%chk=000274772.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274772

0 1
O 0.306825 -1.726904 -0.217645
O -1.317005 -3.106290 0.569266
O -5.522870 2.477115 0.166375
O -3.936478 3.582165 -0.805427
N 2.952938 -0.830145 0.220874
N -4.391974 2.582071 -0.276633
C 1.397423 -2.754019 -0.170935
C 2.576406 -1.920418 -0.728114
C 4.215955 1.263562 0.574745
C 3.975515 0.084166 -0.379450
C 5.363454 2.174124 0.089576
C 1.018294 -3.879252 -1.122844
C 1.577053 -3.215725 1.260969
C 4.960515 2.966535 -1.160654
C 5.782293 3.130032 1.214740
C -0.962861 -2.017373 0.177081
C -1.829367 -0.803121 0.045753
C -3.140383 -0.877207 0.540327
C -1.353301 0.370738 -0.554434
C -3.984049 0.229935 0.437395
C -2.190310 1.482656 -0.662315
C -3.497989 1.399338 -0.163856
H 2.311829 -1.548284 -1.742731
H 3.457941 -2.590509 -0.848057
H 4.453989 0.869692 1.584617
H 3.291281 1.856568 0.699793
H 3.691443 0.457787 -1.387240
H 4.915380 -0.498235 -0.506786
H 6.242981 1.532022 -0.167692
H 2.107821 -0.296889 0.465389
H 0.133134 -4.425333 -0.754908
H 1.824974 -4.613672 -1.224351
H 0.769203 -3.510380 -2.123993
H 1.761394 -2.370999 1.941168
H 0.692390 -3.754642 1.630981
H 2.442135 -3.882869 1.358562
H 4.686170 2.303551 -1.987298
H 4.104807 3.621862 -0.965585
H 5.782437 3.601737 -1.508781
H 6.601597 3.783492 0.895848
H 4.954965 3.775900 1.528008
H 6.126136 2.583387 2.099405
H -3.494014 -1.805839 1.002727
H -0.327571 0.408044 -0.934622
H -5.011515 0.193842 0.817417
H -1.839491 2.410584 -1.127664


%chk=000274772-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274772

0 1
O 0.231999 -1.637831 -0.224057
O -1.398103 -3.102495 0.618885
O -5.987269 2.220062 0.264956
O -4.374018 3.547426 -0.650517
N 2.870397 -0.662574 0.044498
N -4.786020 2.427409 -0.158449
C 1.377360 -2.666006 -0.208296
C 2.545213 -1.833046 -0.787147
C 4.297894 1.324040 0.497673
C 4.055013 0.101321 -0.409023
C 5.598854 2.110804 0.185952
C 1.019081 -3.827374 -1.152396
C 1.639575 -3.113314 1.239019
C 5.585682 2.742165 -1.228236
C 5.832757 3.201024 1.259229
C -1.044165 -1.973283 0.195890
C -1.983689 -0.804152 0.085410
C -3.316278 -0.984958 0.538580
C -1.579071 0.445358 -0.451922
C -4.242830 0.070476 0.462954
C -2.495311 1.510512 -0.535244
C -3.814000 1.304461 -0.073974
H 2.289794 -1.569040 -1.844426
H 3.435461 -2.491471 -0.825967
H 4.326346 0.967190 1.546075
H 3.433289 2.019547 0.421603
H 3.963028 0.429046 -1.474553
H 4.935776 -0.571534 -0.358645
H 6.446808 1.393910 0.234930
H 2.045503 -0.056147 0.156721
H 0.185273 -4.422951 -0.750660
H 1.898713 -4.487427 -1.264333
H 0.743561 -3.449391 -2.153158
H 1.922475 -2.246555 1.857491
H 0.760006 -3.620818 1.664048
H 2.488400 -3.821709 1.243582
H 5.517786 1.979466 -2.024900
H 4.722728 3.427740 -1.339045
H 6.506109 3.329566 -1.404087
H 6.778387 3.744603 1.077186
H 5.010494 3.942722 1.247721
H 5.879560 2.763689 2.274016
H -3.600967 -1.960266 0.944956
H -0.552014 0.567245 -0.804039
H -5.274835 -0.038981 0.805287
H -2.215253 2.484346 -0.944586


