%chk=000240687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240687

0 1
O 0.042356 1.759366 0.479996
O -2.087166 1.187142 -3.693020
N 2.173538 1.114334 -0.096664
N -1.693246 0.245073 -1.632652
C 0.732887 2.030452 -1.837918
C -0.685361 2.454071 -2.198969
C 2.662188 -0.046854 0.171069
C -2.480556 0.191459 -0.617822
C 1.918520 -1.338410 0.179988
C 4.121862 -0.119526 0.482418
C -3.481555 1.238980 -0.249941
C -2.412595 -0.966348 0.320170
C 0.868404 1.581720 -0.393001
C -1.578044 1.290099 -2.600893
C 2.168213 -2.269497 1.202033
C 4.912839 -1.110003 -0.121210
C -3.097630 2.271673 0.616412
C -1.570710 -0.886463 1.438376
C 0.976857 -1.632482 -0.815892
C 4.702040 0.804442 1.363866
C -4.781625 1.186797 -0.766470
C -3.204017 -2.100126 0.098314
C 1.482047 -3.484842 1.222057
C 6.278630 -1.174649 0.162263
C -4.025076 3.255621 0.967165
C -1.535732 -1.947381 2.346600
C 0.295684 -2.853465 -0.793659
C 6.068756 0.728722 1.648047
C -5.703462 2.176075 -0.410736
C -3.160065 -3.156843 1.012799
C 0.547093 -3.779405 0.222573
C 6.856691 -0.258265 1.048340
C -5.326606 3.207933 0.455214
C -2.330947 -3.079610 2.136601
H 1.093120 1.236476 -2.527238
H 1.433638 2.883001 -2.000390
H -0.661038 3.180867 -3.040237
H -1.157156 2.993517 -1.343907
H 2.896885 -2.041229 1.980616
H 4.462101 -1.825584 -0.809587
H -2.075289 2.302197 1.010906
H -0.943343 -0.001444 1.588289
H 0.756516 -0.915312 -1.608596
H 4.086515 1.583123 1.818337
H -5.071828 0.384413 -1.443902
H -3.845798 -2.158222 -0.779022
H 1.673685 -4.203713 2.016747
H 6.894549 -1.939787 -0.308001
H -3.733200 4.059317 1.641705
H -0.884427 -1.891856 3.217445
H -0.445423 -3.069004 -1.564205
H 6.519312 1.444329 2.334401
H -6.715855 2.141967 -0.810304
H -3.775380 -4.039672 0.849195
H 0.009192 -4.726378 0.241745
H 7.921966 -0.313297 1.268805
H -6.047661 3.975972 0.731392
H -2.303992 -3.901671 2.849348


%chk=000240687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240687

0 1
O 0.935112 1.167211 1.452721
O -0.931906 0.961614 -2.390980
N 2.862788 0.968347 0.151094
N -1.817613 0.634643 -0.259396
C 1.083539 2.466112 -0.639673
C -0.454762 2.623138 -0.639456
C 3.375117 -0.216414 -0.069275
C -2.990302 0.401616 0.251279
C 2.532419 -1.409225 -0.414581
C 4.861885 -0.356833 0.020301
C -4.229585 1.026413 -0.319915
C -3.058529 -0.496059 1.445556
C 1.575144 1.435909 0.389466
C -1.140560 1.361886 -1.195091
C 2.834252 -2.688933 0.127890
C 5.563654 -1.336376 -0.733482
C -5.281481 1.480023 0.521732
C -1.909249 -0.616483 2.276660
C 1.392551 -1.266460 -1.248635
C 5.597625 0.534281 0.848241
C -4.335900 1.213616 -1.726535
C -4.221624 -1.255462 1.746338
C 2.002896 -3.794866 -0.149410
C 6.970828 -1.422518 -0.656978
C -6.414131 2.114335 -0.032352
C -1.934415 -1.474660 3.393906
C 0.570879 -2.375048 -1.535417
C 7.000334 0.438799 0.933004
C -5.477084 1.833383 -2.276224
C -4.236401 -2.120575 2.861867
C 0.870924 -3.642603 -0.984344
C 7.692902 -0.540485 0.179494
C -6.518166 2.288003 -1.432284
C -3.095765 -2.228790 3.691084
H 1.444287 2.193112 -1.647932
H 1.553454 3.437352 -0.388189
H -0.727010 3.464121 -1.303775
H -0.807357 2.836836 0.383030
H 3.700259 -2.808355 0.787577
H 5.011100 -2.013273 -1.393232
H -5.198607 1.358658 1.606935
H -1.012052 -0.034219 2.034662
H 1.143007 -0.299472 -1.697198
H 5.047685 1.292792 1.414754
H -3.531227 0.860415 -2.381077
H -5.100532 -1.189596 1.096245
H 2.234459 -4.771609 0.289629
H 7.502664 -2.173605 -1.251206
H -7.212122 2.474382 0.626230
H -1.048433 -1.555625 4.032850
H -0.302109 -2.236489 -2.181101
H 7.556085 1.123698 1.582802
H -5.554342 1.960805 -3.361349
H -5.132522 -2.711752 3.080748
H 0.226904 -4.502637 -1.199368
H 8.784527 -0.612424 0.242616
H -7.401714 2.773515 -1.861473
H -3.110476 -2.896367 4.560211


