%chk=000281555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281555

0 1
O -9.610461 1.535583 1.532811
O 9.609459 1.521978 -1.548298
O -11.111016 0.875820 -0.183995
O 11.110977 0.877648 0.173521
N -4.838010 -0.084391 0.045471
N 4.837877 -0.084738 -0.043976
C -0.000029 1.281741 -0.007630
C -1.183067 0.341032 -0.014200
C 1.182989 0.341155 0.010281
C -0.733310 -1.018665 -0.001249
C 0.733191 -1.018597 0.013744
C -2.529101 0.647529 -0.027821
C 2.529024 0.647744 0.020174
C -1.647217 -2.061661 -0.000711
C 1.647063 -2.061545 0.025773
C -3.453228 -0.427278 -0.036015
C 3.453152 -0.426908 0.041375
C -3.018872 -1.762190 -0.024211
C 3.018733 -1.761843 0.045644
C -5.713275 -0.547449 -0.788968
C 5.713567 -0.540054 0.794300
C -7.140995 -0.177587 -0.646154
C 7.141201 -0.171511 0.647362
C -8.923325 0.844208 0.541488
C 8.922876 0.839544 -0.550415
C -7.581644 0.549084 0.493690
C 7.581220 0.544877 -0.499215
C -9.828200 0.448904 -0.489611
C 9.828328 0.453510 0.483682
C -8.032516 -0.562862 -1.654571
C 8.033292 -0.547718 1.658700
C -9.409415 -0.254204 -1.597867
C 9.410160 -0.239605 1.598447
C -11.009456 1.575948 1.102339
C 11.008697 1.566184 -1.118996
H 0.009816 1.938802 -0.898786
H -0.009858 1.949481 0.875556
H -2.887934 1.674687 -0.024084
H 2.887919 1.674770 0.004045
H -1.314444 -3.097405 0.015798
H 1.314269 -3.097403 0.021756
H -3.743950 -2.572722 -0.012288
H 3.743751 -2.572513 0.043440
H -5.492280 -1.212653 -1.642815
H 5.492991 -1.197237 1.654442
H -6.881532 0.850654 1.275188
H 6.880673 0.839403 -1.283005
H -7.669509 -1.117986 -2.520387
H 7.670766 -1.095031 2.529674
H -10.093842 -0.555976 -2.385336
H 10.095028 -0.534300 2.388209
H -11.282254 2.626195 0.934980
H -11.605852 1.017705 1.835868
H 11.281603 2.617889 -0.961240
H 11.604672 1.001360 -1.847814


%chk=000281555-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281555

0 1
O -9.726330 2.062597 0.981394
O 9.725053 2.052936 -1.005021
O -11.290403 0.649620 -0.171887
O 11.290420 0.650949 0.159860
N -4.881152 0.082944 -0.004415
N 4.880939 0.083599 0.005959
C -0.000202 1.448223 -0.004715
C -1.192947 0.498248 -0.008198
C 1.192678 0.498489 0.007557
C -0.734648 -0.858356 -0.001436
C 0.734567 -0.858185 0.013636
C -2.560855 0.792352 -0.002649
C 2.560540 0.792722 -0.001110
C -1.668932 -1.920169 0.012691
C 1.668996 -1.919952 0.009319
C -3.509327 -0.272751 -0.024308
C 3.509173 -0.272001 0.030181
C -3.046637 -1.626303 -0.001774
C 3.046665 -1.625771 0.020621
C -5.797164 -0.656236 -0.585908
C 5.797513 -0.649874 0.593743
C -7.228638 -0.340183 -0.495457
C 7.228904 -0.334773 0.498650
C -9.043706 1.020272 0.303969
C 9.043145 1.017467 -0.316456
C -7.675180 0.788066 0.267540
C 7.674628 0.785884 -0.275922
C -9.971030 0.190806 -0.374210
C 9.971227 0.194501 0.368563
C -8.166711 -1.167732 -1.173840
C 8.167733 -1.155787 1.183892
C -9.561683 -0.915053 -1.124120
C 9.562682 -0.903860 1.129841
C -11.168496 1.854489 0.698776
C 11.167590 1.847091 -0.722633
H 0.005658 2.106704 -0.895268
H -0.006153 2.114884 0.879728
H -2.937269 1.820364 0.009831
H 2.936799 1.820625 -0.023428
H -1.332253 -2.962576 0.046280
H 1.332460 -2.962678 -0.014362
H -3.776924 -2.442630 0.043779
H 3.777054 -2.442385 -0.017496
H -5.539123 -1.545632 -1.199415
H 5.540109 -1.533265 1.216123
H -6.944132 1.414616 0.783320
H 6.943014 1.407451 -0.796904
H -7.800874 -2.024324 -1.751834
H 7.802528 -2.006631 1.770705
H -10.283600 -1.548880 -1.644269
H 10.285178 -1.532700 1.655214
H -11.561410 2.728806 0.152287
H -11.700171 1.662905 1.646476
H 11.561728 2.726686 -0.185582
H 11.697671 1.645794 -1.669217


