%chk=000264522.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264522

0 1
S -1.848024 -1.034544 -0.000010
S 5.316752 2.095254 0.001007
O 3.753639 -2.638918 0.001122
N 2.768048 1.384694 -0.000964
N 4.387301 -0.414005 0.000269
N 0.824344 -1.632024 0.000321
N 0.365803 0.619811 -0.000671
N -6.851529 -0.191165 0.000426
C 2.057997 -0.955633 0.000047
C 1.747024 0.432910 -0.000555
C 3.403516 -1.478477 0.000364
C 4.104318 0.956631 -0.000422
C -0.153179 -0.650400 -0.000164
C 2.446315 2.833666 -0.001119
C 5.821824 -0.817390 0.001231
C -2.619779 0.615518 -0.000160
C -4.084508 0.333441 0.000043
C -4.784384 0.199921 1.208727
C -4.784681 0.199723 -1.208446
C -6.163228 -0.061051 1.164191
C -6.163515 -0.061240 -1.163529
H 0.723993 -2.634880 0.000738
H 2.870013 3.325239 0.896156
H 1.352139 2.986360 -0.004542
H 2.875581 3.326365 -0.895176
H 6.338218 -0.428210 0.898028
H 6.339529 -0.427893 -0.894679
H 5.901715 -1.921674 0.001071
H -2.287865 1.201981 -0.883808
H -2.287675 1.202243 0.883241
H -4.274761 0.293820 2.165347
H -4.275292 0.293463 -2.165206
H -6.749668 -0.172247 2.084784
H -6.750180 -0.172588 -2.083960


%chk=000264522-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264522

0 1
S -1.808226 -1.306743 0.001056
S 5.273929 2.262564 -0.000415
O 3.907965 -2.682653 0.000786
N 2.714209 1.335378 0.000124
N 4.433561 -0.352649 0.000165
N 0.954140 -1.751582 0.001141
N 0.385753 0.457232 0.000583
N -6.931795 0.090313 -0.000630
C 2.154770 -1.027452 0.000769
C 1.771297 0.318649 0.000503
C 3.515180 -1.475607 0.000613
C 4.087541 1.019415 0.000085
C -0.075662 -0.822656 0.000851
C 2.277147 2.747657 -0.000089
C 5.874962 -0.697486 -0.000146
C -2.576556 0.455298 0.000266
C -4.078479 0.323876 -0.000036
C -4.810681 0.261954 1.212574
C -4.810101 0.261048 -1.212949
C -6.218365 0.148541 1.163983
C -6.217809 0.147675 -1.164946
H 0.885222 -2.769348 0.001442
H 2.672335 3.262244 0.891103
H 1.177190 2.753581 -0.000407
H 2.672952 3.262121 -0.891063
H 6.362542 -0.270748 0.891599
H 6.362160 -0.270680 -0.892062
H 5.946158 -1.794841 -0.000181
H -2.186453 0.956881 -0.897360
H -2.186868 0.957524 0.897713
H -4.296653 0.303748 2.179077
H -4.295609 0.302112 -2.179236
H -6.808475 0.102443 2.086054
H -6.807479 0.100892 -2.087263


