%chk=000288897.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288897

0 1
O 1.845283 -3.261407 0.827834
N -1.930346 -0.536401 0.037958
C 2.432910 -1.051856 0.075803
C -2.335945 0.114121 -1.250810
C -2.607336 0.061784 1.234915
C -3.857280 -0.025537 -1.425172
C -4.129973 -0.073153 1.074250
C -0.483895 -0.635096 0.196647
C -4.609363 0.575226 -0.230743
C 1.815393 0.337730 0.101724
C 0.420110 0.538889 0.175999
C 1.439609 -2.173951 0.475355
C 0.003461 -1.881619 0.350893
C 3.620158 -1.131306 1.046981
C 2.870303 -1.372889 -1.364366
C 2.667825 1.453762 0.032310
C -0.077917 1.852951 0.242530
C 2.157546 2.749712 0.075747
C 0.777436 2.950964 0.192926
H -1.809710 -0.416054 -2.074949
H -2.043992 1.184360 -1.312116
H -2.333258 1.129799 1.391355
H -2.268244 -0.501176 2.132333
H -4.118108 -1.098940 -1.526176
H -4.168950 0.462120 -2.366448
H -4.636789 0.382043 1.944316
H -4.405132 -1.147818 1.077741
H -4.455775 1.669931 -0.193242
H -5.697965 0.422191 -0.352350
H -0.657437 -2.753696 0.393200
H 3.951053 -2.175783 1.166354
H 4.481249 -0.555264 0.695849
H 3.349873 -0.763861 2.043452
H 2.023040 -1.343219 -2.059508
H 3.617862 -0.657981 -1.724691
H 3.318356 -2.374184 -1.424573
H 3.744906 1.304740 -0.051052
H -1.153947 2.023270 0.343216
H 2.831184 3.604229 0.024133
H 0.375306 3.960969 0.244374


%chk=000288897-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288897

0 1
O 1.298605 -3.024898 1.305221
N -1.896725 0.525516 0.619075
C 2.164522 -1.051820 0.146003
C -2.490543 1.237997 -0.548707
C -2.931790 -0.138396 1.450196
C -3.350145 0.276848 -1.411892
C -3.800903 -1.138952 0.648903
C -0.582171 0.033021 0.587657
C -4.438000 -0.425460 -0.566847
C 1.828693 0.431044 -0.055268
C 0.517713 0.951751 0.177126
C 1.057055 -1.832593 0.908477
C -0.266263 -1.253007 1.020710
C 3.499538 -1.238061 0.924980
C 2.292298 -1.748865 -1.252238
C 2.850283 1.326743 -0.459432
C 0.312093 2.360785 0.117773
C 2.618189 2.711974 -0.583776
C 1.344918 3.236415 -0.263121
H -1.689687 1.672312 -1.164917
H -3.126378 2.066548 -0.172386
H -3.589836 0.663559 1.845941
H -2.445081 -0.618676 2.314507
H -2.686545 -0.481303 -1.872549
H -3.809984 0.855432 -2.236511
H -4.583010 -1.556259 1.311499
H -3.176144 -1.984107 0.302084
H -5.168334 0.329730 -0.207634
H -5.002452 -1.146252 -1.187293
H -1.037736 -1.936665 1.386878
H 3.596532 -2.303966 1.192192
H 4.372689 -0.946656 0.314837
H 3.507460 -0.642491 1.855135
H 1.354641 -1.664990 -1.831043
H 3.104524 -1.282112 -1.838633
H 2.521394 -2.818677 -1.103665
H 3.853527 0.936442 -0.658675
H -0.655522 2.770977 0.420497
H 3.429833 3.378537 -0.895524
H 1.164241 4.316171 -0.297580


