%chk=000212403.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212403

0 1
O 5.151135 1.252340 0.460719
O 5.777079 -0.697293 -0.555594
N 1.249053 -0.969186 0.374104
N 4.065792 -0.683546 1.045015
N -2.412691 -0.425802 -0.343530
C 2.281605 -1.792705 -0.338623
C 1.811608 0.375272 0.731819
C 3.505497 -1.986196 0.579638
C 3.026806 0.187969 1.662057
C 0.011018 -0.828673 -0.460436
C -1.175855 -0.550656 0.487209
C -3.592621 -0.019395 0.483099
C -4.855022 -0.033230 -0.393906
C -6.075310 0.467098 0.388661
C 5.039428 -0.103845 0.206282
C -7.339485 0.453029 -0.481120
C -8.563323 0.955402 0.297812
C -9.824316 0.943081 -0.563348
C 6.267721 1.949229 -0.181125
C 5.953992 2.198092 -1.641360
H 1.836673 -2.786847 -0.562562
H 2.599610 -1.352727 -1.308471
H 2.100788 0.978657 -0.155951
H 1.023249 0.948824 1.266664
H 4.297928 -2.566572 0.053690
H 3.218231 -2.558600 1.491799
H 2.712538 -0.304263 2.611825
H 3.470842 1.173787 1.926856
H 0.078717 -0.027317 -1.228241
H -0.169111 -1.774744 -1.014689
H -1.234119 -1.344738 1.263010
H -1.013255 0.406770 1.028964
H -2.608495 -1.321736 -0.804297
H -3.403422 1.011854 0.856645
H -3.740304 -0.661600 1.378109
H -5.044206 -1.052713 -0.780351
H -4.688624 0.600321 -1.289273
H -6.231445 -0.158725 1.288487
H -5.888736 1.492987 0.761924
H -7.185415 1.079091 -1.381254
H -7.529055 -0.570563 -0.857376
H -8.376544 1.981311 0.671416
H -8.719882 0.329585 1.198132
H -10.692183 1.303667 0.000063
H -9.716938 1.584305 -1.445702
H -10.060670 -0.066091 -0.919356
H 6.300516 2.873306 0.424614
H 7.184904 1.349959 -0.039623
H 4.977866 2.681150 -1.770176
H 5.925712 1.250653 -2.203210
H 6.710716 2.836222 -2.111843


%chk=000212403-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212403

0 1
O 5.599610 1.173424 0.612965
O 6.102604 -0.914333 -0.357846
N 1.140598 -0.821265 0.111502
N 3.961544 -0.441730 0.480775
N -2.625522 -0.474681 -0.264720
C 2.120440 -1.655836 -0.631277
C 1.694334 0.537696 0.341585
C 3.432422 -1.782517 0.164428
C 3.005402 0.461476 1.149400
C -0.190602 -0.804870 -0.544545
C -1.309308 -0.277731 0.378135
C -3.768349 0.132785 0.452871
C -5.094433 -0.133617 -0.285290
C -6.314565 0.499505 0.420102
C 5.275008 -0.137433 0.197014
C -7.648769 0.224831 -0.309691
C -8.868711 0.873882 0.383319
C -10.198185 0.594312 -0.350542
C 6.989441 1.606709 0.299763
C 7.087079 2.162934 -1.123983
H 1.688888 -2.663492 -0.776799
H 2.347317 -1.228566 -1.641562
H 1.889950 1.066091 -0.627316
H 0.964438 1.136905 0.913596
H 4.197483 -2.328382 -0.410410
H 3.232274 -2.328358 1.108493
H 2.778715 0.066515 2.160760
H 3.461449 1.456711 1.248593
H -0.195859 -0.210849 -1.491583
H -0.432544 -1.851083 -0.821070
H -1.211076 -0.777828 1.372859
H -1.187657 0.809649 0.549920
H -2.801178 -1.471574 -0.459476
H -3.592971 1.226311 0.508224
H -3.857821 -0.229281 1.509898
H -5.252495 -1.230379 -0.372233
H -5.007621 0.255530 -1.318426
H -6.381729 0.117132 1.460306
H -6.162434 1.596338 0.501024
H -7.580329 0.597322 -1.353150
H -7.810034 -0.871413 -0.381472
H -8.706703 1.969060 0.453224
H -8.935043 0.502810 1.426612
H -11.053608 1.070628 0.163017
H -10.167233 0.981566 -1.386566
H -10.399425 -0.492359 -0.405663
H 7.196718 2.378017 1.059765
H 7.666389 0.745329 0.436570
H 6.365994 2.984937 -1.276925
H 6.889256 1.368096 -1.862570
H 8.104849 2.557276 -1.304406


