%chk=000280531.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280531

0 1
O 1.631094 0.433715 0.331797
N -2.154648 0.483221 -0.398670
N -4.473831 -0.040449 0.385242
N -2.751467 -1.772163 0.239045
N -0.588822 -1.362344 -0.583380
N -5.002653 -2.308561 0.777115
N 6.652379 -1.873452 -0.445960
C -3.574730 1.008725 -0.106092
C -1.129839 1.432666 -0.892081
C -0.186156 1.901650 0.233486
C -3.468932 2.098659 0.974933
C -4.149404 1.565786 -1.421201
C -1.858539 -0.871667 -0.216318
C 1.290188 1.779808 -0.125446
C -4.073938 -1.300649 0.464238
C 2.920173 -0.025916 0.107962
C 3.929679 0.675860 -0.554894
C 3.131823 -1.318173 0.629967
C 5.181431 0.072430 -0.705371
C 4.376582 -1.911100 0.475197
C 5.412592 -1.219576 -0.197918
H -1.647369 2.310610 -1.342677
H -0.557216 0.962616 -1.726216
H -0.418807 2.947081 0.513547
H -0.374753 1.315483 1.163953
H -2.960333 1.727003 1.871392
H -2.950010 2.992090 0.625062
H -4.479649 2.397632 1.291524
H -3.624787 2.456441 -1.771344
H -4.124840 0.812310 -2.218407
H -5.207913 1.828457 -1.277251
H 1.491701 1.852830 -1.207210
H 1.919326 2.495862 0.431589
H -0.434439 -2.344017 -0.359483
H 0.225781 -0.778301 -0.379315
H -4.622518 -3.178976 1.123759
H -5.855769 -2.007998 1.229037
H 3.765805 1.671396 -0.955383
H 2.322829 -1.828178 1.149217
H 5.971853 0.605446 -1.229942
H 4.551266 -2.913563 0.862276
H 6.889624 -2.606941 0.208563
H 7.439736 -1.257750 -0.599143


%chk=000280531-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000280531

0 1
O 1.668464 0.182124 0.383619
N -2.213436 0.411107 -0.064719
N -4.685065 0.230189 0.237346
N -3.182562 -1.660728 0.704325
N -0.874330 -1.476904 0.502337
N -5.466136 -1.784422 1.136280
N 6.932073 -1.426651 -0.966915
C -3.595700 1.001284 -0.378419
C -0.995381 1.155258 -0.430975
C -0.182215 1.666017 0.798256
C -3.673665 2.442849 0.184995
C -3.793209 0.999420 -1.922350
C -2.124607 -0.899084 0.375398
C 1.329226 1.608374 0.561165
C -4.426722 -1.003856 0.652191
C 3.008414 -0.143614 0.046892
C 4.068116 0.791100 0.002964
C 3.261047 -1.503313 -0.248723
C 5.370723 0.362958 -0.335249
C 4.558768 -1.928361 -0.582818
C 5.641546 -1.000776 -0.633288
H -1.289999 2.006138 -1.065499
H -0.344989 0.511068 -1.056347
H -0.468962 2.704714 1.047739
H -0.427527 1.048855 1.681281
H -3.479453 2.430352 1.271005
H -2.970265 3.137995 -0.309869
H -4.699893 2.812262 0.024482
H -3.034842 1.614342 -2.443856
H -3.741617 -0.035460 -2.302847
H -4.793380 1.404676 -2.153294
H 1.624081 2.169035 -0.351074
H 1.885824 2.017371 1.428233
H -0.886073 -2.421466 0.881782
H 0.013987 -0.974702 0.411959
H -5.250758 -2.703363 1.509490
H -6.408909 -1.408047 1.141003
H 3.902441 1.848380 0.230050
H 2.433670 -2.220013 -0.218005
H 6.184426 1.097692 -0.366250
H 4.737585 -2.986197 -0.810296
H 7.118103 -2.400080 -1.186691
H 7.703701 -0.768522 -1.010108


