%chk=000286872.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286872

0 1
O -4.791854 -0.669700 2.015284
O -6.217651 0.404733 -0.301958
O 4.057144 2.284209 1.887585
O 5.836045 0.625639 0.392551
O 2.723960 -2.709915 -1.659169
O 0.969914 -2.740393 -0.408432
N 0.097100 0.598498 -1.401586
N 2.030857 -2.246218 -0.764813
C 0.225893 -0.390901 0.818848
C -0.574445 0.164127 -0.332529
C -2.018708 0.200228 -0.252574
C 1.709310 -0.189718 0.670706
C -2.724300 0.741466 -1.362801
C 2.536451 -1.057110 -0.063622
C -2.752236 -0.299281 0.864292
C 2.295331 0.919050 1.305320
C -4.149382 0.827674 -1.325212
C -4.124664 -0.224899 0.877128
C -1.981957 1.202071 -2.493735
C -4.838457 0.363991 -0.227440
C 3.665603 1.175055 1.199607
C 3.923789 -0.803221 -0.193048
C 4.491829 0.292688 0.429974
C -0.608916 1.110761 -2.477905
C -5.515364 -1.915197 1.802255
C -6.887344 1.034584 0.825726
C 5.453565 2.684911 1.829471
C 6.673145 -0.122589 -0.525004
H -0.004930 -1.487784 0.911172
H -0.128691 0.064497 1.771126
H -2.233502 -0.751522 1.710177
H 1.679914 1.618886 1.874277
H -4.689738 1.259444 -2.167350
H -2.512434 1.611981 -3.349859
H 4.523265 -1.489822 -0.800340
H 0.016264 1.438483 -3.316147
H -6.246519 -1.797218 0.995270
H -6.002019 -2.068264 2.771408
H -4.805681 -2.717792 1.582962
H -7.938137 0.794692 0.629496
H -6.708723 2.112622 0.780595
H -6.546516 0.614480 1.779449
H 5.734622 2.911838 0.795680
H 6.087277 1.894459 2.246966
H 5.452057 3.582420 2.458954
H 6.303602 -0.024381 -1.550407
H 6.736649 -1.169032 -0.212033
H 7.639382 0.383371 -0.403614


%chk=000286872-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286872

0 1
O -4.828543 -0.861234 1.994163
O -6.299666 0.088122 -0.334151
O 4.399058 2.192427 2.068141
O 5.977824 0.401729 0.379954
O 2.582207 -2.641620 -1.651594
O 0.600200 -2.267353 -0.601956
N 0.076409 0.908466 -1.287835
N 1.845327 -1.978118 -0.813052
C 0.219686 -0.031847 0.985920
C -0.596262 0.412005 -0.230634
C -2.039332 0.305649 -0.206717
C 1.722286 0.004383 0.775244
C -2.773887 0.745405 -1.374957
C 2.465700 -0.872216 -0.065784
C -2.767872 -0.231753 0.901304
C 2.465294 1.002323 1.436879
C -4.201921 0.668623 -1.375414
C -4.158920 -0.323585 0.871567
C -2.028537 1.262817 -2.483667
C -4.892591 0.165449 -0.273799
C 3.863896 1.162972 1.303362
C 3.866568 -0.742869 -0.221859
C 4.583194 0.254243 0.457265
C -0.639334 1.325291 -2.395751
C -5.533990 -2.140396 1.731026
C -7.018698 0.879535 0.694402
C 5.702344 2.813024 1.748065
C 6.704377 -0.540540 -0.479072
H -0.098727 -1.052403 1.261307
H -0.032195 0.631370 1.837005
H -2.254032 -0.606084 1.790933
H 1.953284 1.723731 2.081063
H -4.776231 1.018027 -2.239879
H -2.546152 1.603466 -3.386481
H 4.360387 -1.457825 -0.883206
H -0.034846 1.714423 -3.221838
H -6.278000 -2.021431 0.923021
H -6.029380 -2.401087 2.678375
H -4.802553 -2.924033 1.458374
H -8.084485 0.652085 0.542593
H -6.836513 1.958578 0.531939
H -6.698871 0.591081 1.711186
H 5.745469 3.107608 0.685380
H 6.532783 2.127892 1.975237
H 5.737767 3.703329 2.394217
H 6.376055 -0.456486 -1.532492
H 6.570977 -1.581806 -0.128906
H 7.761243 -0.249465 -0.392179


