%chk=000220179.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220179

0 1
S 2.639540 -0.456942 -0.772827
S -2.738909 0.149429 1.066891
C 0.571785 1.253728 -1.076256
C -0.326717 0.699204 0.041408
C 2.043155 1.270177 -0.688152
C -1.792231 0.748939 -0.373774
C 4.327646 -0.302595 -0.280548
C -4.371360 -0.119771 0.466421
C 4.652681 0.080294 1.022388
C -4.908267 0.567972 -0.622312
C 5.315929 -0.638094 -1.207947
C -5.134538 -1.047661 1.185248
C 5.998443 0.134903 1.400084
C -6.232566 0.317510 -1.001566
C 6.659367 -0.588477 -0.818858
C -6.457586 -1.283454 0.802737
C 6.999622 -0.199721 0.481138
C -7.007024 -0.604360 -0.291505
H 0.419249 0.671067 -2.009516
H 0.257509 2.289683 -1.326305
H -0.027451 -0.344373 0.282962
H -0.162596 1.278712 0.973501
H 2.632605 1.895551 -1.384024
H 2.198287 1.678689 0.326346
H -2.107982 1.775685 -0.632506
H -1.985350 0.107170 -1.253256
H 3.873418 0.324933 1.743502
H -4.322393 1.298391 -1.175406
H 5.050244 -0.936835 -2.222548
H -4.707987 -1.585864 2.032236
H 6.266287 0.432839 2.412360
H -6.659841 0.847244 -1.851488
H 7.439874 -0.851531 -1.530851
H -7.061399 -2.001216 1.356159
H 8.045977 -0.159321 0.779788
H -8.036521 -0.794606 -0.588025


%chk=000220179-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220179

0 1
S 2.789609 -0.594237 -1.053097
S -2.689144 -0.538016 0.969329
C 0.547843 1.142120 -1.149725
C -0.264612 0.370249 -0.081774
C 2.061207 1.166413 -0.874981
C -1.771818 0.410189 -0.385774
C 4.484038 -0.290181 -0.381781
C -4.446445 -0.368536 0.466434
C 4.682104 -0.144284 1.012414
C -4.877698 0.330461 -0.687180
C 5.588948 -0.247548 -1.264359
C -5.405130 -0.989642 1.309472
C 5.985474 0.060002 1.520630
C -6.257371 0.406652 -0.989564
C 6.893311 -0.055562 -0.750019
C -6.778725 -0.908368 0.998733
C 7.093082 0.103422 0.640857
C -7.214306 -0.209086 -0.152664
H 0.360136 0.710426 -2.153573
H 0.196566 2.194060 -1.190004
H 0.084997 -0.677983 -0.036598
H -0.074173 0.815631 0.914914
H 2.591362 1.810728 -1.596008
H 2.280572 1.511907 0.150076
H -2.147641 1.448967 -0.396532
H -1.992419 -0.070437 -1.355421
H 3.824726 -0.207963 1.691442
H -4.159103 0.815235 -1.354784
H 5.424584 -0.364035 -2.340531
H -5.077134 -1.533429 2.202843
H 6.135702 0.171980 2.600242
H -6.579497 0.950425 -1.885073
H 7.747636 -0.026949 -1.435540
H -7.507946 -1.392684 1.657911
H 8.103419 0.254502 1.037132
H -8.281256 -0.147132 -0.391950


