%chk=000246230.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246230

0 1
Cl -7.343648 0.055046 -0.835543
S 1.386787 0.374634 0.078856
N -3.581180 0.733114 0.404418
N -1.554478 1.821169 0.328736
N -2.738631 -1.624675 0.204700
N -0.298025 -1.713385 0.059070
C -2.605698 -0.259895 0.279952
C -5.036596 0.518589 0.451917
C -1.336509 0.439099 0.241150
C -2.880632 1.981887 0.416733
C -0.182375 -0.370404 0.128515
C -5.564242 0.145654 -0.936746
C 2.537323 -1.032322 -0.064371
C 3.885096 -0.394304 -0.105140
C -1.559747 -2.281365 0.099052
C 4.589625 -0.155685 1.086191
C 4.456916 -0.029871 -1.335076
C 5.853609 0.437984 1.044033
C 5.721338 0.563375 -1.369819
C 6.421898 0.797683 -0.182235
H -5.535465 1.438238 0.837976
H -5.262790 -0.303792 1.178917
H -3.402334 2.926622 0.500332
H -5.298145 0.892744 -1.708236
H -5.182096 -0.844181 -1.266131
H 2.310055 -1.631395 -0.969635
H 2.409685 -1.728828 0.789327
H -1.594923 -3.381900 0.036342
H 4.150670 -0.429249 2.044647
H 3.914618 -0.205414 -2.263061
H 6.396418 0.622067 1.970021
H 6.161060 0.845163 -2.325433
H 7.406515 1.260195 -0.212157


%chk=000246230-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246230

0 1
Cl -7.470553 -0.347777 -0.847698
S 1.355912 0.692359 0.144353
N -3.692349 0.749874 0.404564
N -1.735184 1.962591 0.414566
N -2.755334 -1.530096 0.150260
N -0.305408 -1.509158 0.037459
C -2.655027 -0.177488 0.269350
C -5.130483 0.431878 0.440289
C -1.448371 0.591439 0.279224
C -3.076456 2.012525 0.483797
C -0.240955 -0.148681 0.153746
C -5.618958 -0.023355 -0.945760
C 2.524710 -0.826728 -0.045005
C 3.951252 -0.339822 -0.099012
C -1.531204 -2.123476 0.041254
C 4.706427 -0.181429 1.092316
C 4.562727 -0.034194 -1.342818
C 6.044137 0.268710 1.041718
C 5.900467 0.415690 -1.396154
C 6.645151 0.568711 -0.203231
H -5.680155 1.330315 0.768088
H -5.304105 -0.372377 1.175542
H -3.657857 2.925754 0.598470
H -5.482509 0.751718 -1.713818
H -5.152640 -0.971601 -1.246695
H 2.205037 -1.343441 -0.961915
H 2.318486 -1.477826 0.817421
H -1.522224 -3.212644 -0.055121
H 4.242178 -0.411451 2.058902
H 3.986607 -0.149782 -2.268834
H 6.616504 0.384130 1.968872
H 6.360985 0.645183 -2.363512
H 7.683292 0.917047 -0.243318


