%chk=000245512.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245512

0 1
O -4.699371 -2.102505 0.252153
O 4.699054 -2.103583 -0.251530
C 0.000323 2.345432 -0.000231
C 0.000177 0.998445 -0.000070
C 1.275357 3.150504 -0.020268
C -1.274535 3.150789 0.019626
C -1.241085 0.189671 0.021968
C 1.241264 0.189397 -0.021908
C 1.690936 3.493902 -1.450669
C -1.690044 3.494589 1.449951
C -1.784374 -0.228686 1.252693
C 1.784467 -0.229371 -1.252530
C -1.868985 -0.174371 -1.175046
C 1.869078 -0.174496 1.175196
C -2.942904 -0.994549 1.288459
C 2.942832 -0.995494 -1.288109
C -3.036909 -0.945548 -1.165108
C 3.036835 -0.945929 1.165448
C -3.559310 -1.346029 0.069014
C 3.559156 -1.346817 -0.068577
C -5.410991 -2.545856 -0.926949
C 5.410571 -2.546808 0.927681
H 2.095694 2.593605 0.480490
H 1.147113 4.080044 0.570698
H -1.146086 4.080172 -0.571541
H -2.094991 2.593960 -0.481015
H 1.893619 2.585222 -2.031513
H 0.910245 4.054464 -1.976403
H 2.602352 4.101647 -1.461442
H -0.909233 4.055096 1.975564
H -2.601329 4.102533 1.460588
H -1.892925 2.586079 2.030992
H -1.287414 0.050265 2.181386
H 1.287572 0.049467 -2.181292
H -1.444842 0.144067 -2.126743
H 1.444999 0.144260 2.126815
H -3.380524 -1.329621 2.225330
H 3.380384 -1.330883 -2.224897
H -3.510651 -1.220118 -2.100391
H 3.510513 -1.220379 2.100798
H -4.772639 -3.191916 -1.536357
H -5.781505 -1.686721 -1.493044
H -6.240724 -3.114949 -0.488012
H 5.781269 -1.687618 1.493574
H 6.240184 -3.116184 0.488884
H 4.772076 -3.192584 1.537239


%chk=000245512-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245512

0 1
O -4.722977 -2.492205 -0.224826
O 4.722464 -2.493239 0.225599
C 0.000306 2.183484 -0.000247
C 0.000129 0.800687 -0.000067
C 1.284803 3.002122 -0.128131
C -1.283954 3.002514 0.127509
C -1.259562 -0.016019 -0.080155
C 1.259622 -0.016293 0.080246
C 1.250475 4.007759 -1.310376
C -1.249323 4.008285 1.309634
C -1.482449 -1.089087 0.831658
C 1.482171 -1.089784 -0.831152
C -2.237688 0.200939 -1.084625
C 2.237900 0.200850 1.084529
C -2.638734 -1.883564 0.764319
C 2.638270 -1.884511 -0.763595
C -3.403876 -0.593100 -1.175839
C 3.403906 -0.593431 1.175959
C -3.608081 -1.637508 -0.241301
C 3.607772 -1.638272 0.241831
C -5.745382 -2.287186 -1.251973
C 5.745022 -2.288034 1.252557
H 2.147494 2.329507 -0.266300
H 1.475696 3.567974 0.807330
H -1.474664 3.568310 -0.808022
H -2.146852 2.330186 0.265760
H 1.059306 3.484719 -2.265335
H 0.469138 4.778520 -1.181407
H 2.222028 4.528412 -1.396503
H -0.467725 4.778770 1.180593
H -2.220705 4.529273 1.395678
H -1.058350 3.485294 2.264659
H -0.733730 -1.295219 1.604559
H 0.733330 -1.296054 -1.603899
H -2.073261 0.993053 -1.824189
H 2.073736 0.993313 1.823779
H -2.813134 -2.700389 1.471436
H 2.812407 -2.701668 -1.470392
H -4.127592 -0.395111 -1.972634
H 4.127747 -0.395286 1.972602
H -5.331117 -2.433531 -2.268852
H -6.195816 -1.277851 -1.177975
H -6.512020 -3.050114 -1.051472
H 6.195687 -1.278837 1.178093
H 6.511460 -3.051227 1.052297
H 5.330826 -2.433857 2.269539


