%chk=000270391.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270391

0 1
O -1.578204 1.610246 0.901243
O 3.171407 1.013097 -0.165640
O 0.879919 -0.505289 2.538396
O 0.216064 2.764195 1.654616
N -0.638247 -0.220971 -0.104475
C 0.488184 0.570597 0.435790
C 1.282338 -0.323849 1.416325
C 2.500596 -0.969877 0.873993
C -1.754411 0.391252 0.193310
C -0.169138 1.784540 1.104598
C -3.142241 0.037402 -0.095471
C 3.462053 -0.308686 0.077604
C 2.726819 -2.318707 1.199088
C 4.605750 -0.969990 -0.395607
C -3.425356 -1.134927 -0.817855
C -4.186651 0.865147 0.352527
C 3.855240 -2.989617 0.728117
C 4.788684 -2.313527 -0.067104
C -4.752954 -1.471656 -1.090712
C -5.509560 0.518159 0.074164
C -5.792818 -0.647880 -0.646355
C 4.130494 1.810643 -0.906075
H 1.146812 0.918180 -0.413269
H 1.999620 -2.838045 1.831706
H 5.340196 -0.456440 -1.007563
H -2.608170 -1.775357 -1.159792
H -3.953738 1.772584 0.916990
H 4.011459 -4.036122 0.982247
H 5.671630 -2.841066 -0.432855
H -4.977261 -2.379340 -1.649829
H -6.321827 1.156421 0.420401
H -6.827496 -0.915483 -0.860996
H 4.228809 1.431209 -1.926893
H 5.089034 1.836354 -0.379127
H 3.650963 2.799702 -0.892197


%chk=000270391-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270391

0 1
O -1.287926 1.035013 0.924874
O 2.942139 0.627103 -0.821056
O 0.444698 -2.399538 0.790817
O 0.934849 1.560635 1.470225
N -0.998134 -0.587729 -0.732899
C 0.350778 -0.215001 -0.264339
C 1.114630 -1.422093 0.361537
C 2.606870 -1.383194 0.498402
C -1.856974 0.114825 -0.042921
C 0.142527 0.890183 0.803761
C -3.319723 0.101599 -0.131157
C 3.493093 -0.388961 -0.034768
C 3.179888 -2.443589 1.258028
C 4.886437 -0.466249 0.218004
C -3.947497 -0.815650 -1.017185
C -4.106832 0.984376 0.654691
C 4.560006 -2.526473 1.503239
C 5.413577 -1.525485 0.982852
C -5.351885 -0.842854 -1.116156
C -5.513260 0.949890 0.549147
C -6.138206 0.039499 -0.334663
C 3.787735 1.762083 -1.211905
H 0.963603 0.197959 -1.082705
H 2.488888 -3.194734 1.654328
H 5.563337 0.293472 -0.181520
H -3.320641 -1.492572 -1.606204
H -3.612731 1.682484 1.336861
H 4.967439 -3.350905 2.096040
H 6.492323 -1.567484 1.170017
H -5.836072 -1.550855 -1.797240
H -6.121016 1.630102 1.155354
H -7.230826 0.014489 -0.413143
H 4.590559 1.443251 -1.902985
H 4.218109 2.253477 -0.320521
H 3.108238 2.455825 -1.727511


