%chk=000213196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213196

0 1
O -6.090253 -0.614154 -1.198778
O 6.091554 -0.609779 1.198810
O -3.104538 1.302348 1.479302
O 3.104329 1.305024 -1.479112
N -4.180007 1.385523 -0.581254
N 4.179738 1.388303 0.581459
N -1.815511 1.072101 -0.427071
N 1.815471 1.073297 0.427202
C -5.963343 -0.205312 0.189455
C 5.964428 -0.200906 -0.189392
C -7.305400 -0.339600 0.919915
C 7.306662 -0.333965 -0.919744
C -7.839995 -1.771531 0.786982
C 7.842484 -1.765444 -0.786902
C -7.910602 -2.180485 -0.689909
C 7.913313 -2.174476 0.689956
C -6.554869 -1.970057 -1.368019
C 6.557335 -1.965292 1.367960
C -5.506729 1.262814 0.072603
C 5.506544 1.266815 -0.072438
C -3.045310 1.240366 0.260678
C 3.045147 1.242631 -0.260506
C -0.597902 1.115391 0.312939
C 0.597832 1.115914 -0.312798
H -5.182779 -0.842587 0.661215
H 5.184451 -0.838799 -0.661287
H -8.040952 0.371214 0.494704
H -7.188487 -0.067365 1.985294
H 8.041563 0.377444 -0.494403
H 7.189608 -0.061729 -1.985108
H -7.192914 -2.473733 1.347421
H -8.842164 -1.844664 1.249797
H 7.196061 -2.468153 -1.347466
H 8.844757 -1.837666 -1.249635
H -8.680928 -1.574618 -1.207327
H -8.227930 -3.234461 -0.787478
H 8.683064 -1.567986 1.207500
H 8.231550 -3.228184 0.787455
H -6.613658 -2.051574 -2.468362
H -5.784421 -2.657562 -0.977957
H 6.616095 -2.046864 2.468301
H 5.787522 -2.653430 0.977761
H -5.472022 1.734801 1.083528
H -6.229932 1.842592 -0.547285
H 6.229251 1.847194 0.547463
H 5.471405 1.738829 -1.083339
H -4.161218 0.951298 -1.509654
H 4.161281 0.953784 1.509725
H -1.760397 1.167354 -1.437480
H 1.760290 1.168271 1.437635
H -0.726446 1.118223 1.403486
H 0.726375 1.119144 -1.403343


%chk=000213196-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213196

0 1
O -6.479014 -0.197615 -1.118777
O 6.480241 -0.192618 1.118873
O -2.862417 0.779210 2.028906
O 2.862715 0.781390 -2.028469
N -4.213389 0.793951 0.110269
N 4.213762 0.797487 -0.109895
N -1.874966 0.816095 -0.099220
N 1.875320 0.817625 0.099690
C -6.352190 -0.417940 0.346155
C 6.353397 -0.412900 -0.346062
C -7.741482 -0.468506 1.009812
C 7.742642 -0.462506 -1.009890
C -8.624527 -1.555817 0.349253
C 8.626472 -1.549295 -0.349520
C -8.686176 -1.344652 -1.183037
C 8.688159 -1.338223 1.182781
C -7.263434 -1.264034 -1.766661
C 7.265434 -1.258579 1.766575
C -5.477588 0.739603 0.845786
C 5.477963 0.744102 -0.845484
C -2.985373 0.794525 0.762997
C 2.985712 0.796854 -0.762566
C -0.552893 0.812239 0.397861
C 0.553239 0.812650 -0.397362
H -5.821379 -1.384871 0.505973
H 5.823198 -1.380164 -0.505902
H -8.225494 0.522530 0.901768
H -7.623681 -0.666247 2.092985
H 8.226022 0.528838 -0.901834
H 7.624840 -0.660245 -2.093063
H -8.197520 -2.557172 0.565276
H -9.641308 -1.540488 0.783349
H 8.200089 -2.550910 -0.565578
H 9.643192 -1.533271 -0.783734
H -9.221881 -0.402342 -1.408791
H -9.239539 -2.169957 -1.672002
H 9.223282 -0.395586 1.408555
H 9.242113 -2.163212 1.671610
H -7.270998 -1.003814 -2.838484
H -6.740737 -2.238772 -1.635154
H 7.272954 -0.998443 2.838418
H 6.743356 -2.233648 1.635051
H -5.233495 0.613641 1.914733
H -6.039904 1.687685 0.724859
H 6.039625 1.692555 -0.724455
H 5.233895 0.618104 -1.914432
H -4.291560 0.723201 -0.906357
H 4.292032 0.726843 0.906730
H -2.017046 0.851637 -1.110089
H 2.017404 0.853414 1.110550
H -0.513994 0.808839 1.491707
H 0.514329 0.809106 -1.491208


