%chk=000274889.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274889

0 1
O 5.961270 0.562904 0.821311
O -5.961816 0.568177 -0.820941
O 5.659025 -0.908830 -0.878315
O -5.660742 -0.904599 0.877985
N 3.119369 1.648716 2.166990
N -3.119002 1.652770 -2.165727
C 1.395679 -0.802939 -0.147873
C -1.397322 -0.801931 0.147422
C 0.821672 -0.807604 1.134522
C -0.565358 -0.815293 1.281221
C 0.563702 -0.814967 -1.281692
C -0.823307 -0.806285 -1.134985
C 2.851290 -0.811849 -0.341133
C -2.852942 -0.809765 0.340673
C 3.747242 -0.061145 0.333634
C -3.748276 -0.057795 -0.333508
C 5.197754 -0.205806 -0.007353
C -5.198904 -0.201489 0.007393
C 7.415128 0.570958 0.606094
C -7.415674 0.577220 -0.605740
C 7.750841 1.434962 -0.588461
C -7.750727 1.441632 0.588710
C 3.402464 0.883961 1.347246
C -3.402728 0.887727 -1.346472
H 1.458083 -0.812004 2.021959
H -1.001165 -0.816695 2.282018
H 0.999550 -0.816091 -2.282468
H -1.459757 -0.809672 -2.022402
H 3.214780 -1.498780 -1.127878
H -3.217026 -1.497012 1.126875
H 7.751212 0.999884 1.569151
H 7.757273 -0.472797 0.493687
H -7.751490 1.006242 -1.568843
H -7.758558 -0.466278 -0.493162
H 8.832297 1.599024 -0.673308
H 7.414318 0.971174 -1.528061
H 7.270224 2.420777 -0.522890
H -8.832094 1.606173 0.673783
H -7.414190 0.977903 1.528328
H -7.269695 2.427223 0.522810


%chk=000274889-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274889

0 1
O 6.318245 -0.155491 0.694153
O -6.319412 -0.149911 -0.694280
O 5.509414 -0.119690 -1.500476
O -5.510543 -0.115611 1.500357
N 3.850508 -0.149656 3.017852
N -3.851658 -0.145395 -3.017986
C 1.428127 -0.138753 -0.166172
C -1.429278 -0.137606 0.166039
C 0.846781 -0.139405 1.140007
C -0.545761 -0.138300 1.292048
C 0.544610 -0.138288 -1.292182
C -0.847933 -0.138268 -1.140140
C 2.859342 -0.137073 -0.451395
C -2.860491 -0.134830 0.451264
C 3.957967 -0.139606 0.389042
C -3.959119 -0.136160 -0.389172
C 5.314030 -0.133994 -0.260235
C -5.315175 -0.129632 0.260110
C 7.730705 -0.125303 0.191884
C -7.731841 -0.118672 -0.191984
C 8.190218 1.317836 -0.028506
C -8.190027 1.324776 0.029151
C 3.900161 -0.145523 1.821464
C -3.901318 -0.141636 -1.821597
H 1.480305 -0.140184 2.029696
H -0.973623 -0.138005 2.301390
H 0.972472 -0.137981 -2.301523
H -1.481458 -0.138177 -2.029829
H 3.130744 -0.132311 -1.517927
H -3.131888 -0.130211 1.517798
H 8.294160 -0.624058 0.995704
H 7.782494 -0.716127 -0.739284
H -8.295760 -0.616498 -0.996053
H -7.784169 -0.709923 0.738883
H 9.260446 1.325297 -0.306141
H 7.620904 1.794135 -0.844101
H 8.068441 1.913764 0.891951
H -9.260237 1.333077 0.306831
H -7.620244 1.800134 0.844966
H -8.067740 1.921062 -0.891007


