%chk=000295278.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295278

0 1
S 5.482991 -0.034576 -0.083897
O -1.174314 1.311546 -0.793932
N -2.673346 0.717373 0.867202
N -0.374613 0.121572 1.045050
C -4.450411 -0.078499 -0.741892
C -3.830412 1.104036 0.014204
C -5.250410 -1.017627 0.169338
C -5.878227 -2.164220 -0.619355
C -1.389120 0.747207 0.263896
C 1.017447 0.114935 0.724743
C 1.884717 -0.487798 1.664203
C 1.525829 0.653733 -0.471355
C 3.748797 -0.017366 0.202169
C 3.251310 -0.552252 1.392817
C 2.895232 0.586125 -0.725416
C 5.691362 -1.468187 -1.170617
H -3.660450 -0.643626 -1.276395
H -5.109745 0.315104 -1.542210
H -4.576945 1.590186 0.681840
H -3.492406 1.882754 -0.714002
H -6.043566 -0.448137 0.693702
H -4.597285 -1.429157 0.962570
H -2.885142 -0.011631 1.546206
H -5.119308 -2.770543 -1.127722
H -6.446367 -2.833511 0.036828
H -6.569006 -1.797111 -1.387591
H -0.615822 -0.236522 1.970963
H 1.502042 -0.900850 2.593122
H 0.854776 1.129867 -1.195765
H 3.924800 -1.017828 2.115281
H 3.292553 1.010986 -1.649931
H 5.139966 -1.349252 -2.108745
H 5.365644 -2.394289 -0.686622
H 6.760130 -1.554344 -1.404089


%chk=000295278-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295278

0 1
S 5.658438 -0.052268 -0.014727
O -1.213726 1.315233 -0.957371
N -2.663410 0.620239 0.737978
N -0.363639 0.229285 0.966849
C -4.615249 -0.027830 -0.736897
C -3.867925 1.088434 0.030531
C -5.195536 -1.136642 0.169906
C -5.973437 -2.207594 -0.625656
C -1.397630 0.758407 0.166798
C 1.026025 0.187653 0.679670
C 1.872196 -0.432725 1.641028
C 1.598288 0.733637 -0.502355
C 3.832269 0.020083 0.247404
C 3.261930 -0.516366 1.425570
C 2.991917 0.646979 -0.701847
C 5.757001 -1.586884 -1.122034
H -3.925790 -0.471179 -1.481253
H -5.440813 0.443889 -1.308585
H -4.546464 1.562292 0.766904
H -3.531947 1.865483 -0.677186
H -5.864895 -0.678268 0.927682
H -4.372105 -1.628322 0.728088
H -2.785580 0.118622 1.618140
H -5.319403 -2.696804 -1.371348
H -6.377825 -2.993371 0.038422
H -6.822805 -1.755154 -1.171087
H -0.628196 -0.171967 1.869024
H 1.442397 -0.851908 2.560609
H 0.950286 1.218581 -1.234221
H 3.906476 -0.993368 2.170976
H 3.433550 1.082905 -1.604557
H 5.170147 -1.425422 -2.039117
H 5.384900 -2.468481 -0.578148
H 6.821256 -1.719071 -1.374595


