%chk=000268184.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268184

0 1
O 1.013188 1.030964 -0.827666
O 0.556878 0.225509 1.275606
N -1.116006 0.496479 -0.338634
C -3.493119 0.587645 0.320134
C -4.143868 0.505232 -1.083250
C -2.183069 -0.241643 0.400325
C -4.462121 0.135352 1.429658
C -4.330861 -0.952737 -1.541435
C -5.477264 1.280232 -1.104079
C -2.342732 -1.672708 -0.150535
C -2.998195 -1.710275 -1.534647
C -5.760773 0.950920 1.390150
C -6.434080 0.851202 0.015280
C 4.679060 0.112651 -0.396310
C 0.178508 0.524757 0.160406
C 5.120593 0.652990 0.979064
C 5.385447 -1.227606 -0.691792
C 3.151830 -0.077464 -0.457099
C 6.645820 0.807794 1.048626
C 6.910981 -1.073495 -0.625313
C 7.356036 -0.516222 0.734031
C 2.409323 1.253472 -0.452706
H -3.234002 1.660825 0.510362
H -3.454978 1.006887 -1.808423
H -1.856234 -0.307104 1.477038
H -3.981768 0.245229 2.420136
H -4.694140 -0.940937 1.315708
H -4.773446 -0.975894 -2.554128
H -5.058335 -1.463375 -0.881303
H -5.265450 2.363368 -1.010836
H -5.969470 1.152702 -2.086080
H -2.952600 -2.258502 0.565890
H -1.356818 -2.175418 -0.182630
H -2.313587 -1.284028 -2.292392
H -3.162489 -2.761714 -1.839766
H -6.451841 0.594806 2.176794
H -5.547524 2.010813 1.628555
H -7.343358 1.480489 -0.006746
H -6.776270 -0.186880 -0.159998
H -1.271172 0.681302 -1.327814
H 4.983100 0.847797 -1.181018
H 4.635783 1.624642 1.182958
H 4.775432 -0.030362 1.778859
H 5.055301 -1.994020 0.035015
H 5.089459 -1.601430 -1.688779
H 2.873804 -0.646913 -1.366115
H 2.802558 -0.696705 0.396467
H 6.940303 1.163545 2.053547
H 6.977335 1.588570 0.337827
H 7.256471 -0.403617 -1.435800
H 7.394701 -2.050862 -0.808658
H 8.451592 -0.369412 0.742565
H 7.138003 -1.254437 1.529595
H 2.729903 1.939151 -1.257639
H 2.437461 1.756736 0.529297


%chk=000268184-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268184

0 1
O 0.944709 0.667781 -1.043271
O 0.397163 0.233371 1.218432
N -1.099564 -0.186892 -0.550191
C -3.386572 0.386509 0.303438
C -4.125191 0.468870 -1.068277
C -2.233083 -0.664047 0.271141
C -4.371463 0.129419 1.475175
C -4.611849 -0.925979 -1.545385
C -5.268622 1.517437 -1.005842
C -2.723911 -2.044822 -0.237819
C -3.448246 -1.945579 -1.602272
C -5.484680 1.203569 1.518200
C -6.244442 1.276461 0.172440
C 4.745668 0.170268 -0.438329
C 0.090888 0.227867 -0.003934
C 5.026403 0.726424 0.983849
C 5.628362 -1.077887 -0.707639
C 3.250471 -0.175882 -0.661185
C 6.530978 1.010577 1.209896
C 7.132431 -0.795297 -0.484951
C 7.393445 -0.244188 0.936828
C 2.320831 1.045722 -0.622788
H -2.914223 1.374320 0.491348
H -3.390719 0.827483 -1.824388
H -1.825388 -0.772082 1.293306
H -3.808603 0.125882 2.429740
H -4.840038 -0.870385 1.380120
H -5.080519 -0.826507 -2.544565
H -5.397346 -1.313332 -0.866979
H -4.820642 2.526304 -0.890025
H -5.822766 1.522820 -1.966092
H -3.422047 -2.468585 0.510271
H -1.861168 -2.734095 -0.300820
H -2.730162 -1.642899 -2.394171
H -3.825412 -2.943114 -1.898629
H -6.188823 0.989588 2.345670
H -5.027486 2.191900 1.732640
H -6.998414 2.086843 0.203827
H -6.803882 0.332277 0.015093
H -1.192941 -0.129351 -1.564714
H 5.037854 0.953811 -1.174719
H 4.443487 1.651043 1.161582
H 4.674690 -0.016974 1.730157
H 5.305836 -1.894358 -0.026970
H 5.456847 -1.438832 -1.741668
H 3.135013 -0.667177 -1.648036
H 2.920897 -0.901674 0.108327
H 6.695610 1.371804 2.243800
H 6.854138 1.827133 0.530529
H 7.480147 -0.051722 -1.232411
H 7.721412 -1.717903 -0.654377
H 8.467640 -0.007835 1.066739
H 7.143360 -1.027604 1.682400
H 2.625820 1.809433 -1.359001
H 2.267399 1.488387 0.386804


