%chk=000234591.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234591

0 1
O 3.684751 0.852606 1.373965
O 3.459410 2.416964 -0.803620
N 0.185678 -2.905809 0.520523
C -0.441364 -1.648170 -0.014214
C -1.502400 -1.160277 1.006401
C 0.625663 -0.582809 -0.206753
C -2.482199 -0.218557 0.363285
C 1.656988 -0.432236 0.740616
C 0.560975 0.262317 -1.318705
C 2.608732 0.561368 0.552007
C -2.191066 1.151313 0.270777
C -3.694361 -0.704556 -0.150589
C 1.049183 -3.574123 -0.492602
C 1.516333 1.269367 -1.512773
C 2.540828 1.420204 -0.580398
C -3.105038 2.023564 -0.325135
C -4.605608 0.172709 -0.745078
C -4.314232 1.537376 -0.833199
C 3.880381 0.002238 2.529141
H -0.953210 -1.835600 -0.997736
H -2.035140 -2.024750 1.451620
H -0.994978 -0.673306 1.865909
H -0.553260 -3.557623 0.809958
H 1.693975 -1.109509 1.594101
H -0.242916 0.153071 -2.046045
H -1.245496 1.532657 0.656048
H -3.929106 -1.764334 -0.086280
H 0.529483 -3.890601 -1.408899
H 1.512280 -4.459968 -0.028870
H 1.869022 -2.894360 -0.784926
H 1.472461 1.932108 -2.375119
H -2.873451 3.085392 -0.394492
H -5.545503 -0.208780 -1.140093
H -5.024980 2.218677 -1.295216
H 4.147870 2.429487 -0.082820
H 4.039816 -1.033828 2.215019
H 3.029770 0.092740 3.211283
H 4.790109 0.428340 2.970308


%chk=000234591-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234591

0 1
O 3.640474 0.946170 1.281063
O 3.389631 2.471034 -0.902033
N 0.218078 -2.958361 0.554398
C -0.432358 -1.761201 -0.030421
C -1.543333 -1.287201 0.969486
C 0.597737 -0.660244 -0.295587
C -2.477751 -0.238327 0.390342
C 1.632407 -0.434258 0.651453
C 0.513898 0.166312 -1.437819
C 2.553568 0.604336 0.442463
C -2.223473 1.146621 0.559777
C -3.620379 -0.628542 -0.356109
C 1.131414 -3.686230 -0.348274
C 1.439593 1.217301 -1.646192
C 2.460514 1.441139 -0.707939
C -3.086365 2.115633 -0.000196
C -4.486101 0.335944 -0.919209
C -4.221481 1.714147 -0.741955
C 3.836424 0.146315 2.489831
H -0.936823 -1.996277 -1.001849
H -2.133895 -2.180847 1.261179
H -1.040788 -0.914610 1.880619
H -0.475262 -3.582525 0.986429
H 1.696577 -1.108769 1.512185
H -0.284530 -0.000769 -2.169670
H -1.340363 1.464639 1.126322
H -3.837177 -1.696622 -0.488776
H 0.657278 -4.012378 -1.305325
H 1.525142 -4.580392 0.167086
H 1.988446 -3.039864 -0.607537
H 1.382418 1.864334 -2.526394
H -2.872656 3.181245 0.140933
H -5.366238 0.015344 -1.488584
H -4.892566 2.465091 -1.174134
H 4.027274 2.458838 -0.139372
H 4.020846 -0.915180 2.236328
H 2.957985 0.219223 3.159369
H 4.721235 0.572233 2.985512


