%chk=000202734.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202734

0 1
O -0.085931 0.712614 0.040673
N -4.745404 -0.422687 -0.119607
N 2.092613 1.275598 0.750229
N 3.119802 2.143932 0.462352
C -3.751497 0.559134 -0.662829
C -2.376089 0.246726 -0.049697
C -6.139220 0.133578 -0.146891
C -4.665260 -1.732145 -0.851271
C -1.343416 1.281790 -0.475849
C 0.995986 1.527039 -0.090267
C -6.305007 1.189890 0.946516
C -5.291725 -2.840209 -0.003684
C 2.301900 0.103707 1.623538
C 1.305545 2.640394 -0.871885
C 2.646356 2.994746 -0.495236
C 2.693745 -1.121750 0.830339
C 3.447665 4.114310 -1.033873
C 4.030421 -1.539487 0.792323
C 1.713443 -1.842205 0.132151
C 4.380542 -2.687068 0.074101
C 2.068856 -2.987135 -0.584352
C 3.401450 -3.413428 -0.610579
H -4.060038 1.587240 -0.367358
H -3.693412 0.553598 -1.772077
H -2.036231 -0.769165 -0.339634
H -2.457452 0.209327 1.057582
H -6.415970 0.556763 -1.136276
H -6.847336 -0.703995 0.049336
H -5.145685 -1.696485 -1.852720
H -3.591469 -1.972233 -1.023418
H -1.240594 1.375715 -1.569989
H -1.497328 2.271280 -0.014944
H -5.962550 0.802781 1.916572
H -5.720580 2.093355 0.740453
H -7.353855 1.484162 1.053275
H -5.101145 -3.825558 -0.440313
H -6.376332 -2.718983 0.096068
H -4.876831 -2.834536 1.014063
H 3.084519 0.363049 2.378561
H 1.352327 -0.079715 2.184184
H 0.707297 3.126596 -1.605573
H 2.951216 5.079214 -0.855204
H 4.445988 4.165109 -0.570490
H 3.593439 4.008011 -2.119071
H 4.798193 -0.965391 1.309991
H 0.678139 -1.493687 0.138088
H 5.419256 -3.011494 0.045420
H 1.308265 -3.546514 -1.125556
H 3.676196 -4.306785 -1.167773


%chk=000202734-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202734

0 1
O -0.106783 0.835699 0.433246
N -4.851636 -0.340416 -0.254843
N 2.208034 1.237622 0.770414
N 3.255847 2.095426 0.388402
C -3.778857 0.632022 -0.585357
C -2.447403 0.296683 0.124160
C -6.212696 0.258887 -0.327761
C -4.738299 -1.600864 -1.040446
C -1.333019 1.262187 -0.279858
C 1.021623 1.588926 0.159211
C -6.540221 1.155954 0.881107
C -5.384017 -2.808506 -0.334743
C 2.471255 0.083503 1.637207
C 1.270924 2.717626 -0.642141
C 2.668708 2.989534 -0.466054
C 2.819514 -1.193189 0.872157
C 3.490203 4.088946 -1.082067
C 3.881320 -1.194782 -0.068389
C 2.103829 -2.391159 1.108778
C 4.220142 -2.379472 -0.757657
C 2.445921 -3.580006 0.422721
C 3.505772 -3.576733 -0.512281
H -4.110235 1.635945 -0.259903
H -3.611621 0.698789 -1.692381
H -2.126761 -0.733042 -0.119970
H -2.603416 0.336946 1.216670
H -6.354904 0.834109 -1.278649
H -6.942847 -0.570198 -0.354683
H -5.176306 -1.480215 -2.064503
H -3.663581 -1.814804 -1.186338
H -1.139133 1.228491 -1.371909
H -1.569833 2.307333 0.008822
H -6.458078 0.575128 1.816045
H -5.853533 2.019070 0.956756
H -7.568643 1.555020 0.799067
H -5.260982 -3.723439 -0.944059
H -6.466572 -2.660328 -0.169615
H -4.910710 -2.970413 0.649138
H 3.311198 0.384157 2.288360
H 1.582362 -0.082908 2.269465
H 0.564449 3.270631 -1.256124
H 3.103296 5.087347 -0.805752
H 4.533552 4.013754 -0.733062
H 3.487253 4.025852 -2.186156
H 4.425848 -0.262309 -0.257838
H 1.273195 -2.393424 1.825594
H 5.041395 -2.371842 -1.483492
H 1.885413 -4.502240 0.614113
H 3.771837 -4.496297 -1.046005


