%chk=000215537.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215537

0 1
O 2.822581 -2.534980 0.520957
O 0.607399 -2.456900 0.267080
N -0.490584 0.013817 -0.349081
N 1.016767 1.837436 -0.422918
C -1.670147 0.900900 -0.578975
C -2.698699 0.139056 -1.440060
C -2.273625 1.348538 0.768661
C -3.400001 -0.990445 -0.675381
C -2.968674 0.204617 1.515139
C -4.019444 -0.482623 0.633176
C 0.791084 0.467712 -0.232343
C 1.885344 -0.421565 0.049163
C 3.188941 0.120787 0.106492
C 2.272686 2.295076 -0.356208
C 1.658898 -1.834862 0.270791
C 3.397323 1.472469 -0.094831
H -1.326848 1.813456 -1.141370
H -2.210323 -0.265071 -2.348058
H -3.452618 0.866494 -1.801399
H -2.996622 2.164951 0.575611
H -1.480616 1.792321 1.402275
H -2.683303 -1.807733 -0.459583
H -4.183180 -1.441504 -1.314017
H -3.444115 0.593930 2.435244
H -2.218450 -0.536558 1.853753
H -4.842282 0.223299 0.410215
H -4.479715 -1.325086 1.182919
H -0.693491 -0.981717 -0.152408
H 4.026756 -0.553787 0.315314
H 2.397650 3.376021 -0.515957
H 4.390699 1.905224 -0.054536
H 2.642709 -3.502672 0.670632


%chk=000215537-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215537

0 1
O 2.833099 -2.618316 0.405059
O 0.549889 -2.475022 0.038142
N -0.493126 -0.003179 -0.402713
N 0.974397 1.829894 -0.331202
C -1.664502 0.863485 -0.666246
C -2.730382 0.058488 -1.450200
C -2.261808 1.425166 0.655576
C -3.398474 -1.045350 -0.590112
C -2.913065 0.317828 1.516976
C -3.987060 -0.458628 0.716230
C 0.779300 0.462932 -0.233629
C 1.891699 -0.438189 0.028894
C 3.187793 0.122003 0.172537
C 2.230091 2.312311 -0.189976
C 1.668639 -1.878565 0.146068
C 3.374826 1.510255 0.062138
H -1.303513 1.712635 -1.273194
H -2.276284 -0.376649 -2.361268
H -3.510675 0.770543 -1.784856
H -3.026242 2.183555 0.387996
H -1.465143 1.950409 1.213347
H -2.662180 -1.836391 -0.337141
H -4.192263 -1.543095 -1.179594
H -3.360800 0.763441 2.426107
H -2.129329 -0.387222 1.861448
H -4.819434 0.230399 0.461857
H -4.418064 -1.267646 1.337118
H -0.608344 -1.023882 -0.314514
H 4.026384 -0.551717 0.369569
H 2.326630 3.401638 -0.281409
H 4.361594 1.967834 0.167995
H 2.582449 -3.578364 0.469295


