%chk=000266697.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266697

0 1
O 5.539146 2.044101 2.023968
O -5.539988 2.049529 -2.023906
N 4.972564 -0.880791 0.145238
N -4.974212 -0.878712 -0.150220
N 5.714197 -0.077867 2.801292
N -5.716287 -0.071084 -2.804644
C 5.842675 0.316677 0.325760
C -5.843825 0.319478 -0.328427
C 7.326371 -0.105777 0.140122
C 5.608944 1.430745 -0.723180
C -5.609217 1.431706 0.722260
C -7.327662 -0.102561 -0.142994
C 7.673066 0.186331 -1.327072
C 6.661347 1.236230 -1.826217
C -6.661374 1.235908 1.825308
C -7.673679 0.187214 1.324821
C 5.653464 0.855573 1.769809
C -5.654827 0.860645 -1.771652
C 3.552379 -0.753305 0.049240
C -3.553966 -0.751905 -0.053938
C 2.845670 -1.824535 -0.546430
C -2.847676 -1.824091 0.540476
C 2.837110 0.323171 0.606657
C -2.838292 0.324974 -0.610067
C 0.736730 -0.751375 0.006839
C -0.738325 -0.751086 -0.011523
C 1.454326 -1.819690 -0.557870
C -1.456321 -1.819794 0.551919
C 1.442485 0.315091 0.583974
C -1.443674 0.316341 -0.587391
H 7.972561 0.491544 0.813013
H 7.502595 -1.158797 0.413701
H 4.584123 1.412470 -1.129789
H 5.719196 2.427091 -0.243408
H -5.719132 2.428891 0.244152
H -4.584282 1.412276 1.128525
H -7.973788 0.496239 -0.814632
H -7.504511 -1.155020 -0.418320
H 8.709358 0.553073 -1.422782
H 7.615853 -0.731892 -1.936444
H 6.189526 0.908960 -2.768412
H 7.165188 2.192502 -2.051810
H -7.164747 2.192039 2.052537
H -6.189411 0.906975 2.766852
H -8.709800 0.554165 1.421561
H -7.616549 -0.732048 1.932633
H 5.362053 -1.515496 -0.562764
H -5.363916 -1.514535 0.556676
H 5.590390 -1.062835 2.619255
H 5.502020 0.224494 3.741366
H -5.592808 -1.056400 -2.624241
H -5.504201 0.232717 -3.744275
H 3.383365 -2.658805 -0.989511
H -3.385679 -2.658674 0.982597
H 3.348963 1.172791 1.057442
H -3.349836 1.175328 -1.059817
H 0.914632 -2.648004 -1.017514
H -0.916948 -2.648856 1.010585
H 0.895166 1.149502 1.025127
H -0.896032 1.151062 -1.027552


%chk=000266697-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266697

0 1
O 6.381877 2.424389 1.798681
O -6.382101 2.429701 -1.798462
N 5.024215 -0.725006 0.427112
N -5.025249 -0.722073 -0.430912
N 5.395978 0.572446 2.805205
N -5.395808 0.579421 -2.807550
C 5.945155 0.438898 0.392322
C -5.945864 0.442078 -0.394985
C 7.395123 -0.105013 0.182253
C 5.764357 1.348914 -0.861004
C -5.765946 1.349918 0.860039
C -7.396140 -0.101800 -0.186972
C 7.480213 -0.408444 -1.336069
C 6.562720 0.662154 -2.013122
C -6.565165 0.661191 2.010382
C -7.482473 -0.407928 1.330745
C 5.909405 1.250300 1.722005
C -5.908931 1.255800 -1.723276
C 3.620158 -0.663387 0.283966
C -3.621188 -0.661179 -0.287205
C 2.908771 -1.839852 -0.091201
C -2.910422 -1.838462 0.086554
C 2.864828 0.516016 0.545829
C -2.865222 0.518165 -0.547537
C 0.740615 -0.664302 0.058042
C -0.741655 -0.663829 -0.060979
C 1.507650 -1.836659 -0.197700
C -1.509312 -1.836105 0.193239
C 1.461492 0.503268 0.431289
C -1.461904 0.504564 -0.432861
H 8.098898 0.701603 0.452753
H 7.613951 -0.975942 0.828113
H 4.700413 1.486310 -1.115054
H 6.183590 2.339237 -0.613251
H -6.184954 2.340689 0.613687
H -4.702195 1.486839 1.115130
H -8.099476 0.705494 -0.456581
H -7.614708 -0.971519 -0.834546
H 8.522365 -0.360773 -1.697592
H 7.113763 -1.429766 -1.556305
H 5.884401 0.189064 -2.744925
H 7.161896 1.408552 -2.564285
H -7.164494 1.406673 2.562616
H -5.887380 0.186551 2.741679
H -8.524880 -0.360560 1.691567
H -7.116516 -1.429763 1.549438
H 5.445997 -1.606291 0.124048
H -5.447473 -1.603598 -0.129169
H 4.989287 -0.353673 2.668846
H 5.369268 1.032012 3.713957
H -4.989213 -0.346932 -2.672534
H -5.369166 1.040278 -3.715650
H 3.466832 -2.759204 -0.313227
H -3.468953 -2.757848 0.307250
H 3.363894 1.436589 0.861748
H -3.363756 1.439335 -0.862535
H 1.002185 -2.753526 -0.521927
H -1.004345 -2.753657 0.516295
H 0.912374 1.420628 0.672382
H -0.912285 1.421912 -0.672855


