%chk=000201885.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201885

0 1
O 6.644422 -0.911229 1.158962
O 0.472354 2.412531 -2.050549
O -0.274351 -0.745436 -0.237744
N 3.934499 -0.352417 0.251435
N -1.597434 -1.179170 0.221911
C 2.773012 -0.361182 -0.668308
C 5.097040 0.416506 -0.264558
C 4.361525 -1.727942 0.622937
C 2.063293 1.011802 -0.720929
C 6.217967 0.447312 0.788078
C 5.485853 -1.665567 1.668595
C 0.815446 1.036058 -1.638256
C -0.419610 0.392210 -1.042448
C -1.745097 0.711063 -1.125394
C -2.445686 -0.277002 -0.334461
C -3.896504 -0.387011 -0.089451
C -4.781788 0.629693 -0.534534
C -4.426977 -1.512204 0.599482
C -6.168481 0.524730 -0.297478
C -5.811621 -1.613049 0.836788
C -6.689345 -0.596207 0.389121
H 3.069820 -0.661586 -1.708104
H 2.059944 -1.117962 -0.299277
H 4.789701 1.455173 -0.485404
H 5.493200 -0.033708 -1.211012
H 4.725432 -2.299918 -0.268034
H 3.494400 -2.268755 1.046450
H 1.796151 1.309636 0.311116
H 2.746951 1.778603 -1.130283
H 1.062756 0.545302 -2.598847
H 7.120513 0.941794 0.392111
H 5.860574 0.987256 1.691648
H 5.104038 -1.184036 2.594613
H 5.869036 -2.672371 1.903242
H -2.166406 1.530431 -1.699793
H 0.294648 2.947293 -1.233344
H -4.390810 1.507146 -1.061270
H -3.742959 -2.295881 0.940653
H -6.840820 1.316243 -0.645893
H -6.209250 -2.484407 1.368423
H -7.766237 -0.677440 0.573208


%chk=000201885-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201885

0 1
O 6.741674 -0.990700 0.939030
O 0.484589 2.577888 -1.713770
O -0.298374 -0.717194 -0.189205
N 3.984918 -0.334785 0.278768
N -1.637691 -1.189407 0.182165
C 2.723541 -0.335515 -0.499119
C 5.122855 0.290531 -0.443240
C 4.366801 -1.692982 0.748744
C 2.047460 1.055843 -0.490427
C 6.358169 0.350826 0.470489
C 5.607883 -1.604887 1.651412
C 0.816579 1.168119 -1.421915
C -0.431521 0.475918 -0.915485
C -1.771086 0.792197 -1.025319
C -2.486918 -0.257245 -0.334820
C -3.945689 -0.402140 -0.150371
C -4.844894 0.524514 -0.741836
C -4.470538 -1.474800 0.622721
C -6.237800 0.383848 -0.564221
C -5.861483 -1.612480 0.797871
C -6.752042 -0.684229 0.206094
H 2.892983 -0.658885 -1.559850
H 2.039217 -1.071103 -0.044014
H 4.852126 1.318189 -0.748701
H 5.379301 -0.285940 -1.368971
H 4.588901 -2.379218 -0.107304
H 3.524494 -2.122856 1.322552
H 1.774370 1.311847 0.551133
H 2.761823 1.821490 -0.846392
H 1.082121 0.765921 -2.418042
H 7.236941 0.735120 -0.073508
H 6.141396 1.004930 1.342689
H 5.366458 -1.006117 2.556188
H 5.955659 -2.607474 1.950510
H -2.180685 1.654752 -1.541669
H 0.293381 3.036838 -0.854584
H -4.461468 1.354744 -1.344925
H -3.777059 -2.188966 1.078163
H -6.920112 1.105249 -1.026899
H -6.253660 -2.442458 1.395711
H -7.833421 -0.793082 0.343751


