%chk=000282866.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282866

0 1
S -2.855796 -1.980189 -1.203868
O -3.386301 -1.787592 -2.541945
O -2.771856 -3.311612 -0.626033
O 9.276288 -0.746872 1.269367
O 2.385669 2.215035 -2.384386
O -6.813732 2.295584 2.048702
O -6.286146 0.986576 3.688711
N 5.256275 0.939257 -0.722885
N 2.488987 0.574861 -0.759267
N -6.239494 1.328364 2.519060
C -1.310898 -1.227707 -1.091659
C 6.421569 1.345929 0.124556
C -3.854058 -1.015781 -0.116306
C 7.328129 0.128385 0.339698
C 1.206483 -0.013558 -0.916203
C 4.420395 2.105459 -1.119680
C -0.980207 -0.161212 -1.937434
C -0.362400 -1.706502 -0.178667
C 0.264056 0.455141 -1.853177
C 0.888895 -1.109317 -0.076571
C 8.465009 0.453039 1.309906
C 3.012719 1.647951 -1.513477
C -4.539680 0.093480 -0.612061
C -3.964375 -1.385176 1.224643
C -5.326492 0.869305 0.245863
C -4.746303 -0.621734 2.097576
C -5.412851 0.503368 1.595188
C 10.410311 -0.702870 2.152565
H 6.021660 1.702492 1.101035
H 7.004513 2.186270 -0.312463
H 7.760673 -0.229583 -0.617729
H 6.743916 -0.733107 0.727757
H 4.836189 2.698106 -1.968429
H 4.317138 2.822421 -0.270208
H 5.588566 0.457102 -1.568722
H -1.702733 0.190273 -2.684054
H -0.602577 -2.568085 0.456774
H 0.512619 1.291811 -2.517567
H 1.615286 -1.491962 0.636994
H 9.075069 1.311306 0.980158
H 8.108432 0.619838 2.340395
H 3.123037 0.126959 -0.077078
H -4.480830 0.352607 -1.676387
H -3.455274 -2.282923 1.596306
H -5.871195 1.745002 -0.123226
H -4.844746 -0.893606 3.153922
H 11.087490 0.109567 1.874281
H 10.087738 -0.613394 3.193802
H 10.884431 -1.677606 1.978022


%chk=000282866-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282866

0 1
S -2.771834 -1.838019 -1.268011
O -3.561028 -1.450390 -2.648693
O -2.542072 -3.373415 -0.745300
O 8.434479 -0.922448 2.066216
O 2.514738 2.583722 -2.958866
O -6.590137 1.995989 2.916735
O -5.827578 0.447649 4.408138
N 5.355140 0.956683 -1.241604
N 2.738463 0.715832 -1.517072
N -5.901487 0.948924 3.221819
C -1.080089 -1.010825 -1.329447
C 6.344107 1.314490 -0.189008
C -3.717057 -0.952521 0.132697
C 6.919788 0.043283 0.462845
C 1.443172 0.162862 -1.480928
C 4.698156 2.090134 -1.937213
C -0.910506 0.110014 -2.158324
C -0.033260 -1.590917 -0.593310
C 0.361945 0.710314 -2.231741
C 1.237011 -0.991725 -0.671298
C 7.962298 0.359720 1.540985
C 3.197359 1.827241 -2.208214
C -4.485226 0.174794 -0.200710
C -3.657403 -1.508296 1.420882
C -5.211956 0.809928 0.827649
C -4.384043 -0.875240 2.450578
C -5.138713 0.276175 2.133660
C 9.437494 -0.758482 3.117120
H 5.821096 1.926127 0.571480
H 7.176312 1.938068 -0.593357
H 7.399288 -0.595565 -0.305458
H 6.102034 -0.548462 0.912995
H 5.163215 2.362268 -2.905587
H 4.753511 2.991938 -1.298884
H 5.761306 0.285265 -1.908664
H -1.746588 0.489353 -2.755230
H -0.205976 -2.497171 -0.003883
H 0.540243 1.585484 -2.860028
H 2.075755 -1.420428 -0.110897
H 8.813836 0.937046 1.111761
H 7.513028 0.969550 2.358826
H 3.522358 0.278305 -0.986638
H -4.532315 0.521979 -1.237835
H -3.082297 -2.422769 1.598333
H -5.828470 1.692258 0.638929
H -4.381779 -1.253447 3.475863
H 10.337655 -0.225618 2.742313
H 9.028985 -0.200744 3.986979
H 9.720640 -1.773811 3.435196


