%chk=000245362.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245362

0 1
O 1.667676 0.374584 -1.358910
O 0.760573 -1.209106 0.014981
N -0.547857 0.538046 -0.854319
C 3.626793 0.073924 0.062447
C 5.086814 -0.392540 0.099520
C 2.964029 -0.300440 -1.258193
C 5.754501 -0.031232 1.423887
C -1.758805 0.259060 -0.125181
C 0.624535 -0.199608 -0.645861
C -0.496474 1.737154 -1.730516
C -2.030976 -1.048958 0.321062
C -2.681018 1.294746 0.119315
C -3.223420 -1.310493 0.994566
C -3.872285 1.008419 0.790542
C -4.150625 -0.288754 1.228156
H 3.057116 -0.377715 0.903158
H 3.564817 1.168925 0.217947
H 5.652139 0.060276 -0.738779
H 5.135520 -1.489418 -0.053981
H 3.476259 0.118208 -2.143165
H 2.812168 -1.388506 -1.367650
H 5.757303 1.051414 1.594754
H 5.239772 -0.494365 2.274516
H 6.796282 -0.370629 1.448011
H -0.285994 2.650401 -1.149186
H -1.451083 1.856906 -2.270018
H 0.304272 1.624364 -2.487555
H -1.309089 -1.854691 0.156088
H -2.479040 2.315592 -0.192827
H -3.431817 -2.323231 1.340379
H -4.586826 1.809783 0.976924
H -5.079560 -0.503117 1.750687


%chk=000245362-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245362

0 1
O 1.677592 0.475898 -1.331064
O 0.751423 -1.208810 -0.002029
N -0.560458 0.622409 -0.766345
C 3.750847 0.165678 0.028125
C 5.138948 -0.515922 0.092820
C 2.982074 -0.240693 -1.235362
C 5.930706 -0.114148 1.355778
C -1.791993 0.262693 -0.104737
C 0.611025 -0.128850 -0.635596
C -0.547579 1.869840 -1.567670
C -2.020416 -1.028942 0.451981
C -2.833751 1.230935 -0.023034
C -3.255711 -1.326732 1.063593
C -4.064133 0.915511 0.591783
C -4.288886 -0.365596 1.139917
H 3.157150 -0.116777 0.917645
H 3.873907 1.266286 0.044529
H 5.725384 -0.252135 -0.811233
H 5.008709 -1.616812 0.073678
H 3.512396 0.065705 -2.152927
H 2.791474 -1.328816 -1.249226
H 6.097384 0.978890 1.388932
H 5.381762 -0.398462 2.272693
H 6.918707 -0.608749 1.385224
H -0.567510 2.763967 -0.916683
H -1.426254 1.889117 -2.234975
H 0.366779 1.898397 -2.170223
H -1.230753 -1.778889 0.416276
H -2.695889 2.238663 -0.422370
H -3.407030 -2.328158 1.482459
H -4.845652 1.682144 0.642559
H -5.244549 -0.608642 1.616278


