%chk=000215403.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215403

0 1
O -3.136567 1.061658 1.169554
O 5.920441 -1.856297 -0.797965
N 0.370135 -1.145063 0.352821
N 4.037782 -0.727007 -0.176012
N -6.173451 -1.456510 -1.230887
C 3.148579 -1.913735 -0.301282
C 2.487951 -2.240221 1.051836
C 2.073102 -1.671499 -1.378329
C 1.394893 -1.235524 1.443860
C 0.992918 -0.677748 -0.928568
C -0.764778 -0.252217 0.755676
C -2.041657 -0.745589 0.055807
C 5.402665 -0.806569 -0.452020
C -3.244222 0.091977 0.442684
C -4.533741 -0.330651 -0.114655
C -5.783477 0.359281 0.113660
C 6.155637 0.478615 -0.271844
C -4.809216 -1.425906 -0.932476
C -6.799579 -0.360380 -0.594157
C -6.134759 1.509659 0.845492
C 7.264431 0.491921 0.584313
C 5.785500 1.634114 -0.971270
C -8.147445 0.045517 -0.584974
C -7.460628 1.905929 0.852629
C -8.455914 1.181340 0.144610
C 7.993073 1.672730 0.753951
C 6.521168 2.810421 -0.801207
C 7.621053 2.830891 0.063383
H 3.791395 -2.785768 -0.615791
H 3.251460 -2.292488 1.850729
H 2.041816 -3.254389 0.984516
H 1.596734 -2.644819 -1.617368
H 2.541023 -1.318479 -2.316342
H 0.881059 -1.596839 2.362850
H 1.847952 -0.252869 1.695277
H 1.420110 0.345390 -0.853213
H 0.192293 -0.631310 -1.699343
H -0.919050 -0.299016 1.857069
H -0.595202 0.821534 0.522077
H 3.611162 0.135627 0.141529
H -1.910193 -0.731158 -1.044350
H -2.210230 -1.812125 0.315023
H -4.129987 -2.173162 -1.312756
H -6.637843 -2.140626 -1.797135
H -5.354688 2.053296 1.385217
H 7.559886 -0.420343 1.105421
H 4.937398 1.615100 -1.654722
H -8.905347 -0.510086 -1.126117
H -7.760557 2.791822 1.410647
H -9.485012 1.537009 0.183788
H 8.854562 1.687593 1.420130
H 6.239476 3.710549 -1.345292
H 8.191692 3.749518 0.195226


%chk=000215403-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215403

0 1
O -3.331226 0.461323 1.727402
O 5.428384 -1.730448 -1.308301
N 0.429446 -1.266039 0.837106
N 4.075670 -0.885392 0.376609
N -5.708146 -0.563338 -2.144406
C 3.248646 -2.111984 0.460699
C 2.531658 -2.173427 1.828305
C 2.198152 -2.165745 -0.680403
C 1.407018 -1.121656 1.941278
C 1.092318 -1.112774 -0.484803
C -0.733172 -0.360329 1.015784
C -1.929988 -0.759242 0.133581
C 5.115188 -0.771482 -0.528921
C -3.241255 -0.092452 0.583669
C -4.395110 -0.140854 -0.325262
C -5.734835 0.381020 -0.060327
C 5.870816 0.535923 -0.535902
C -4.433907 -0.706553 -1.613331
C -6.536140 0.101594 -1.218138
C -6.325499 1.050881 1.041698
C 7.162630 0.537494 -1.120927
C 5.342708 1.750054 -0.022639
C -7.895743 0.465258 -1.314284
C -7.683786 1.417735 0.955039
C -8.459855 1.130140 -0.205938
C 7.924822 1.722878 -1.170002
C 6.104120 2.938584 -0.076145
C 7.399377 2.927062 -0.643828
H 3.938338 -2.968573 0.344793
H 3.259083 -2.043760 2.652987
H 2.079021 -3.176090 1.933379
H 1.741030 -3.173586 -0.683966
H 2.706343 -2.019053 -1.649881
H 0.873397 -1.254141 2.900217
H 1.847352 -0.084456 1.965031
H 1.529555 -0.084471 -0.596722
H 0.334170 -1.229580 -1.279179
H -1.059061 -0.411517 2.069559
H -0.464224 0.708972 0.820226
H 3.901404 -0.136709 1.047939
H -1.746790 -0.525480 -0.932172
H -2.056534 -1.859635 0.201171
H -3.645762 -1.201512 -2.177673
H -6.000598 -0.886740 -3.064843
H -5.723366 1.267487 1.927374
H 7.538624 -0.403442 -1.535845
H 4.325729 1.793179 0.386916
H -8.493688 0.244608 -2.205370
H -8.157564 1.935541 1.796288
H -9.513061 1.430360 -0.237789
H 8.924153 1.711171 -1.618786
H 5.684957 3.872553 0.314269
H 7.989007 3.849744 -0.683837


