%chk=000213080.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213080

0 1
O -2.342406 0.816658 -0.477655
O 1.315225 1.633207 0.272581
O -2.557355 0.188410 1.726581
O 3.202803 0.362010 -0.073920
N -3.393481 2.213133 0.943973
N 3.032896 1.842046 1.712904
C 0.637028 -1.589714 -0.285530
C -0.151220 -0.260805 -0.168757
C 0.739472 -2.075897 -1.747500
C 0.025971 -2.691637 0.605494
C -1.556717 -0.385250 -0.761238
C 0.599401 0.923830 -0.787573
C 1.905997 -3.040511 -1.948729
C -0.060786 -2.299347 2.077342
C -2.755290 0.986956 0.834508
C 2.593273 1.192912 0.567378
H 1.677963 -1.379229 0.083802
H -0.266667 -0.036547 0.933639
H -0.204473 -2.560269 -2.060293
H 0.874933 -1.207046 -2.422215
H -0.981023 -2.967941 0.237389
H 0.642197 -3.608236 0.504014
H -2.096664 -1.260554 -0.354747
H -1.582203 -0.385605 -1.865074
H 1.311842 0.634074 -1.580193
H -0.084203 1.721510 -1.139082
H 1.807607 -3.935102 -1.323433
H 1.974191 -3.370667 -2.990614
H 2.862903 -2.566908 -1.690097
H 0.910734 -1.986825 2.474788
H -0.767240 -1.467045 2.232238
H -0.414521 -3.135597 2.689753
H -3.595397 2.767027 0.127471
H -3.895866 2.431401 1.790907
H 2.491889 2.589412 2.118875
H 4.010489 1.794045 1.957010


%chk=000213080-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213080

0 1
O -2.435220 0.928034 -0.518583
O 1.644242 1.400722 0.502921
O -3.223424 -0.166350 1.422584
O 3.283228 0.673282 -1.043272
N -3.973277 1.967519 0.792864
N 3.832163 1.460638 1.097770
C 0.595512 -1.475667 -0.096843
C -0.230189 -0.149414 -0.006263
C 0.895815 -1.906544 -1.563889
C -0.062366 -2.641919 0.699455
C -1.552182 -0.241841 -0.794727
C 0.557705 1.093586 -0.465040
C 2.100046 -2.866024 -1.689375
C -0.320409 -2.355725 2.196276
C -3.218638 0.823959 0.648045
C 2.960284 1.132858 0.081835
H 1.569226 -1.261912 0.393388
H -0.493728 0.009690 1.056374
H -0.007623 -2.384925 -1.997367
H 1.115217 -1.014639 -2.181422
H -1.017390 -2.933226 0.215733
H 0.600965 -3.524461 0.611921
H -2.100046 -1.161963 -0.530864
H -1.397708 -0.193792 -1.885205
H 1.007631 0.963580 -1.465296
H -0.090673 1.985330 -0.456447
H 1.957363 -3.791401 -1.101491
H 2.262751 -3.162342 -2.742115
H 3.020513 -2.366952 -1.334864
H 0.590349 -1.964892 2.689778
H -1.136491 -1.625397 2.338716
H -0.615279 -3.282533 2.722569
H -3.916948 2.713962 0.104484
H -4.599165 2.040172 1.589629
H 3.480824 1.830252 1.977593
H 4.828225 1.334231 0.945124


