%chk=000107284.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000107284

0 1
O 0.007135 3.333703 -1.357415
O -0.127498 0.054270 -2.541687
C 2.749354 0.814342 -1.020244
C 1.782702 1.946785 -0.661796
C 3.772120 0.581894 0.099178
C 0.707633 2.136064 -1.737197
C 4.744239 -0.549873 -0.260560
C -2.579630 0.113718 -1.111144
C -3.650564 0.102425 -0.014040
C -1.394966 1.005559 -0.729058
C -4.840193 -0.783750 -0.407596
C -0.289388 0.952064 -1.747536
C 5.767754 -0.785782 0.857939
C -5.914309 -0.799004 0.687995
C 6.740116 -1.918535 0.499528
C -7.104776 -1.685296 0.295158
C 7.761644 -2.158349 1.608997
C -8.177634 -1.704486 1.381714
H 2.186529 -0.120989 -1.220065
H 3.273876 1.048479 -1.967670
H 1.306348 1.767514 0.322110
H 2.329533 2.905778 -0.541147
H 3.249503 0.340774 1.045110
H 4.336403 1.514186 0.295458
H 1.153058 2.266423 -2.747664
H 5.268263 -0.310762 -1.206131
H 4.180155 -1.482333 -0.457766
H -2.218317 -0.916999 -1.310022
H -3.015689 0.460116 -2.068661
H -3.213846 -0.257268 0.937705
H -3.999789 1.133969 0.185472
H -0.979924 0.698688 0.255686
H -1.721374 2.059270 -0.576855
H -5.278222 -0.425982 -1.359449
H -4.490890 -1.815578 -0.607009
H 6.333614 0.144790 1.055661
H 5.245691 -1.026207 1.803974
H -5.478426 -1.158229 1.639992
H -6.264880 0.231558 0.888644
H 7.264863 -1.679155 -0.446083
H 6.175508 -2.851202 0.303626
H -7.543323 -1.326499 -0.656558
H -6.755847 -2.717651 0.096489
H -0.387842 3.759095 -2.144343
H 7.276342 -2.436050 2.551541
H 8.450721 -2.968112 1.344164
H 8.365145 -1.264313 1.802499
H -7.785855 -2.091819 2.329087
H -9.022594 -2.339299 1.092424
H -8.572876 -0.701141 1.576748


%chk=000107284-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107284

0 1
O 0.150405 3.783281 -1.712760
O -0.409838 0.736397 -3.239610
C 2.567953 0.883347 -1.079029
C 1.777331 2.198344 -0.893904
C 3.624500 0.670597 0.027929
C 0.778974 2.479742 -2.029515
C 4.409654 -0.651902 -0.124879
C -2.536253 0.410562 -1.325765
C -3.388047 0.079323 -0.080275
C -1.244986 1.176269 -0.978422
C -4.687201 -0.680626 -0.429877
C -0.313721 1.394414 -2.167112
C 5.482711 -0.853882 0.968264
C -5.540090 -1.044150 0.806680
C 6.260220 -2.182674 0.824816
C -6.836923 -1.805690 0.449694
C 7.337872 -2.371682 1.914201
C -7.681425 -2.173736 1.688973
H 1.874132 0.017577 -1.091824
H 3.070543 0.887726 -2.068067
H 1.232801 2.187810 0.070236
H 2.476337 3.055839 -0.854054
H 3.127281 0.688870 1.020521
H 4.336153 1.522442 0.022075
H 1.311208 2.523960 -3.003236
H 4.894463 -0.677711 -1.123241
H 3.699242 -1.504750 -0.103621
H -2.272236 -0.520284 -1.862389
H -3.136824 1.010986 -2.037985
H -2.786344 -0.531590 0.625672
H -3.644356 1.015178 0.459343
H -0.666963 0.608448 -0.215314
H -1.456475 2.158932 -0.513499
H -5.295272 -0.065695 -1.126010
H -4.428845 -1.608476 -0.981874
H 6.200044 -0.006926 0.940060
H 5.000943 -0.818997 1.968067
H -4.934006 -1.661220 1.502927
H -5.801313 -0.117749 1.360319
H 6.734889 -2.220100 -0.177099
H 5.543954 -3.028927 0.860211
H -7.443460 -1.186580 -0.242559
H -6.575049 -2.728129 -0.108106
H -0.347770 4.102492 -2.508211
H 6.885533 -2.367834 2.924003
H 7.877379 -3.328609 1.789242
H 8.084239 -1.555650 1.878675
H -7.106138 -2.814782 2.383622
H -8.600021 -2.720585 1.406775
H -7.985607 -1.266801 2.245140


