.432708
C -0.135681 1.293347 -0.413897
C -1.150216 2.088721 0.432354
C 1.238457 1.943874 -0.155839
C -0.259650 2.989903 1.345850
C 2.149967 1.061124 0.716586
C 0.590425 3.003338 3.597960
C -4.128941 -0.048780 1.724361
C -1.864986 0.431312 -2.308646
C 4.137510 -1.834860 -1.071035
C -4.170518 -0.763841 2.930409
C -4.621514 -0.634899 0.549139
C -4.702537 -2.050316 2.964820
C -5.153334 -1.922628 0.579481
C 5.099604 -1.325312 -1.953355
C 3.450843 -3.013035 -1.393009
C -5.195220 -2.642318 1.786641
C 5.373254 -1.985484 -3.149631
C 3.720164 -3.677040 -2.588441
C 4.681907 -3.165839 -3.478580
C -5.772532 -4.016305 1.822414
C 4.979888 -3.879539 -4.753061
H -0.138550 0.217670 -0.091115
H -1.846914 2.719298 -0.175383
H 1.772721 2.303522 -1.061154
H -0.607300 4.016962 1.541752
H 3.042200 1.629342 1.047477
H 1.610169 0.658086 1.599308
H 1.515458 3.488757 3.274215
H -0.140886 3.724176 3.975574
H 0.790692 2.226937 4.347056
H -3.786373 -0.307938 3.851216
H -4.594105 -0.083161 -0.400150
H -4.733278 -2.599572 3.904391
H -5.529726 -2.371125 -0.339714
H 5.644778 -0.407996 -1.700411
H 2.703311 -3.419259 -0.701138
H 6.123393 -1.585873 -3.830178
H 3.183669 -4.592546 -2.832628
H -6.853959 -3.978685 2.030709
H -5.649649 -4.550216 0.868975
H -5.318206 -4.645581 2.600940
H 5.306165 -3.198800 -5.552360
H 4.112501 -4.432842 -5.140693
H 5.788927 -4.613692 -4.608037


%chk=000265281-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265281

0 1
S -0.071897 0.193140 -1.877213
S -3.688447 1.530969 1.217950
S 4.794361 -0.714440 0.196818
O 1.002233 2.788652 0.797634
O -1.990637 0.663022 1.135478
O 0.021138 1.735375 2.746658
O 2.952070 -0.305319 0.091751
O -3.723004 2.528933 2.494303
O -3.933714 2.140134 -0.264624
O 5.578761 0.707716 0.181118
O 5.040890 -1.776297 1.390623
N -2.612495 -1.280887 -1.850631
C 0.160616 0.657685 -0.026557
C -0.981907 1.528507 0.546466
C 1.433727 1.547457 0.092857
C -0.237043 2.460288 1.537528
C 2.564035 0.874173 0.892868
C 0.487253 2.588524 3.854090
C -4.712034 0.007185 1.567244
C -1.578735 -0.675349 -1.816582
C 4.930552 -1.567097 -1.460616
C -5.265770 -0.101495 2.852336
C -4.893473 -0.938371 0.544493
C -6.069217 -1.232052 3.117514
C -5.698237 -2.057383 0.845139
C 5.203498 -0.779536 -2.590358
C 4.763279 -2.960002 -1.499815
C -6.298181 -2.219953 2.124011
C 5.314260 -1.440606 -3.832059
C 4.876530 -3.593000 -2.756655
C 5.151142 -2.848634 -3.934820
C -7.174582 -3.424180 2.411436
C 5.298470 -3.545964 -5.273720
H 0.253089 -0.286182 0.530173
H -1.422297 2.158399 -0.253244
H 1.817957 1.869631 -0.891261
H -0.735153 3.428711 1.726015
H 3.414438 1.577906 0.985702
H 2.208163 0.561987 1.890247
H 1.446757 3.077784 3.602009
H -0.274570 3.355130 4.095784
H 0.620688 1.914637 4.713223
H -5.079121 0.667194 3.608682
H -4.418979 -0.834112 -0.436649
H -6.518672 -1.346607 4.109998
H -5.852228 -2.818571 0.072136
H 5.339821 0.302664 -2.500617
H 4.562204 -3.525575 -0.584757
H 5.527239 -0.854188 -4.732828
H 4.747099 -4.679075 -2.821167
H -8.140250 -3.344790 1.876667
H -6.693868 -4.360015 2.074177
H -7.395634 -3.520924 3.487578
H 4.986204 -2.893905 -6.107525
H 4.700087 -4.471959 -5.318055
H 6.354088 -3.827036 -5.454246


