%chk=000265181.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265181

0 1
S -0.235352 -0.588549 -0.576989
S -2.266122 0.211922 1.488324
O -0.806940 -0.121377 -1.841200
O -0.426552 -2.008811 -0.263861
O 6.435401 -0.939425 0.774819
N -0.907118 0.292440 0.667920
N 5.534084 0.826140 -0.410710
C 1.441505 -0.195050 -0.523074
C -3.678000 0.608245 0.490036
C 2.343381 -1.057288 0.110218
C 1.901944 0.988254 -1.110315
C 4.160538 0.442573 -0.425151
C -3.622982 0.775658 -0.891786
C -4.872239 0.833322 1.184638
C -5.975303 1.389005 -0.905043
C 3.701322 -0.749153 0.164434
C 3.254774 1.317417 -1.069447
C -4.771733 1.165275 -1.588878
C -6.018852 1.219371 0.491722
C -2.641610 -1.525060 1.808755
C -7.205604 1.787948 -1.651447
C 6.603134 0.107967 0.189945
C 7.938586 0.776810 0.024827
H 1.982661 -1.990412 0.561684
H 1.197315 1.660012 -1.613977
H -2.689917 0.607481 -1.459048
H -4.920781 0.712292 2.267486
H 4.400936 -1.430357 0.661132
H 3.598324 2.238447 -1.531039
H -4.722462 1.289761 -2.669840
H -6.947462 1.390886 1.030924
H -2.289284 -1.801949 2.807379
H -2.119554 -2.210081 1.105899
H -3.705967 -1.759004 1.737563
H -7.889193 2.394409 -1.042739
H -6.975346 2.372288 -2.553167
H -7.765025 0.898288 -1.979563
H 5.751832 1.706769 -0.884086
H 8.232725 0.879719 -1.028440
H 8.721081 0.170355 0.514275
H 7.974654 1.771766 0.488322


%chk=000265181-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265181

0 1
S -0.294958 -0.424700 -0.586718
S -2.362013 0.237602 1.660281
O -0.831407 0.235694 -1.994408
O -0.544429 -2.036046 -0.365454
O 6.563059 -0.918842 0.984652
N -0.765380 0.589705 0.946438
N 5.677121 0.727577 -0.438421
C 1.546336 -0.077151 -0.505168
C -3.848087 0.652656 0.549780
C 2.361349 -0.914991 0.271268
C 2.050072 0.999617 -1.253017
C 4.290233 0.415666 -0.428529
C -3.725519 0.820764 -0.841960
C -5.073098 0.841015 1.222307
C -6.144207 1.343022 -0.939718
C 3.749725 -0.673264 0.311255
C 3.434791 1.241848 -1.211068
C -4.885814 1.163966 -1.572313
C -6.219298 1.179073 0.467271
C -2.635239 -1.661975 1.854750
C -7.372501 1.709888 -1.753137
C 6.725115 0.085762 0.233678
C 8.102697 0.698250 -0.008745
H 1.923864 -1.756598 0.817399
H 1.375821 1.607968 -1.863345
H -2.763713 0.695364 -1.359336
H -5.143561 0.742212 2.312100
H 4.417130 -1.303732 0.900351
H 3.854319 2.075442 -1.788094
H -4.803759 1.292637 -2.658248
H -7.176093 1.325070 0.981772
H -1.937911 -1.979303 2.642862
H -2.394130 -2.142658 0.896556
H -3.685488 -1.783437 2.158959
H -8.267268 1.814173 -1.116303
H -7.225135 2.665869 -2.289173
H -7.588484 0.940297 -2.517396
H 5.939338 1.529734 -1.015458
H 8.098325 1.561913 -0.696174
H 8.771428 -0.078348 -0.417824
H 8.527568 1.016567 0.958830


