%chk=000235281.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235281

0 1
O -0.398673 -1.364882 -1.185090
N -1.989832 -0.923827 1.229079
C -2.745484 -2.120375 0.747296
C -3.318583 -1.954900 -0.664512
C -4.242917 -0.735763 -0.705132
C -2.472165 0.352384 0.770152
C -3.588903 0.472107 -0.094360
C -0.515056 -1.082118 1.211837
C -1.876864 1.519056 1.294649
C -4.094269 1.744508 -0.387779
C 0.173196 -1.088228 -0.154814
C -2.393457 2.775868 0.983100
C -3.505362 2.893694 0.144933
C 1.623601 -0.723754 -0.148370
C 2.474544 -1.044484 0.918629
C 2.141126 -0.053822 -1.268506
C 4.339345 -0.009839 -0.244163
C 3.823237 -0.691523 0.870953
C 3.487692 0.307928 -1.313594
C 5.792127 0.380861 -0.287989
C 6.000340 1.769598 0.314877
H -3.572460 -2.266422 1.481830
H -2.105331 -3.024406 0.798498
H -3.857725 -2.866614 -0.973460
H -2.484296 -1.823483 -1.392139
H -5.187024 -0.951410 -0.161909
H -4.536131 -0.525225 -1.753738
H -0.082024 -0.266640 1.843377
H -0.262540 -2.033665 1.737186
H -1.019467 1.440304 1.960246
H -4.955707 1.841049 -1.047405
H -1.927894 3.667915 1.398224
H -3.908999 3.873699 -0.094601
H 2.094347 -1.580018 1.787901
H 1.478138 0.177975 -2.106798
H 4.478434 -0.943915 1.702691
H 3.877200 0.836116 -2.182367
H 6.411546 -0.362964 0.254815
H 6.167143 0.363430 -1.332612
H 5.429165 2.532836 -0.228146
H 7.056286 2.060917 0.283264
H 5.676697 1.806032 1.362247


%chk=000235281-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235281

0 1
O -0.077080 -0.546516 -1.688517
N -1.929682 -0.775050 0.410573
C -2.482792 -2.059520 -0.080225
C -3.851462 -1.884611 -0.760235
C -4.767078 -1.004406 0.120081
C -2.683116 0.414273 0.435320
C -4.113359 0.351502 0.327298
C -0.510015 -0.774132 0.710365
C -2.067453 1.691105 0.597705
C -4.866951 1.540168 0.391047
C 0.412926 -0.568089 -0.523559
C -2.848217 2.863135 0.682971
C -4.255632 2.801902 0.583608
C 1.888437 -0.436318 -0.293004
C 2.480266 -0.523447 0.997454
C 2.733853 -0.218323 -1.415992
C 4.720798 -0.170551 0.035789
C 3.875147 -0.394603 1.153707
C 4.123827 -0.086643 -1.252004
C 6.217919 0.023895 0.215124
C 6.592031 1.520821 0.399537
H -2.575475 -2.769777 0.771988
H -1.768581 -2.495572 -0.805734
H -4.294560 -2.883767 -0.927640
H -3.715786 -1.403975 -1.746464
H -4.927983 -1.514484 1.093557
H -5.762220 -0.882498 -0.345281
H -0.279627 -0.013073 1.479212
H -0.235178 -1.753072 1.159249
H -0.977394 1.785218 0.625800
H -5.958474 1.472399 0.294986
H -2.346638 3.829972 0.808959
H -4.861138 3.712413 0.639925
H 1.861870 -0.698829 1.884231
H 2.267601 -0.158957 -2.405349
H 4.318343 -0.470416 2.154132
H 4.761899 0.079399 -2.128660
H 6.570149 -0.546718 1.095228
H 6.757133 -0.375024 -0.665046
H 6.278820 2.116532 -0.476648
H 7.683681 1.638412 0.524855
H 6.094194 1.945226 1.289953


