%chk=000183092.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183092

0 1
O 5.409895 1.495145 -0.975276
O 3.283333 -2.177490 0.836503
N -0.182023 -0.309661 -0.011735
N -2.932935 -0.336288 -0.967149
N 4.047425 -0.222294 -0.188658
N -4.508315 1.326153 -0.262144
N -4.740251 -1.007324 0.454481
C -0.901960 0.984530 -0.287899
C 1.933081 0.905018 0.560211
C 0.111773 2.023346 -0.809202
C 0.881360 -0.123837 1.030105
C 1.249637 2.235119 0.193312
C -1.983558 0.738321 -1.372724
C -1.141139 -1.374754 0.436725
C 2.747320 0.348088 -0.630123
C -2.212228 -1.602508 -0.646540
C -4.059075 0.008895 -0.211063
C 5.297730 0.435171 -0.413256
C 4.194103 -1.458645 0.508742
C 6.393015 -0.446318 0.168803
C 5.682821 -1.673434 0.753039
C -5.696352 1.594822 0.325698
C -5.922790 -0.684628 1.025767
C -6.454099 0.613986 0.984419
H -1.401214 1.385405 0.632305
H 2.626279 1.098216 1.416641
H -0.405101 2.981122 -1.006784
H 0.526371 1.687316 -1.780383
H 1.381030 -1.113207 1.181539
H 0.472370 0.188845 2.013950
H 1.991120 2.947210 -0.217681
H 0.857257 2.710158 1.113690
H -2.532938 1.681925 -1.591123
H -1.511073 0.407938 -2.326178
H -1.630126 -1.144667 1.408224
H -0.561442 -2.314337 0.579432
H 2.963602 1.148079 -1.375741
H 2.167160 -0.446548 -1.158645
H -1.739659 -1.955049 -1.592546
H -2.929436 -2.391444 -0.324374
H 7.124478 -0.716132 -0.617752
H 6.969157 0.111976 0.931863
H 5.878555 -1.800206 1.835111
H 6.013396 -2.617729 0.278165
H -6.447055 -1.503099 1.536094
H -6.035856 2.636981 0.264578
H -7.404744 0.849936 1.445279


%chk=000183092-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183092

0 1
O 5.544237 1.494850 -0.336557
O 2.926137 -2.392085 -0.172623
N 0.002010 -0.017275 0.332441
N -2.761467 -0.255636 -0.397642
N 3.985026 -0.278599 -0.323875
N -4.702213 1.089641 -0.471998
N -4.760262 -1.189098 0.446816
C -0.775022 1.202368 -0.033331
C 2.150454 1.239204 0.514213
C 0.146858 2.223589 -0.736561
C 1.152271 0.291163 1.217425
C 1.406166 2.534364 0.100913
C -1.943746 0.824055 -0.972235
C -0.851544 -1.084326 0.914530
C 2.813606 0.536641 -0.703930
C -1.996300 -1.464386 -0.041332
C -4.105746 -0.114940 -0.134109
C 5.278568 0.279070 -0.177348
C 3.954139 -1.676691 -0.101292
C 6.246559 -0.851463 0.187961
C 5.380575 -2.132479 0.232588
C -6.030445 1.197152 -0.213493
C -6.087218 -1.028809 0.684684
C -6.792574 0.157473 0.370739
H -1.207877 1.676141 0.888962
H 2.950245 1.513540 1.229668
H -0.422662 3.153411 -0.927656
H 0.438243 1.812810 -1.723609
H 1.643688 -0.665157 1.474271
H 0.815459 0.767320 2.175345
H 2.086453 3.207024 -0.455104
H 1.105459 3.072335 1.022810
H -2.592335 1.694377 -1.153618
H -1.517585 0.477094 -1.936587
H -1.292215 -0.767378 1.894220
H -0.216562 -1.971343 1.094064
H 3.170659 1.290343 -1.428560
H 2.081195 -0.135377 -1.184427
H -1.570334 -1.905670 -0.964373
H -2.682271 -2.185982 0.426505
H 7.048535 -0.893837 -0.568674
H 6.727202 -0.615739 1.152950
H 5.377548 -2.623801 1.220530
H 5.691632 -2.893524 -0.503480
H -6.593893 -1.885863 1.144449
H -6.491021 2.154421 -0.485853
H -7.860733 0.265172 0.569879


