%chk=000297214.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297214

0 1
O 1.813773 0.335477 -0.421717
O 1.044938 2.459461 -0.239176
O -0.951708 -3.505188 -0.091986
O -3.954232 2.838018 0.116483
O -3.103326 -3.333543 0.099712
O -5.181083 1.055363 0.235949
N -1.984297 -2.867508 -0.003624
N -4.114284 1.632589 0.140759
C 3.225606 0.809266 -0.523682
C 5.560871 -0.614835 0.584871
C 3.727122 1.052618 0.867907
C 3.891218 -0.322812 -1.247304
C 4.791014 0.412157 1.361166
C 4.955193 -0.956377 -0.743832
C -0.494083 0.597814 -0.154359
C 0.833106 1.269018 -0.267444
C -1.638826 1.401900 -0.064012
C -0.597136 -0.799414 -0.134473
C -1.867851 -1.387574 -0.024258
C -2.896587 0.787237 0.045321
C -3.028686 -0.607727 0.066805
H 3.212645 1.749536 -1.125957
H 6.605366 -0.255361 0.433286
H 5.655112 -1.543208 1.194915
H 3.165798 1.792763 1.438095
H 3.439614 -0.593064 -2.200422
H 5.164809 0.607817 2.367225
H 5.449419 -1.765804 -1.283520
H -1.552918 2.502623 -0.077921
H 0.307645 -1.429064 -0.204196
H -4.023130 -1.080675 0.153590


%chk=000297214-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297214

0 1
O 1.839714 0.274515 -0.404297
O 0.984920 2.452589 -0.324573
O -1.026135 -3.608968 -0.068858
O -3.953907 2.922075 0.130413
O -3.286493 -3.376637 0.143430
O -5.279260 1.069851 0.282757
N -2.096490 -2.897895 0.023749
N -4.133684 1.647343 0.163242
C 3.284963 0.841383 -0.544721
C 5.583631 -0.671239 0.640072
C 3.813843 1.119600 0.836837
C 4.044018 -0.205667 -1.307583
C 4.848018 0.423674 1.376563
C 5.082753 -0.894775 -0.767538
C -0.519987 0.544441 -0.173353
C 0.824287 1.206526 -0.306474
C -1.660346 1.374933 -0.074111
C -0.656321 -0.862705 -0.140726
C -1.946240 -1.413804 -0.010106
C -2.927354 0.775503 0.056129
C -3.104267 -0.620439 0.091016
H 3.145667 1.777947 -1.117120
H 6.671120 -0.443161 0.620017
H 5.510571 -1.621391 1.213447
H 3.322867 1.924352 1.396109
H 3.717607 -0.398384 -2.336180
H 5.195078 0.665946 2.389601
H 5.605339 -1.648877 -1.370460
H -1.552270 2.463316 -0.097702
H 0.219807 -1.511052 -0.214208
H -4.096343 -1.067497 0.192827


