%chk=000201756.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201756

0 1
O 0.034523 0.202725 1.718953
N 1.172746 0.513511 -0.283115
N -1.160075 0.006004 -0.242324
C 2.482765 0.473332 0.437511
C -2.461554 -0.121625 0.468333
C 3.451153 1.490567 -0.142434
C 3.008353 -0.954201 0.414255
C -3.112999 -1.392516 -0.054689
C -3.331380 1.117661 0.313056
C 0.016134 0.221168 0.495148
C 4.814614 1.381842 0.181698
C 2.714272 -1.798358 1.494944
C -3.672381 -1.439576 -1.340381
C -4.728630 1.003299 0.378399
C 3.016729 2.564834 -0.929613
C 3.732245 -1.448911 -0.679032
C -3.122289 -2.539460 0.750887
C -2.752398 2.387340 0.175283
C 5.728747 2.323043 -0.294332
C 3.157177 -3.123527 1.487357
C -4.240685 -2.625247 -1.812472
C -5.533981 2.140861 0.282986
C 3.936961 3.504474 -1.406901
C 4.172556 -2.775385 -0.683119
C -3.694350 -3.723071 0.274825
C -3.561522 3.523297 0.077801
C 5.293097 3.385486 -1.094150
C 3.888058 -3.613299 0.399951
C -4.253366 -3.768251 -1.005899
C -4.953211 3.403470 0.127605
H 2.287594 0.786722 1.511744
H -2.241527 -0.226580 1.577635
H 1.219694 0.163607 -1.240696
H -1.203183 0.142551 -1.245885
H 5.162988 0.559331 0.807130
H 2.125787 -1.421600 2.335405
H -3.674381 -0.548172 -1.966063
H -5.194137 0.025497 0.506290
H 1.959230 2.685109 -1.164835
H 3.961761 -0.797173 -1.521644
H -2.678982 -2.513984 1.746344
H -1.668728 2.502404 0.158220
H 6.783408 2.230506 -0.040069
H 2.929279 -3.775533 2.329193
H -4.675319 -2.658886 -2.810115
H -6.617205 2.042352 0.332601
H 3.590652 4.334395 -2.020608
H 4.738460 -3.155996 -1.531556
H -3.700998 -4.612000 0.903836
H -3.102939 4.504984 -0.030749
H 6.007076 4.117376 -1.465646
H 4.233047 -4.645499 0.395840
H -4.696938 -4.690920 -1.375132
H -5.581445 4.288521 0.052030


%chk=000201756-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201756

0 1
O -0.007308 0.251068 1.817394
N 1.178101 0.395097 -0.198440
N -1.176018 0.404243 -0.207431
C 2.494568 0.215822 0.450742
C -2.498768 0.239506 0.433028
C 3.472895 1.346123 0.090315
C 3.018755 -1.205629 0.182654
C -3.023198 -1.186463 0.190918
C -3.470828 1.363892 0.038629
C -0.002105 0.333761 0.546623
C 4.864197 1.192495 0.327540
C 2.709811 -2.240350 1.100743
C -3.714667 -1.537436 -0.996915
C -4.866321 1.213988 0.252309
C 3.003705 2.590728 -0.397249
C 3.728893 -1.530443 -1.001572
C -2.734363 -2.199287 1.139325
C -2.992204 2.601776 -0.457204
C 5.761509 2.252043 0.072172
C 3.102538 -3.572838 0.843873
C -4.105690 -2.874102 -1.232362
C -5.758202 2.270291 -0.033927
C 3.900870 3.651301 -0.659280
C 4.118238 -2.862770 -1.263340
C -3.129011 -3.536095 0.908743
C -3.883790 3.658895 -0.750109
C 5.284992 3.486429 -0.427827
C 3.807493 -3.889072 -0.340635
C -3.815456 -3.878505 -0.279333
C -5.272036 3.497597 -0.541832
H 2.268962 0.293466 1.532944
H -2.283729 0.339455 1.515471
H 1.146531 0.336797 -1.218459
H -1.137341 0.339804 -1.226854
H 5.245401 0.240675 0.714304
H 2.149264 -1.996908 2.011471
H -3.960867 -0.761423 -1.732137
H -5.255208 0.267756 0.644920
H 1.928742 2.728819 -0.555462
H 3.991019 -0.737679 -1.712995
H -2.187404 -1.935549 2.052612
H -1.914434 2.737589 -0.597365
H 6.831891 2.114737 0.263447
H 2.859754 -4.361508 1.564882
H -4.639702 -3.132182 -2.154071
H -6.831988 2.135855 0.139490
H 3.518007 4.606597 -1.036556
H 4.666825 -3.100412 -2.181981
H -2.902028 -4.307757 1.652950
H -3.493555 4.608829 -1.133315
H 5.981789 4.307891 -0.628843
H 4.113307 -4.922033 -0.541577
H -4.122722 -4.914806 -0.459852
H -5.964611 4.316415 -0.766776


