%chk=000212911.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212911

0 1
O -1.098686 1.143034 1.208528
O -0.336237 2.613049 -1.766299
O 1.031026 0.954330 -2.484371
O -2.792956 -0.337366 0.771899
N 1.103304 1.726392 -0.250489
N -2.766908 1.831364 -0.147608
C 1.277453 -1.808804 1.392383
C 0.634110 -0.513435 0.826429
C 2.020657 -2.571486 0.275977
C 1.695998 0.501420 0.350404
C -0.316527 0.099231 1.865218
C 2.198794 -1.532345 2.584153
C 2.259321 -4.043075 0.643121
C 2.987697 -4.788287 -0.472802
C 0.648006 1.644267 -1.566044
C -2.280735 0.743581 0.586980
C -3.807671 1.551064 -1.174421
C -3.239182 1.302449 -2.482099
C -2.760717 1.093568 -3.567841
H 0.435008 -2.458814 1.749000
H 0.014232 -0.808755 -0.062759
H 2.987727 -2.081882 0.053317
H 1.440000 -2.521732 -0.667194
H 2.336602 0.837129 1.197189
H 2.372450 0.022715 -0.397708
H -1.000839 -0.648581 2.308128
H 0.195360 0.671630 2.658118
H 2.598862 -2.470542 2.991004
H 1.675110 -1.026593 3.401028
H 3.061771 -0.917059 2.307640
H 1.292126 -4.540955 0.853919
H 2.845828 -4.109267 1.580658
H 0.514429 2.274295 0.397304
H 3.968442 -4.346503 -0.682872
H 2.416764 -4.773717 -1.408787
H 3.151341 -5.838628 -0.206525
H -2.089874 2.566739 -0.400543
H -0.590739 2.675223 -2.726380
H -4.431050 0.673368 -0.846277
H -4.492341 2.439223 -1.200573
H -2.356555 0.897855 -4.500603


%chk=000212911-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212911

0 1
O -1.130114 1.201613 1.307069
O -0.189612 2.722642 -1.879396
O 1.128788 0.876378 -2.525280
O -2.890560 -0.315709 0.870045
N 1.085062 1.676625 -0.303211
N -2.653909 1.714883 -0.302245
C 1.292337 -1.818465 1.446158
C 0.644881 -0.509553 0.880877
C 2.061164 -2.592527 0.337296
C 1.699697 0.505291 0.345938
C -0.308651 0.120044 1.923174
C 2.178290 -1.578102 2.696284
C 2.324224 -4.079202 0.673910
C 3.048174 -4.823168 -0.469451
C 0.738914 1.663353 -1.626961
C -2.294213 0.763944 0.625701
C -3.823025 1.517870 -1.174507
C -3.458219 1.438049 -2.606227
C -3.156180 1.389287 -3.800766
H 0.442226 -2.464151 1.758952
H 0.020551 -0.816298 0.015310
H 3.032221 -2.095490 0.132816
H 1.480975 -2.543103 -0.607379
H 2.343242 0.866378 1.169157
H 2.342882 0.015333 -0.402934
H -0.989643 -0.642061 2.343551
H 0.229121 0.632758 2.738098
H 2.545097 -2.537223 3.102292
H 1.624683 -1.074897 3.509909
H 3.065985 -0.963368 2.455718
H 1.357030 -4.578662 0.887343
H 2.928818 -4.158489 1.599017
H 0.552833 2.312033 0.294745
H 4.028425 -4.358464 -0.686666
H 2.451819 -4.795336 -1.400646
H 3.225947 -5.883491 -0.212530
H -1.960916 2.425448 -0.563102
H -0.448901 2.681784 -2.835938
H -4.309832 0.578162 -0.854448
H -4.551858 2.338396 -1.027751
H -2.906352 1.311587 -4.843721


