%chk=000264499.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264499

0 1
O -6.555251 -2.161222 -1.101778
N -3.891550 -1.652145 -0.225084
N 2.019987 -0.615917 2.350137
C -4.389191 -1.098121 -1.522148
C -4.568746 -2.946389 0.096226
C -5.912415 -0.912216 -1.425025
C -6.086896 -2.707165 0.147191
C -2.501100 -1.547591 0.048108
C 3.525101 1.151888 0.192337
C 3.509711 -0.243355 -0.372630
C 2.372445 1.989570 -0.296392
C -1.900355 -2.360926 1.039578
C -1.717912 -0.545528 -0.574510
C 2.619222 -1.227266 0.096696
C 0.197435 -1.168634 0.777704
C 1.554990 2.722669 0.635508
C 1.620299 -0.962548 1.174759
C -0.570890 -2.162716 1.398792
C -0.387786 -0.364370 -0.210938
C 0.495019 3.525785 0.136956
C 2.112874 2.075641 -1.647837
C 4.415245 -0.574481 -1.395268
C 2.649193 -2.518717 -0.454132
C 1.768088 2.675295 2.050621
C 0.254974 3.588451 -1.272090
C 1.046841 2.878769 -2.138491
C 4.442136 -1.861123 -1.934930
C -0.320393 4.264185 1.054541
C 3.558281 -2.837310 -1.463672
C 0.974297 3.391129 2.909790
C -0.085410 4.199394 2.404345
H -4.139263 -1.768268 -2.374556
H -3.903602 -0.114988 -1.719713
H -4.214938 -3.318896 1.084590
H -4.330482 -3.729272 -0.657784
H -6.186380 -0.157587 -0.666348
H -6.362483 -0.658023 -2.401059
H -6.653612 -3.652191 0.221908
H -6.367462 -2.023855 0.968461
H 4.475497 1.671541 -0.061832
H 3.539448 1.088901 1.310107
H -2.478616 -3.135782 1.539217
H -2.154372 0.102606 -1.332751
H -0.122869 -2.793557 2.167876
H 0.206747 0.414891 -0.697566
H 2.722157 1.524767 -2.364098
H 5.107537 0.178992 -1.767353
H 1.955002 -3.275785 -0.088398
H 2.578386 2.044014 2.431891
H -0.560187 4.209555 -1.637099
H 0.877426 2.919600 -3.213577
H 5.152795 -2.105035 -2.722997
H -1.127865 4.876172 0.656570
H 3.578681 -3.841333 -1.881878
H 1.138752 3.353667 3.985081
H -0.700065 4.758307 3.107990
H 1.319427 -0.454479 3.071855


%chk=000264499-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000264499

0 1
O -6.967416 -3.121319 -1.307170
N -4.239820 -2.430351 -0.594351
N 1.542488 -0.757857 2.106488
C -4.612805 -2.760211 -1.991885
C -5.151377 -3.032849 0.401659
C -6.089175 -2.423431 -2.258892
C -6.617331 -2.705765 0.058181
C -2.898482 -2.152301 -0.254338
C 3.349662 1.098402 0.613730
C 3.313260 -0.133594 -0.279299
C 2.405441 2.234231 0.203777
C -2.361607 -2.494474 1.027072
C -2.024070 -1.485997 -1.169688
C 2.296285 -1.135920 -0.170807
C -0.176220 -1.492062 0.465381
C 2.188564 3.341461 1.113332
C 1.210490 -1.098498 0.874626
C -1.040879 -2.160691 1.372279
C -0.700781 -1.177942 -0.818803
C 1.315301 4.431202 0.716647
C 1.765091 2.250057 -1.041913
C 4.309806 -0.290528 -1.274708
C 2.318849 -2.244766 -1.059935
C 2.809961 3.410127 2.406377
C 0.682164 4.397168 -0.569780
C 0.905773 3.324860 -1.431513
C 4.331406 -1.403085 -2.145184
C 1.101702 5.526299 1.618421
C 3.326962 -2.389480 -2.036023
C 2.584294 4.490425 3.263638
C 1.721881 5.560411 2.868729
H -4.450509 -3.845682 -2.179511
H -3.983007 -2.199968 -2.699864
H -4.936992 -2.612347 1.399327
H -5.016852 -4.137543 0.452335
H -6.247706 -1.325891 -2.180967
H -6.395704 -2.773450 -3.258103
H -7.302115 -3.257317 0.722960
H -6.788865 -1.613128 0.170916
H 4.384957 1.495742 0.631211
H 3.104269 0.777537 1.641123
H -2.961083 -3.058679 1.746698
H -2.385593 -1.174855 -2.154323
H -0.659411 -2.467665 2.354375
H -0.067872 -0.653212 -1.542383
H 1.931579 1.423265 -1.740719
H 5.084501 0.480794 -1.363643
H 1.541664 -3.011364 -0.968701
H 3.469944 2.599590 2.729481
H 0.025139 5.225208 -0.861936
H 0.426258 3.298369 -2.416681
H 5.122718 -1.496514 -2.897453
H 0.437957 6.341779 1.305627
H 3.329297 -3.262109 -2.698419
H 3.067765 4.519556 4.246574
H 1.551052 6.401955 3.549330
H 0.717095 -0.738595 2.743602


