%chk=000212387.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212387

0 1
O 3.553835 -0.486795 0.137749
O 3.643131 1.634739 -0.695155
N -0.751361 0.182062 -0.902233
N 2.088286 0.095560 -1.531928
N -4.267404 -0.309092 0.358206
C 0.003804 1.453169 -1.157780
C 0.140296 -0.832263 -0.248827
C -1.970766 0.444079 -0.070229
C 1.202234 1.162455 -2.083654
C 1.332020 -1.138290 -1.178580
C -3.015005 -0.649243 -0.389946
C 3.117907 0.537204 -0.676295
C -5.497308 -0.710043 -0.401955
C -4.253033 -0.907944 1.735133
C -5.710079 0.232955 -1.587146
C -5.244140 -0.169169 2.636176
C 4.818728 -0.255677 0.878699
C 5.971953 -0.431821 -0.092686
C 4.749895 -1.315711 1.965301
H -0.683122 2.164803 -1.666554
H 0.353942 1.949094 -0.226846
H -0.450312 -1.760521 -0.091682
H 0.510649 -0.511228 0.748822
H -2.405138 1.433859 -0.336299
H -1.764220 0.485215 1.019135
H 0.845658 0.804802 -3.077009
H 1.796407 2.089670 -2.252596
H 0.969561 -1.581913 -2.134876
H 2.017781 -1.875694 -0.704104
H -2.618009 -1.657276 -0.152584
H -3.206468 -0.647907 -1.486905
H -5.462534 -1.764301 -0.751594
H -6.369742 -0.631296 0.285837
H -4.475625 -1.996870 1.733871
H -3.228775 -0.794307 2.155226
H -5.697764 1.281040 -1.258344
H -4.920826 0.128847 -2.341200
H -6.670691 0.042245 -2.075022
H -5.085064 0.916771 2.582494
H -6.283266 -0.351284 2.339308
H -5.132635 -0.476416 3.680438
H 4.773373 0.779169 1.286508
H 5.902078 -1.381117 -0.638091
H 5.974988 0.372245 -0.844702
H 6.939966 -0.409080 0.418773
H 4.685556 -2.325277 1.538031
H 3.862362 -1.180831 2.596459
H 5.635179 -1.280216 2.609954


%chk=000212387-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212387

0 1
O 3.905552 -0.560642 0.213373
O 3.974275 1.580617 -0.769963
N -0.848169 0.337332 -0.615351
N 2.014674 0.288922 -0.792028
N -4.519780 -0.364012 0.183939
C -0.085933 1.594375 -0.831015
C -0.056669 -0.601604 0.219585
C -2.215217 0.573677 -0.085833
C 1.244370 1.295925 -1.547891
C 1.278532 -0.948545 -0.468546
C -3.183439 -0.580801 -0.427974
C 3.337949 0.526453 -0.483537
C -5.636755 -0.878662 -0.652938
C -4.582238 -0.840939 1.592783
C -5.934199 0.018945 -1.869284
C -5.653452 -0.115573 2.429641
C 5.360241 -0.419285 0.562580
C 6.212395 -0.782767 -0.662264
C 5.573985 -1.344628 1.763434
H -0.690513 2.272055 -1.461104
H 0.129686 2.120529 0.133856
H -0.632540 -1.532079 0.368939
H 0.156074 -0.163556 1.229295
H -2.618414 1.493418 -0.546593
H -2.207166 0.749913 1.019264
H 1.026046 0.903830 -2.561873
H 1.862098 2.203633 -1.639233
H 1.064067 -1.501711 -1.405738
H 1.903125 -1.576821 0.182283
H -2.747031 -1.562451 -0.118626
H -3.284247 -0.619233 -1.526316
H -5.442722 -1.927788 -0.994367
H -6.541044 -0.919647 -0.018687
H -4.749698 -1.948047 1.640418
H -3.593814 -0.656848 2.054248
H -6.189371 1.039069 -1.533422
H -5.065544 0.091787 -2.548642
H -6.782125 -0.386843 -2.452420
H -5.457160 0.970670 2.436300
H -6.670124 -0.273835 2.026394
H -5.646303 -0.485610 3.472111
H 5.527365 0.639557 0.834308
H 5.997996 -1.815662 -0.990687
H 6.007201 -0.088185 -1.493854
H 7.286922 -0.712738 -0.410711
H 5.358771 -2.393424 1.491431
H 4.915438 -1.058173 2.601276
H 6.623211 -1.282197 2.104736


