%chk=000291235.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291235

0 1
S 2.113033 -1.554231 1.256953
O 0.458632 -1.604358 0.630641
O 2.472624 -2.915973 0.943908
O 2.038461 -1.152970 2.634835
N -0.026942 -0.323297 0.683496
C -3.311474 0.958654 -0.092407
C -3.534763 -0.477176 -0.342332
C -1.952236 1.140308 0.328883
C -2.311014 -1.173888 -0.073864
C -1.276111 -0.191101 0.350032
C 2.915395 -0.435600 0.261996
C 3.068933 -0.725101 -1.116553
C 3.420511 0.782364 0.767834
C -4.161847 2.044813 -0.198603
C -4.658796 -1.169331 -0.755425
C -1.464897 2.396553 0.637596
C -2.226272 -2.546313 -0.214438
C 4.281501 1.358273 -1.435584
C 3.754702 0.162868 -1.949687
C 4.106052 1.663484 -0.080573
C -3.659225 3.324181 0.116945
C -4.566124 -2.569704 -0.900856
C -2.339950 3.497215 0.526427
C -3.377628 -3.244306 -0.635531
C 2.496399 -1.967216 -1.705153
C 3.246015 1.169342 2.193672
C 5.012598 2.293197 -2.339328
H -5.194639 1.922651 -0.515649
H -5.594143 -0.656079 -0.962644
H -0.433764 2.535263 0.959841
H -1.294630 -3.074363 0.000505
H 3.877741 -0.069518 -3.004913
H 4.501683 2.594394 0.318938
H -4.320564 4.186553 0.037821
H -5.445127 -3.126396 -1.224705
H -1.971156 4.493239 0.767537
H -3.327985 -4.326579 -0.749546
H 1.399340 -2.015402 -1.583907
H 2.699588 -2.074739 -2.778065
H 2.892428 -2.882515 -1.216268
H 3.703290 0.442276 2.890363
H 3.666023 2.152889 2.435738
H 2.178711 1.189736 2.489784
H 5.846733 1.788393 -2.850037
H 4.348115 2.685621 -3.124742
H 5.435181 3.159791 -1.813333


%chk=000291235-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291235

0 1
S 2.294964 -1.831331 1.344358
O 0.350085 -1.848832 0.657673
O 2.844776 -3.297697 0.940995
O 2.238600 -1.431433 2.908542
N -0.048505 -0.510706 0.655791
C -3.247945 0.974045 -0.144047
C -3.573791 -0.457635 -0.331596
C -1.875359 1.074694 0.250357
C -2.399176 -1.233291 -0.052520
C -1.311545 -0.297675 0.316490
C 3.009957 -0.442101 0.244313
C 3.161555 -0.759162 -1.134081
C 3.357986 0.800392 0.834227
C -4.029235 2.136779 -0.287831
C -4.769929 -1.095820 -0.707294
C -1.278440 2.323123 0.499211
C -2.416509 -2.639280 -0.144632
C 4.168330 1.491163 -1.412944
C 3.757103 0.241400 -1.937645
C 3.955479 1.747374 -0.040001
C -3.429795 3.396368 -0.035857
C -4.787267 -2.511024 -0.802193
C -2.069450 3.489789 0.353159
C -3.626441 -3.273941 -0.523458
C 2.721843 -2.061359 -1.776397
C 3.134677 1.191496 2.281893
C 4.801964 2.533575 -2.314144
H -5.081219 2.077987 -0.588115
H -5.676055 -0.518876 -0.922249
H -0.227031 2.387138 0.797352
H -1.518831 -3.222495 0.076788
H 3.893246 0.032014 -3.005443
H 4.248677 2.717087 0.378797
H -4.024604 4.310396 -0.142686
H -5.711699 -3.022620 -1.092908
H -1.627691 4.474197 0.542895
H -3.664760 -4.365940 -0.599833
H 1.679458 -2.314275 -1.512039
H 2.793211 -1.981179 -2.873160
H 3.343564 -2.908969 -1.440832
H 3.709276 0.557681 2.979249
H 3.436499 2.241084 2.433008
H 2.076205 1.078125 2.572580
H 5.687817 2.125228 -2.834541
H 4.092878 2.867017 -3.095028
H 5.121527 3.423393 -1.746603


