%chk=000245345.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245345

0 1
O 2.638603 -0.451616 -0.860921
O 1.082049 1.263402 0.393242
O 3.179593 -1.649905 0.976819
C -3.785961 0.050738 0.039914
C -0.983095 0.172998 -0.026757
C -5.264353 -0.016965 0.069767
C -3.027974 -1.129599 -0.043323
C -3.134765 1.293175 0.098046
C -1.634685 -1.067685 -0.078225
C -1.741339 1.351310 0.072760
C 0.503910 0.300044 -0.052553
C 4.812154 -0.156895 -0.064203
C 6.034012 -0.790363 0.247240
C 1.260357 -0.849765 -0.714106
C -6.019416 0.664374 -0.897783
C -5.914623 -0.762058 1.065999
C 4.798186 1.162441 -0.552304
C 3.523955 -0.845963 0.140831
C 7.230880 -0.078983 0.051497
C 6.074002 -2.188719 0.759011
C -7.414674 0.596188 -0.868230
C -7.310332 -0.821643 1.092555
C 5.993416 1.854514 -0.735732
C 7.209418 1.228689 -0.433331
C -8.061588 -0.144891 0.126107
H -3.532457 -2.094646 -0.084979
H -3.718635 2.210206 0.175640
H -1.062635 -1.993974 -0.134359
H -1.226180 2.314664 0.136187
H 0.932640 -1.020904 -1.756606
H 1.187113 -1.787700 -0.125877
H -5.516919 1.240081 -1.673795
H -5.330884 -1.285999 1.821758
H 3.836568 1.635844 -0.779974
H 8.182418 -0.554023 0.283762
H 7.024695 -2.440576 1.245206
H 5.919756 -2.914621 -0.053489
H 5.274344 -2.377017 1.500721
H -7.999098 1.122362 -1.621665
H -7.813536 -1.396576 1.868700
H 5.981466 2.876137 -1.109881
H 8.146170 1.768596 -0.576599
H -9.148855 -0.194476 0.148129


%chk=000245345-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245345

0 1
O 2.697160 -0.450209 -1.229104
O 1.127741 1.329555 0.120837
O 3.050634 -1.345701 0.889977
C -3.821548 0.022198 0.011373
C -0.972227 0.196487 -0.251363
C -5.302015 -0.069312 0.147883
C -3.076697 -1.019128 -0.610657
C -3.105819 1.153989 0.499833
C -1.678388 -0.936242 -0.741126
C -1.710482 1.239686 0.371870
C 0.513367 0.337307 -0.357818
C 4.889495 -0.200547 -0.278271
C 5.926493 -0.537892 0.653221
C 1.283893 -0.789435 -1.078143
C -6.113709 1.098562 0.101513
C -5.943090 -1.326701 0.329333
C 5.169931 0.649003 -1.385025
C 3.505495 -0.716409 -0.096726
C 7.219854 -0.003921 0.418013
C 5.711344 -1.427153 1.863314
C -7.515876 1.012442 0.230105
C -7.344933 -1.413651 0.459835
C 6.461419 1.167206 -1.590575
C 7.493666 0.835977 -0.682782
C -8.139187 -0.244340 0.410140
H -3.603962 -1.886824 -1.021520
H -3.649450 1.955422 1.011722
H -1.145274 -1.758330 -1.230782
H -1.157087 2.102320 0.757636
H 0.906173 -0.930882 -2.104545
H 1.178245 -1.730081 -0.503082
H -5.647813 2.075587 -0.069114
H -5.338492 -2.237607 0.403752
H 4.354770 0.898049 -2.068310
H 8.024571 -0.254771 1.118871
H 6.663186 -1.578406 2.401104
H 5.300400 -2.412438 1.580976
H 4.972627 -0.989557 2.557230
H -8.122585 1.923410 0.181243
H -7.816929 -2.390922 0.610019
H 6.661367 1.823620 -2.443967
H 8.505382 1.231330 -0.828670
H -9.227950 -0.311490 0.510976


