%chk=000197959.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197959

0 1
O 1.523118 -2.036842 0.550792
O -4.983965 1.700712 0.197206
N 5.266467 0.603754 -0.287052
N 1.667994 -0.318317 -0.941486
N -4.732282 -0.581119 0.000990
C 3.784487 0.674295 -0.088367
C 5.874198 -0.494641 0.535702
C 5.924828 1.924823 -0.071143
C 3.145002 -0.382133 -1.018886
C 7.246987 -0.870171 -0.023762
C 5.790395 2.530281 1.328973
C 0.955210 -1.168444 -0.093720
C -0.525173 -0.961314 -0.081567
C -1.095414 0.307851 0.083349
C -1.353113 -2.089165 -0.193210
C -3.307630 -0.666197 -0.017721
C -2.479524 0.463815 0.113326
C -2.737972 -1.951090 -0.169935
C -5.502727 0.609379 0.113378
C -6.998778 0.347686 0.110558
C -7.772959 1.651826 0.257744
H 3.468615 0.497343 0.962099
H 3.416294 1.685766 -0.359426
H 5.202486 -1.382538 0.483435
H 5.958945 -0.228225 1.611583
H 5.511144 2.627552 -0.828605
H 7.002334 1.800611 -0.323980
H 3.468264 -0.220026 -2.070081
H 3.486686 -1.405821 -0.728605
H 7.615032 -1.794468 0.433521
H 7.991707 -0.087335 0.155449
H 7.198498 -1.028802 -1.109502
H 6.331846 3.479734 1.399337
H 6.199310 1.864396 2.097954
H 4.746437 2.729038 1.592166
H 1.208603 0.404979 -1.480492
H -0.458026 1.185496 0.202610
H -0.901320 -3.080083 -0.292426
H -2.917678 1.460128 0.242176
H -3.366408 -2.833187 -0.262131
H -5.223783 -1.474735 -0.071848
H -7.269027 -0.344642 0.935684
H -7.295107 -0.161421 -0.830871
H -7.533541 2.354885 -0.552844
H -8.854481 1.478412 0.247552
H -7.520080 2.165755 1.195980


%chk=000197959-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000197959

0 1
O 1.587568 -1.835604 0.305941
O -5.316713 1.597431 -0.691772
N 5.331597 0.574310 -0.238583
N 1.678241 -0.012760 -1.128349
N -4.749435 -0.492148 0.217369
C 3.865659 0.765979 -0.163043
C 5.790872 -0.645733 0.476741
C 6.125319 1.800712 0.023019
C 3.143651 -0.072154 -1.253274
C 7.188335 -1.118935 0.035608
C 6.085109 2.352240 1.475672
C 0.986946 -0.897832 -0.315797
C -0.505073 -0.715531 -0.216764
C -1.202528 0.445875 -0.638922
C -1.252071 -1.774078 0.361529
C -3.337415 -0.519049 0.053220
C -2.601368 0.556637 -0.513065
C -2.645968 -1.682450 0.493017
C -5.659412 0.505431 -0.151429
C -7.127835 0.151055 0.125587
C -7.944019 1.386400 0.560269
H 3.442162 0.484353 0.828986
H 3.635465 1.837180 -0.321692
H 5.060069 -1.447233 0.263798
H 5.776142 -0.507584 1.586674
H 5.762442 2.582987 -0.671627
H 7.175063 1.600455 -0.261566
H 3.444487 0.286345 -2.253050
H 3.443869 -1.129692 -1.160441
H 7.431522 -2.084176 0.516813
H 7.980304 -0.400574 0.315137
H 7.216552 -1.254227 -1.060088
H 6.675710 3.284888 1.545903
H 6.508344 1.630987 2.198214
H 5.049673 2.581006 1.788736
H 1.168814 0.692848 -1.659156
H -0.664794 1.308796 -1.050805
H -0.704946 -2.657678 0.705076
H -3.131307 1.454286 -0.835073
H -3.205895 -2.514739 0.939218
H -5.153045 -1.322879 0.657364
H -7.207405 -0.655119 0.881135
H -7.550414 -0.252905 -0.816696
H -7.799494 2.204354 -0.164978
H -9.019801 1.144148 0.614768
H -7.619077 1.752178 1.550280


