%chk=000201162.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201162

0 1
S -1.722319 -2.040536 -0.312061
O -2.887473 -2.731312 -0.849147
O -0.534995 -1.936876 -1.142377
O -0.281782 2.256458 -2.087442
N 2.251727 0.516570 -0.353189
N 0.792055 -0.334536 1.206967
N 0.797834 1.837085 -1.811990
C -1.366397 0.615317 0.399519
C 0.093635 0.432038 0.304064
C -2.252645 -0.436253 0.144902
C 0.959433 1.006864 -0.675515
C 2.116022 -0.297750 0.810759
C -1.853140 1.885576 0.748251
C -3.630361 -0.205394 0.216424
C 3.478585 0.715469 -0.974135
C -1.303625 -2.806132 1.200323
C 3.276408 -0.907795 1.356949
C -3.231310 2.099916 0.832386
C -4.122452 1.055581 0.565134
C 4.588094 0.110483 -0.428064
C 4.487103 -0.701829 0.740224
H -1.158035 2.702441 0.940829
H -4.332132 -1.017893 -0.017060
H 3.498390 1.341662 -1.874874
H -2.175406 -3.085346 1.804325
H -0.732861 -3.734919 1.054433
H -0.660705 -2.182056 1.846353
H 3.162207 -1.526831 2.248550
H -3.611000 3.086919 1.100256
H -5.196947 1.225631 0.618392
H 5.564854 0.245636 -0.895382
H 5.395837 -1.161587 1.134197


%chk=000201162-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201162

0 1
S -1.762852 -2.249655 -0.100707
O -3.177457 -3.018879 -0.417935
O -0.558483 -2.282463 -1.203130
O 0.017983 3.033956 -1.658792
N 2.304287 0.661979 -0.283544
N 0.715955 -0.500035 0.890406
N 1.106803 2.352733 -1.445479
C -1.372383 0.679389 0.261729
C 0.091857 0.515173 0.206162
C -2.277299 -0.415110 0.266429
C 1.054516 1.300021 -0.536829
C 2.057872 -0.416824 0.594211
C -1.945624 1.978947 0.356745
C -3.667060 -0.261511 0.366800
C 3.564206 0.970919 -0.755829
C -1.140386 -2.982613 1.550687
C 3.145889 -1.214805 1.020898
C -3.338542 2.155632 0.487461
C -4.204251 1.040158 0.497932
C 4.637291 0.184835 -0.346076
C 4.430236 -0.912417 0.549697
H -1.286012 2.848879 0.318870
H -4.305265 -1.149784 0.294372
H 3.626179 1.821450 -1.436945
H -1.996209 -2.948154 2.238798
H -0.851687 -4.013380 1.300034
H -0.299110 -2.344382 1.850525
H 2.952420 -2.049237 1.698043
H -3.746482 3.168643 0.564180
H -5.287322 1.176201 0.582058
H 5.636090 0.417974 -0.721967
H 5.283436 -1.521038 0.863199


