%chk=000252421.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252421

0 1
O -1.998376 -2.382092 -0.958907
O -4.691297 1.313826 -0.284385
N -2.515596 1.493545 0.442355
N 0.269127 -0.757595 0.380240
N -3.345678 -0.540328 -0.626155
N -0.100883 1.381650 1.121312
N 5.120458 -0.970923 -1.394041
C -1.072321 -0.447878 0.095982
C -1.275262 0.877974 0.567119
C 0.818793 0.366697 0.991484
C 2.222305 0.444577 1.477315
C -2.095829 -1.249398 -0.534319
C -3.601856 0.786927 -0.168846
C -2.720376 2.876107 0.937948
C 3.224325 -0.058495 0.474542
C -4.504749 -1.233473 -1.254986
C 3.288750 0.506507 -0.807325
C 4.116030 -1.084669 0.811963
C 4.248375 0.023045 -1.709573
C 5.048695 -1.508841 -0.149805
H 0.713259 -1.628204 0.137850
H 2.306640 -0.093785 2.450941
H 2.460710 1.511652 1.733270
H -2.509139 2.929054 2.020950
H -3.766377 3.193011 0.760197
H -2.041320 3.573771 0.416102
H -4.208538 -2.251500 -1.572197
H -4.855741 -0.671873 -2.138049
H -5.341117 -1.311215 -0.538859
H 2.611028 1.307943 -1.097937
H 4.101083 -1.545369 1.796250
H 4.335186 0.435318 -2.722889
H 5.768193 -2.307067 0.071952


%chk=000252421-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252421

0 1
O -1.953146 -2.367542 -1.094261
O -4.794939 1.298065 -0.198427
N -2.559134 1.476729 0.494007
N 0.255572 -0.675114 0.289083
N -3.365650 -0.509253 -0.633477
N -0.155370 1.403327 1.114356
N 5.218378 -1.082425 -1.344670
C -1.094188 -0.411902 0.038580
C -1.315026 0.870281 0.560747
C 0.786246 0.433740 0.932885
C 2.206863 0.520571 1.421308
C -2.105985 -1.206528 -0.605094
C -3.641016 0.791082 -0.114383
C -2.769246 2.827000 1.051101
C 3.241912 -0.048879 0.455742
C -4.517585 -1.195114 -1.263716
C 3.335911 0.416513 -0.881470
C 4.158806 -1.047527 0.864002
C 4.326473 -0.119770 -1.732581
C 5.119005 -1.528009 -0.057878
H 0.749249 -1.524096 0.010948
H 2.292900 0.008645 2.399898
H 2.402930 1.591001 1.613562
H -2.557202 2.828097 2.133464
H -3.818467 3.101439 0.870070
H -2.095765 3.548029 0.558473
H -4.158735 -2.168872 -1.627920
H -4.908325 -0.588695 -2.096758
H -5.326354 -1.332267 -0.527448
H 2.653156 1.188497 -1.254110
H 4.135086 -1.445407 1.884973
H 4.422113 0.226289 -2.767815
H 5.840035 -2.299006 0.236310


