%chk=000202450.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202450

0 1
O -0.878597 0.045033 0.319628
O 1.982229 0.348160 -2.474092
N -4.880683 -0.831325 -0.005197
C -2.599797 -1.483783 0.733879
C -3.624025 -1.544805 -0.411400
C 1.381268 -0.004290 -1.206190
C 0.963893 1.242627 -0.462328
C -2.153063 -0.057949 1.042007
C -0.219895 1.250314 0.314458
C 2.422723 -0.792848 -0.440858
C 1.735275 2.404712 -0.506408
C -0.636697 2.396766 1.003015
C -5.718741 -1.683460 0.890116
C -5.664285 -0.425630 -1.210556
C 1.332680 3.557892 0.178495
C 2.039168 -1.433991 0.747298
C 3.740657 -0.895565 -0.900629
C 0.152605 3.548859 0.925152
C 2.976525 -2.174585 1.469789
C 4.674189 -1.640841 -0.173698
C 4.294587 -2.279927 1.010237
H -3.015559 -1.948030 1.649538
H -1.709023 -2.091044 0.457839
H -3.796239 -2.602816 -0.702235
H -3.194509 -1.039046 -1.305299
H 0.493781 -0.648204 -1.435102
H -1.947930 0.105289 2.111977
H -2.848329 0.708525 0.655807
H 2.661667 2.401902 -1.086859
H -1.548247 2.404750 1.590364
H -5.134368 -1.954663 1.783674
H -6.095441 -2.608731 0.430325
H -6.582715 -1.093386 1.236170
H -6.560489 0.127530 -0.885904
H -5.988060 -1.254985 -1.855748
H -5.059666 0.270683 -1.813986
H 1.011818 -1.342477 1.103548
H 4.025972 -0.395878 -1.828884
H 1.943291 4.455782 0.131328
H -0.160116 4.447107 1.457979
H 1.394425 0.958486 -2.961095
H 2.682051 -2.669795 2.392575
H 5.698326 -1.721921 -0.532436
H 5.022444 -2.858241 1.574705


%chk=000202450-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202450

0 1
O -1.035252 -0.035066 0.678881
O 1.487061 0.355957 -2.534276
N -4.572102 -0.811954 -0.283756
C -2.821650 -1.495435 1.396282
C -3.436447 -1.724936 -0.002436
C 1.110270 -0.032474 -1.160839
C 0.751565 1.206694 -0.330895
C -2.231057 -0.093260 1.549943
C -0.346996 1.187923 0.575850
C 2.284049 -0.816583 -0.567442
C 1.501862 2.397323 -0.460060
C -0.689906 2.345303 1.317356
C -5.808002 -1.182972 0.435031
C -4.815351 -0.638220 -1.731037
C 1.174638 3.554830 0.281609
C 2.105469 -1.507008 0.658251
C 3.542799 -0.859696 -1.211490
C 0.074928 3.523387 1.166900
C 3.175893 -2.222932 1.236778
C 4.613756 -1.578381 -0.630820
C 4.436597 -2.259967 0.594694
H -3.584430 -1.640715 2.185610
H -2.029969 -2.248432 1.573088
H -3.734294 -2.799793 -0.103030
H -2.651570 -1.533437 -0.756705
H 0.222047 -0.694918 -1.189445
H -1.926064 0.105518 2.597215
H -2.969253 0.663266 1.218474
H 2.350589 2.400765 -1.152703
H -1.538119 2.337874 2.007416
H -5.628386 -1.215418 1.523530
H -6.212202 -2.180075 0.123018
H -6.587997 -0.423575 0.247045
H -5.605219 0.118966 -1.886387
H -5.137561 -1.579344 -2.245121
H -3.894730 -0.277344 -2.222392
H 1.129092 -1.476491 1.156394
H 3.662743 -0.341148 -2.166499
H 1.769837 4.467210 0.170560
H -0.192575 4.414232 1.746307
H 0.787892 0.963690 -2.884093
H 3.028151 -2.751884 2.185553
H 5.585154 -1.608775 -1.138144
H 5.267836 -2.816505 1.042782


