%chk=000276838.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276838

0 1
O 2.337239 -4.356480 0.200735
O -2.335603 -4.357958 -0.204867
O 3.414113 -2.606275 0.862318
O -3.413970 -2.607958 -0.864518
N 2.413440 -3.164030 0.445964
N -2.412779 -3.165317 -0.448876
C -1.209410 -0.941439 -0.221116
C 1.208528 -0.940854 0.220092
C -0.000637 -0.265479 -0.000215
C 1.193999 -2.360120 0.224119
C -1.193922 -2.360689 -0.226410
C 0.000278 -3.057396 -0.001472
C -2.441168 -0.180722 -0.449039
C 2.439845 -0.179582 0.448706
C -2.847566 0.825871 0.339130
C 2.846363 0.826944 -0.339453
C -4.099573 1.567006 0.120856
C 4.098008 1.568520 -0.120563
C -5.252291 0.918995 -0.353319
C -4.143658 2.943646 0.405853
C 5.250844 0.920733 0.353622
C 4.141631 2.945290 -0.404970
C -6.431926 1.642861 -0.546497
C -5.323818 3.661511 0.203623
C 6.430161 1.644961 0.547389
C 5.321475 3.663511 -0.202155
C -6.469299 3.013136 -0.271919
C 6.467084 3.015364 0.273391
H -0.000958 0.828422 0.000222
H 0.000644 -4.164622 -0.001987
H -3.037525 -0.511885 -1.313851
H 3.035690 -0.510363 1.313995
H -2.263295 1.146173 1.208586
H 2.262526 1.146846 -1.209342
H -5.230671 -0.152410 -0.561526
H -3.256968 3.453477 0.778167
H 5.229554 -0.150770 0.561370
H 3.254833 3.454933 -0.777281
H -7.324193 1.135323 -0.912074
H -5.353625 4.728775 0.418808
H 7.322528 1.137605 0.912971
H 5.350937 4.730874 -0.416889
H -7.389091 3.575381 -0.425606
H 7.386627 3.577890 0.427532


%chk=000276838-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276838

0 1
O 2.312809 -4.768088 -0.039320
O -2.311973 -4.769009 0.035375
O 3.480544 -3.037789 0.859994
O -3.480214 -3.038394 -0.862670
N 2.404785 -3.534793 0.336182
N -2.404374 -3.535416 -0.339047
C -1.253556 -1.231781 -0.168652
C 1.253136 -1.231405 0.167348
C -0.000333 -0.584072 -0.000445
C 1.208917 -2.672354 0.176216
C -1.208787 -2.672696 -0.178466
C 0.000199 -3.365174 -0.001362
C -2.486239 -0.443312 -0.298538
C 2.485491 -0.442504 0.297720
C -2.626983 0.861180 0.112917
C 2.625695 0.862282 -0.112982
C -3.835793 1.684015 -0.015637
C 3.834154 1.685550 0.016099
C -5.041841 1.216592 -0.620338
C -3.807067 3.018191 0.487961
C 5.040351 1.218297 0.620634
C 3.804917 3.019985 -0.486783
C -6.167330 2.055757 -0.715631
C -4.934609 3.858296 0.390985
C 6.165491 2.057870 0.716457
C 4.932110 3.860497 -0.389278
C -6.121092 3.380026 -0.212004
C 6.118747 3.382389 0.213537
H -0.000539 0.508257 -0.000095
H 0.000413 -4.457440 -0.001737
H -3.338323 -0.967473 -0.733325
H 3.337774 -0.966551 0.732246
H -1.786061 1.362011 0.615224
H 1.784580 1.363043 -0.615038
H -5.100669 0.195996 -1.012932
H -2.889248 3.391369 0.959715
H 5.099567 0.197517 1.012690
H 2.886978 3.393042 -0.958401
H -7.085633 1.681438 -1.180909
H -4.891502 4.879635 0.784234
H 7.083913 1.683676 1.181601
H 4.888613 4.882030 -0.781981
H -7.000886 4.028164 -0.288228
H 6.998270 4.030845 0.290170


