%chk=000213067.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213067

0 1
O -0.178549 1.374957 -0.475056
O -2.317312 -0.978022 0.501826
O 0.709233 0.437262 1.420492
O -0.556796 -2.245594 -0.246341
N 1.876593 0.507816 -0.631093
N -1.311344 -2.383335 1.961588
C -2.598190 1.166759 -0.572400
C -3.913017 1.408964 0.240695
C -1.407038 1.696569 0.259417
C -2.417017 -0.349925 -0.816585
C -2.614520 1.860982 -1.940000
C -4.063711 2.866142 0.691777
C -5.156196 0.979076 -0.547354
C 0.810175 0.717131 0.243140
C -1.287872 -1.896497 0.656725
C 3.094908 -0.162650 -0.283923
C 4.011302 -0.408989 -1.326905
C 3.389568 -0.541772 1.036254
C 5.222421 -1.035237 -1.030778
C 4.607849 -1.167277 1.305904
C 5.526393 -1.415069 0.280862
H -3.846235 0.760663 1.155126
H -1.373189 1.244770 1.269476
H -1.385398 2.797354 0.322661
H -1.509022 -0.568945 -1.411402
H -3.300405 -0.817158 -1.284152
H -3.337026 1.406898 -2.626048
H -2.880067 2.920489 -1.844755
H -1.625156 1.815494 -2.415468
H -3.983953 3.564327 -0.149176
H -3.315104 3.149831 1.438072
H -5.045367 3.032258 1.152834
H -6.053377 1.032818 0.080467
H -5.074962 -0.055795 -0.901192
H -5.331628 1.618638 -1.418798
H 1.741298 0.766180 -1.613522
H -0.463992 -2.826214 2.298560
H -1.830957 -1.870298 2.661421
H 3.784688 -0.123960 -2.350793
H 2.674973 -0.353485 1.842562
H 5.935365 -1.230471 -1.831789
H 4.841658 -1.464191 2.328496
H 6.472377 -1.903294 0.501670


%chk=000213067-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213067

0 1
O -0.281559 0.938207 -0.367612
O -2.403925 -1.236789 -0.139564
O 1.222867 1.764121 1.251636
O -0.348073 -1.992555 -1.052793
N 1.729839 -0.039883 -0.223641
N -1.272384 -2.905955 0.892567
C -2.684029 1.216109 -0.591829
C -3.994584 1.340396 0.277248
C -1.461894 1.491192 0.324267
C -2.554741 -0.206287 -1.203443
C -2.660063 2.203965 -1.790313
C -4.047516 2.643778 1.116558
C -5.295484 1.218891 -0.555083
C 0.950547 0.961875 0.322959
C -1.255432 -2.041100 -0.177120
C 3.090601 -0.329912 0.056034
C 3.659613 -1.461000 -0.590959
C 3.885280 0.453253 0.935777
C 5.008259 -1.801851 -0.364522
C 5.234563 0.097753 1.149394
C 5.807091 -1.024395 0.507103
H -3.968913 0.485325 0.985519
H -1.568419 0.981780 1.301209
H -1.314024 2.570739 0.499483
H -1.678436 -0.266842 -1.868461
H -3.468438 -0.480825 -1.756454
H -3.394596 1.924622 -2.567231
H -2.890637 3.233103 -1.462446
H -1.658017 2.212864 -2.255082
H -4.028836 3.543588 0.473188
H -3.213000 2.720697 1.835580
H -4.986495 2.676218 1.699430
H -6.170984 1.214317 0.120128
H -5.337607 0.289273 -1.150211
H -5.415847 2.074280 -1.245097
H 1.209369 -0.690340 -0.833091
H -0.500017 -3.556221 1.007421
H -2.040363 -2.887157 1.559392
H 3.042872 -2.064272 -1.268389
H 3.441628 1.313423 1.442064
H 5.435210 -2.674831 -0.871056
H 5.842558 0.706734 1.828285
H 6.855416 -1.289087 0.681654


