%chk=000198608.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198608

0 1
O 1.617170 -1.843366 1.329824
N -1.488879 -0.942858 -0.359304
C 1.372877 -0.836085 0.317053
C 0.355401 0.185157 0.862555
C 0.848287 -1.532779 -0.954874
C -1.060661 -0.394143 0.968996
C -0.583075 -2.059200 -0.789511
C 2.730433 -0.194507 0.076037
C -2.911169 -1.423374 -0.309309
C 2.863271 0.840545 -0.861233
C 3.859592 -0.627725 0.784170
C -3.860052 -0.267344 -0.095252
C 4.105950 1.433952 -1.086770
C 5.104066 -0.035997 0.560733
C 5.237011 1.000617 -0.375921
C -4.887359 -0.372386 0.853553
C -3.740019 0.900732 -0.863975
C 6.571095 1.625828 -0.626832
C -5.789033 0.682220 1.026821
C -4.641019 1.952192 -0.683980
C -5.668401 1.844711 0.260011
H 0.337542 1.075550 0.202076
H 0.691496 0.543610 1.854732
H 1.527379 -2.365950 -1.220566
H 0.881627 -0.820617 -1.803768
H -1.109312 -1.146637 1.785244
H -1.768980 0.420504 1.245769
H -0.945795 -2.437519 -1.771040
H -0.594146 -2.923157 -0.090102
H -3.148616 -1.888167 -1.296625
H -3.073816 -2.214817 0.455438
H 0.785884 -2.283554 1.582538
H 1.994550 1.188506 -1.419740
H 3.758126 -1.435029 1.515608
H 4.196367 2.234947 -1.816748
H 5.972228 -0.382830 1.116734
H -4.989007 -1.271478 1.456897
H -2.930725 0.981746 -1.591526
H 7.209605 1.616081 0.266516
H 6.488119 2.671829 -0.949775
H 7.110507 1.083043 -1.417263
H -6.586644 0.596382 1.762524
H -4.543714 2.857606 -1.280551
H -6.370662 2.663959 0.396737


%chk=000198608-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198608

0 1
O 1.642795 -1.922768 1.354038
N -1.505262 -0.980345 -0.247837
C 1.407755 -0.857721 0.346189
C 0.382129 0.167391 0.909924
C 0.829613 -1.497558 -0.950240
C -1.030405 -0.435206 1.045293
C -0.598249 -2.041067 -0.744433
C 2.771261 -0.209455 0.085453
C -2.920459 -1.417574 -0.199658
C 2.892052 0.858817 -0.839896
C 3.937977 -0.653826 0.752606
C -3.903775 -0.259674 -0.049683
C 4.142749 1.462424 -1.089899
C 5.187770 -0.046355 0.498393
C 5.316845 1.018054 -0.428886
C -5.075933 -0.407622 0.731506
C -3.685091 0.964316 -0.731557
C 6.668972 1.645037 -0.724970
C -6.019885 0.641615 0.823723
C -4.622866 2.015868 -0.637191
C -5.796376 1.857689 0.138361
H 0.328424 1.039733 0.234304
H 0.740232 0.521144 1.894204
H 1.504049 -2.312429 -1.271145
H 0.805608 -0.737290 -1.751760
H -1.038816 -1.232442 1.842073
H -1.734447 0.345391 1.382803
H -0.989023 -2.421861 -1.706307
H -0.572551 -2.919714 -0.041176
H -3.127701 -1.945552 -1.152809
H -3.101832 -2.161665 0.618725
H 0.767720 -2.315081 1.601693
H 2.007817 1.233061 -1.371289
H 3.848928 -1.473060 1.469973
H 4.209014 2.289729 -1.807533
H 6.078110 -0.405768 1.029896
H -5.251251 -1.346780 1.271972
H -2.767751 1.076093 -1.320368
H 7.336050 1.603717 0.154404
H 6.568832 2.702515 -1.027915
H 7.182406 1.114445 -1.550840
H -6.922026 0.512529 1.432637
H -4.441492 2.957843 -1.167803
H -6.524417 2.673601 0.210922


