%chk=000282099.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282099

0 1
O 2.272615 1.393142 2.252876
O -1.301157 2.879375 -0.080390
O -2.571566 -2.939432 -0.732370
C 0.205953 -0.081696 -0.090957
C 1.010720 1.178898 0.250584
C -0.330979 0.957112 0.915820
C -0.437450 -0.129237 -1.450571
C 0.494412 -1.445563 0.467655
C 2.280338 1.230906 1.051315
C -1.483397 1.862004 0.555290
C -1.341408 -1.169534 -1.740412
C -0.430928 -2.477812 0.193690
C -0.198504 0.850043 -2.422627
C 1.591952 -1.737262 1.283536
C -1.568297 -2.257244 -0.747694
C 3.550632 1.131517 0.271780
C -2.830775 1.455312 1.042956
C -2.012349 -1.209139 -2.968909
C -0.277221 -3.748246 0.760658
C -0.855913 0.797950 -3.656319
C 1.753163 -3.015720 1.834080
C -1.766569 -0.226125 -3.930942
C 0.817549 -4.020845 1.585029
C 3.607425 0.474223 -0.966060
C -3.129067 0.127586 1.382974
C 4.712314 1.702259 0.815439
C -3.828540 2.440250 1.133297
C 4.818786 0.395621 -1.656915
C -4.415092 -0.210112 1.811666
C 5.920429 1.627761 0.117883
C -5.110051 2.100749 1.572209
C 5.973423 0.974932 -1.117842
C -5.403667 0.775296 1.909923
H 1.036736 1.968816 -0.536715
H -0.328720 0.681284 1.985654
H 0.486825 1.676133 -2.214308
H 2.346219 -0.988192 1.517030
H -2.728555 -2.013029 -3.161124
H -1.022694 -4.520954 0.549587
H -0.661015 1.568974 -4.402977
H 2.618249 -3.219612 2.467296
H -2.286803 -0.255845 -4.887261
H 0.938448 -5.008936 2.026334
H 2.711527 0.015298 -1.388749
H -2.366678 -0.649434 1.307291
H 4.661046 2.200242 1.787731
H -3.591118 3.469881 0.852227
H 4.864571 -0.117657 -2.616427
H -4.647827 -1.244615 2.063328
H 6.819716 2.075694 0.538517
H -5.880393 2.866692 1.646084
H 6.916108 0.915280 -1.661912
H -6.405125 0.508510 2.247241


%chk=000282099-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282099

0 1
O 2.297615 1.167340 2.196167
O -1.315775 3.065064 -0.023462
O -0.752250 -3.859972 -2.072962
C 0.036983 -0.149749 -0.116574
C 0.941825 1.125718 0.186119
C -0.380613 1.020552 0.882900
C -0.538515 -0.199701 -1.515928
C 0.331466 -1.475554 0.552637
C 2.258303 1.092589 0.929340
C -1.507283 1.997907 0.637312
C -0.802108 -1.451681 -2.153113
C 0.069207 -2.708302 -0.121568
C -0.808013 0.983265 -2.264086
C 0.840199 -1.553462 1.881711
C -0.512253 -2.751076 -1.489787
C 3.509800 1.003919 0.114883
C -2.842683 1.677597 1.230083
C -1.332490 -1.500457 -3.470528
C 0.332596 -3.953504 0.510588
C -1.335935 0.923554 -3.567671
C 1.100682 -2.792414 2.497204
C -1.606461 -0.323639 -4.181836
C 0.852181 -4.006647 1.811683
C 3.484493 0.746182 -1.283382
C -3.127055 0.411507 1.811585
C 4.760754 1.160898 0.772257
C -3.861114 2.668856 1.185448
C 4.690437 0.648729 -2.008361
C -4.407861 0.145232 2.338864
C 5.963005 1.069593 0.045766
C -5.136562 2.403590 1.718591
C 5.930396 0.813488 -1.347494
C -5.412882 1.140112 2.297315
H 0.965658 1.819157 -0.661779
H -0.330532 0.700789 1.929588
H -0.627288 1.971302 -1.834768
H 1.055318 -0.647858 2.453022
H -1.509067 -2.491092 -3.901261
H 0.107013 -4.860337 -0.059388
H -1.537004 1.856994 -4.104644
H 1.499534 -2.807351 3.517371
H -2.016050 -0.367097 -5.196271
H 1.055371 -4.968967 2.292704
H 2.530857 0.604064 -1.803003
H -2.360604 -0.370484 1.837732
H 4.758147 1.352580 1.850379
H -3.623413 3.634694 0.727451
H 4.666146 0.442330 -3.083630
H -4.624645 -0.834158 2.778418
H 6.923515 1.195875 0.556806
H -5.915578 3.172826 1.685642
H 6.865908 0.740699 -1.913384
H -6.406075 0.931996 2.710811


