%chk=000181927.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181927

0 1
O 1.682568 -1.410679 0.092977
O -3.307123 0.792877 0.905202
O 5.100406 -1.114859 0.379655
N 5.754128 -0.179256 -0.433620
C 0.470783 -0.776001 0.232705
C -2.064007 0.211197 0.603733
C 2.823367 -0.625656 -0.374167
C -0.544486 -1.646043 0.695072
C 0.224696 0.575424 -0.042545
C -1.824550 -1.145137 0.884037
C -1.068907 1.074759 0.142074
C 3.960724 -1.647295 -0.355664
C -4.420075 0.382476 0.181184
C -4.375346 -0.419751 -0.963716
C -5.625303 0.888219 0.702296
C -5.582752 -0.722927 -1.601473
C -6.810244 0.570205 0.043265
C -6.794257 -0.234797 -1.105118
C 6.802472 0.350678 0.133211
C 7.563552 1.363493 -0.668667
C 7.320978 0.039276 1.501679
H 3.010848 0.203549 0.331677
H 2.600542 -0.237880 -1.380731
H -0.302006 -2.687468 0.898705
H 1.010074 1.238279 -0.392449
H -2.633452 -1.778327 1.247414
H -1.302663 2.119792 -0.058476
H 3.704667 -2.531661 0.265297
H 4.266804 -1.963511 -1.365901
H -3.432380 -0.791544 -1.354516
H -5.610557 1.509245 1.594221
H -5.572994 -1.345701 -2.495938
H -7.757911 0.949714 0.425284
H -7.726441 -0.476992 -1.608664
H 8.622216 1.081701 -0.754169
H 7.171216 1.473806 -1.692362
H 7.515511 2.354125 -0.194940
H 6.570493 -0.488564 2.113034
H 7.611824 0.944538 2.049259
H 8.203886 -0.613908 1.447535


%chk=000181927-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181927

0 1
O 1.700930 -1.620089 0.431373
O -3.414510 0.695335 0.945645
O 5.358085 -1.069380 0.746946
N 5.640163 -0.210035 -0.431560
C 0.456845 -0.977664 0.545733
C -2.136788 0.109586 0.729393
C 2.907991 -0.806815 0.641065
C -0.677210 -1.808834 0.361921
C 0.288185 0.400314 0.828904
C -1.972957 -1.271095 0.457701
C -1.015415 0.939544 0.917026
C 4.090122 -1.770046 0.489790
C -4.495880 0.411636 0.075613
C -4.330261 0.045024 -1.281295
C -5.784646 0.594218 0.626885
C -5.477842 -0.147183 -2.083437
C -6.920062 0.400994 -0.188360
C -6.774240 0.025862 -1.545579
C 6.784963 0.418023 -0.271066
C 7.200475 1.326292 -1.407364
C 7.676445 0.281602 0.944601
H 2.900660 -0.358659 1.655255
H 2.977091 -0.002492 -0.116935
H -0.521862 -2.872115 0.155916
H 1.149047 1.058414 0.976776
H -2.847811 -1.916773 0.333079
H -1.170978 1.999784 1.137435
H 4.047872 -2.564854 1.253400
H 4.097825 -2.219342 -0.518806
H -3.328758 -0.077081 -1.705162
H -5.873766 0.884306 1.678146
H -5.353238 -0.427660 -3.135447
H -7.919416 0.541193 0.238448
H -7.657547 -0.125935 -2.174769
H 8.172639 1.002092 -1.825449
H 6.447315 1.319878 -2.211609
H 7.331232 2.364486 -1.046439
H 7.159071 0.650938 1.849805
H 8.614614 0.843777 0.811678
H 7.907917 -0.781852 1.137142


