%chk=000215378.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215378

0 1
O -0.694363 -1.480854 -0.101081
O 2.607941 0.535450 0.756881
N -0.280715 0.717371 -0.600337
N 1.547262 -0.997617 -0.646658
N 3.899832 -0.823977 -0.637438
C -1.915563 -0.776587 -0.032082
C -1.662551 0.558872 -0.306651
C -3.079980 -1.592844 0.260125
C -2.567907 1.707022 -0.320896
C 0.260640 -0.486366 -0.457843
C -4.326109 -1.266151 -0.303765
C -2.961796 -2.714006 1.100390
C -3.626694 1.781709 0.600701
C -2.373076 2.745353 -1.247953
C -5.443479 -2.052655 -0.017206
C -4.085372 -3.495035 1.378830
C -4.490999 2.878334 0.579390
C -3.243295 3.837778 -1.261783
C -5.325956 -3.165310 0.823060
C -4.303766 3.904895 -0.352326
C 2.701753 -0.325643 -0.083515
C 5.212665 -0.389690 -0.247663
C 6.299108 -0.951437 -0.950479
C 5.429528 0.530913 0.789650
C 7.598420 -0.584459 -0.598465
C 6.739258 0.881962 1.122917
C 7.824677 0.329261 0.436241
H -4.417135 -0.401873 -0.963676
H -1.991646 -2.966361 1.529577
H -3.766873 0.990704 1.337229
H -1.534122 2.697498 -1.944866
H 1.589937 -1.989334 -0.898891
H -6.409471 -1.798791 -0.452190
H -3.994118 -4.362256 2.031472
H -5.309729 2.935618 1.294759
H -3.090720 4.641364 -1.980652
H -6.200678 -3.775322 1.043467
H -4.979235 4.758139 -0.365454
H 3.859091 -1.442713 -1.450378
H 6.139209 -1.661145 -1.757422
H 4.588726 0.978005 1.330501
H 8.442495 -1.015006 -1.137319
H 6.911443 1.597463 1.928056
H 8.840664 0.610022 0.703943


%chk=000215378-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215378

0 1
O -0.713933 -1.489563 0.160770
O 2.626923 1.022291 0.572957
N -0.315278 0.705609 -0.373280
N 1.535548 -0.919693 -0.230747
N 3.845746 -0.736686 -0.435116
C -1.985439 -0.815388 0.121347
C -1.716837 0.529473 -0.158657
C -3.154408 -1.680645 0.286904
C -2.594528 1.713246 -0.214530
C 0.222600 -0.478972 -0.163690
C -4.393619 -1.376747 -0.346101
C -3.053568 -2.877156 1.053600
C -3.828340 1.780710 0.489764
C -2.164459 2.850167 -0.953220
C -5.502021 -2.234245 -0.194882
C -4.164402 -3.733587 1.196405
C -4.624476 2.943276 0.428286
C -2.965335 4.009237 -1.015726
C -5.396432 -3.415201 0.578278
C -4.202427 4.060381 -0.331155
C 2.683656 -0.099639 0.016706
C 5.196315 -0.331673 -0.222466
C 6.213676 -1.169152 -0.755179
C 5.552415 0.846483 0.485955
C 7.572018 -0.836700 -0.580830
C 6.918167 1.161211 0.655593
C 7.934489 0.331805 0.129131
H -4.479958 -0.481576 -0.969854
H -2.102038 -3.123776 1.535371
H -4.153565 0.936648 1.106613
H -1.193864 2.808844 -1.456974
H 1.650324 -1.932679 -0.306185
H -6.446651 -1.986925 -0.691849
H -4.070389 -4.647484 1.793436
H -5.568516 2.982389 0.983430
H -2.621578 4.875285 -1.592288
H -6.259846 -4.079796 0.691864
H -4.823035 4.962265 -0.377450
H 3.727604 -1.556320 -1.034954
H 5.942020 -2.081344 -1.303408
H 4.769923 1.496510 0.880981
H 8.345250 -1.491161 -0.998023
H 7.186036 2.071626 1.203360
H 8.989535 0.590951 0.266013


