%chk=000278706.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278706

0 1
O 0.403576 -1.360858 1.702565
O 4.027036 1.808934 -2.660877
O 2.643403 0.078742 -2.392309
N 0.520773 -0.914208 -0.567550
C -4.948574 0.321341 -1.663102
C -3.470007 0.032111 -1.544577
C -3.143056 -0.342573 -0.204549
C -5.454194 0.080233 -0.258343
C -4.376644 -0.312427 0.595279
C -1.844741 -0.658711 0.157077
C -2.485344 0.087328 -2.516342
C -0.848170 -0.599193 -0.843252
C -6.742394 0.192109 0.236682
C -4.601331 -0.589190 1.935690
C -1.164530 -0.229213 -2.164606
C -6.962305 -0.090245 1.598071
C -5.912150 -0.473727 2.432366
C 2.535218 -1.534933 0.616952
C 1.055221 -1.263717 0.680685
C 3.463204 -0.483392 0.567576
C 3.023581 0.933224 0.592945
C 2.974054 -2.864321 0.629697
C 4.835272 -0.773089 0.521464
C 2.923021 1.696731 -0.584764
C 2.728630 1.533126 1.825898
C 4.342148 -3.145986 0.585141
C 5.270231 -2.100878 0.528595
C 2.570875 3.053788 -0.521420
C 2.356706 2.878671 1.882735
C 2.286204 3.642054 0.712026
C 3.142327 1.074919 -1.910157
H -5.440287 -0.346106 -2.395612
H -5.139904 1.358639 -1.995753
H -1.594111 -0.945408 1.182693
H -2.720449 0.369745 -3.539991
H -7.568833 0.489184 -0.402331
H -3.784708 -0.889237 2.589611
H -0.387147 -0.188067 -2.925694
H -7.970401 -0.006783 2.001168
H -6.104325 -0.688025 3.482044
H 1.174890 -0.826311 -1.370403
H 2.246457 -3.676632 0.678563
H 5.560083 0.040144 0.483567
H 2.781206 0.938400 2.740664
H 4.684165 -4.180399 0.594897
H 6.337029 -2.321824 0.491697
H 2.520209 3.643024 -1.439381
H 2.119879 3.334585 2.845584
H 2.004747 4.693668 0.761507
H 4.180360 1.413454 -3.564123


%chk=000278706-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278706

0 1
O 0.329224 -1.817473 1.767917
O 3.718615 1.862995 -3.051533
O 2.595226 -0.047749 -2.388844
N 0.524374 -0.832445 -0.371261
C -4.931292 0.534089 -1.618822
C -3.445965 0.231425 -1.457707
C -3.191403 -0.312280 -0.162760
C -5.511142 0.105358 -0.273879
C -4.470305 -0.390507 0.570067
C -1.893344 -0.683622 0.243291
C -2.383373 0.405111 -2.361923
C -0.825233 -0.500541 -0.675727
C -6.841131 0.141562 0.180453
C -4.760972 -0.851929 1.873035
C -1.076300 0.039949 -1.971523
C -7.133009 -0.321529 1.488778
C -6.100198 -0.813631 2.326204
C 2.530100 -1.603925 0.745352
C 1.029030 -1.416957 0.783864
C 3.427561 -0.535958 0.461850
C 3.002226 0.908435 0.431091
C 3.034270 -2.905458 0.986019
C 4.816140 -0.816796 0.366374
C 3.026936 1.712401 -0.749359
C 2.726515 1.546852 1.666248
C 4.416076 -3.171253 0.893300
C 5.308399 -2.124556 0.564590
C 2.844533 3.118724 -0.671381
C 2.503125 2.939643 1.736336
C 2.582977 3.733277 0.568499
C 3.094088 1.072295 -2.086871
H -5.381500 -0.030357 -2.459589
H -5.117309 1.607187 -1.824166
H -1.687050 -1.111501 1.225968
H -2.555982 0.816007 -3.363222
H -7.645199 0.519761 -0.461964
H -3.966388 -1.234833 2.523211
H -0.239920 0.162123 -2.670398
H -8.165177 -0.300075 1.856713
H -6.343537 -1.168329 3.334169
H 1.215659 -0.650119 -1.119086
H 2.325247 -3.701282 1.236134
H 5.512092 0.005260 0.163166
H 2.704618 0.940524 2.577725
H 4.793373 -4.184018 1.070878
H 6.383422 -2.319904 0.484786
H 2.885262 3.709737 -1.591044
H 2.283830 3.405324 2.703204
H 2.429798 4.815931 0.622933
H 3.669913 1.401756 -3.932789


