%chk=000208814.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208814

0 1
O -6.383795 -1.040641 -0.076048
O 1.384197 2.966183 2.306408
O -0.924074 2.799439 0.784487
N -3.573497 -0.573505 -0.267622
N -0.110539 0.921936 -0.249563
N 0.894609 0.016247 -0.476416
C 1.474602 2.462049 0.972395
C -2.185785 -0.375651 0.258337
C -1.449027 0.508183 -0.771521
C 2.388142 1.235576 1.106901
C -4.105045 -1.929223 0.090976
C -4.499462 0.489339 0.247042
C 0.030385 2.089903 0.527363
C 2.050801 0.152384 0.119224
C -5.500601 -2.083478 -0.536227
C -5.883337 0.277185 -0.385159
C 2.007618 3.530193 0.026550
C 3.105567 -0.844590 -0.187649
C 3.394903 -1.175154 -1.520768
C 3.817981 -1.455257 0.857222
C 4.399779 -2.104257 -1.804534
C 4.819205 -2.384009 0.564461
C 5.113516 -2.707517 -0.764700
H -1.656878 -1.348884 0.350893
H -2.154787 0.092571 1.265732
H -2.029571 1.435242 -0.988607
H -1.321570 -0.041103 -1.731716
H 2.299121 0.838500 2.148023
H 3.451849 1.542712 1.017693
H -4.165358 -2.095759 1.187813
H -3.419413 -2.697104 -0.326658
H -4.094094 1.482361 -0.044745
H -4.587502 0.487373 1.355201
H -5.457262 -2.056018 -1.639433
H -6.013758 -2.998254 -0.192755
H -6.651590 0.932896 0.059995
H -5.857377 0.402549 -1.481856
H 2.925339 3.981250 0.429373
H 2.244876 3.120725 -0.963215
H 1.289267 4.348919 -0.118311
H 0.692437 3.671891 2.368587
H 2.829218 -0.713675 -2.330847
H 3.587721 -1.215249 1.893771
H 4.623569 -2.359993 -2.839445
H 5.370639 -2.859339 1.374599
H 5.895882 -3.431046 -0.988349


%chk=000208814-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208814

0 1
O -6.334073 -1.261452 -0.335881
O 1.608855 3.326926 2.373857
O -0.839581 3.056738 1.161489
N -3.512246 -0.572662 -0.305275
N -0.137031 1.142057 0.008510
N 0.848632 0.196473 -0.353184
C 1.562930 2.561778 1.129495
C -2.160791 -0.313801 0.235460
C -1.478243 0.840384 -0.534699
C 2.323962 1.244066 1.363394
C -3.964279 -1.977358 -0.129512
C -4.541170 0.365393 0.217597
C 0.086676 2.266384 0.792576
C 2.021973 0.234549 0.266701
C -5.306882 -2.182515 -0.850932
C -5.878713 0.129481 -0.502056
C 2.169863 3.390349 -0.031274
C 3.010623 -0.803531 -0.120290
C 2.783249 -1.628920 -1.260291
C 4.193835 -1.010389 0.642401
C 3.709844 -2.623981 -1.622506
C 5.119445 -2.012582 0.278649
C 4.884742 -2.821895 -0.855330
H -1.545649 -1.223643 0.108579
H -2.177911 -0.070540 1.326261
H -2.069899 1.766457 -0.460085
H -1.368663 0.556910 -1.594139
H 2.012321 0.834017 2.346220
H 3.401830 1.463110 1.434114
H -4.088778 -2.240893 0.950961
H -3.206269 -2.656548 -0.563374
H -4.215591 1.408304 0.049743
H -4.686915 0.227971 1.318611
H -5.168805 -2.017101 -1.941408
H -5.704107 -3.195876 -0.674747
H -6.678475 0.754103 -0.071113
H -5.764262 0.359570 -1.583302
H 3.190513 3.700188 0.252883
H 2.222382 2.811238 -0.971365
H 1.566983 4.297996 -0.208469
H 0.757086 3.845895 2.419486
H 1.873831 -1.468245 -1.846475
H 4.393555 -0.401682 1.530352
H 3.522325 -3.245893 -2.504882
H 6.022903 -2.160040 0.880421
H 5.606876 -3.594888 -1.140272


