%chk=000223356.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223356

0 1
O 1.436265 0.045520 1.942736
O -1.063195 2.396910 -1.011317
C 1.251874 0.072802 0.517465
C 2.104937 1.216754 -0.093585
C -0.182382 0.472967 0.176756
C 1.636866 -1.296081 0.001386
C 1.314228 2.134470 -0.681487
C -0.129993 1.766831 -0.574867
C 3.563962 1.222644 -0.004109
C -1.268600 -0.239929 0.510381
C 1.635260 -1.535369 -1.381168
C 1.983493 -2.321871 0.889821
C 4.326739 1.863849 -0.998008
C 4.219790 0.593880 1.069434
C 1.981476 -2.797773 -1.868195
C 2.329605 -3.583247 0.396272
C -2.635016 0.156552 0.186740
C 2.329218 -3.822632 -0.981062
C 5.720582 1.877998 -0.913087
C 5.613175 0.615983 1.150901
C 6.365799 1.257093 0.161353
C -3.706350 -0.525019 0.627558
C -5.097089 -0.158039 0.325835
C -5.460031 1.163684 0.014831
C -6.090553 -1.155188 0.358039
C -6.792332 1.480276 -0.263029
C -7.418793 -0.833380 0.074649
C -7.773002 0.484484 -0.235490
H 1.604717 3.046344 -1.178595
H -1.144230 -1.182743 1.062756
H 1.066603 0.859609 2.350273
H 1.364193 -0.738992 -2.073757
H 1.982975 -2.129065 1.965217
H 3.831045 2.344501 -1.840693
H 3.630945 0.086521 1.841030
H 1.981246 -2.983357 -2.941074
H 2.601021 -4.379016 1.087814
H -2.737602 1.051746 -0.446641
H 2.600020 -4.804934 -1.363977
H 6.305564 2.373712 -1.686215
H 6.114315 0.129488 1.986452
H 7.452591 1.270941 0.226120
H -3.590450 -1.420086 1.248220
H -4.701399 1.947062 -0.007602
H -5.823187 -2.182983 0.597531
H -7.065106 2.507161 -0.503051
H -8.181625 -1.610112 0.095612
H -8.809768 0.733036 -0.454374


%chk=000223356-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223356

0 1
O 1.466639 0.043882 1.988772
O -1.001046 2.487064 -1.148137
C 1.299931 0.108053 0.511974
C 2.187641 1.230113 -0.096637
C -0.124705 0.547411 0.137229
C 1.634291 -1.292422 -0.025235
C 1.396026 2.157755 -0.736014
C -0.042888 1.812420 -0.646961
C 3.655374 1.251140 0.022234
C -1.260365 -0.142102 0.501865
C 1.810878 -1.485651 -1.418361
C 1.709562 -2.407143 0.843606
C 4.431410 2.155138 -0.763063
C 4.339537 0.376883 0.916903
C 2.063726 -2.774095 -1.934217
C 1.962667 -3.698087 0.324748
C -2.613178 0.258256 0.187368
C 2.140252 -3.887449 -1.064216
C 5.834202 2.188413 -0.656008
C 5.744808 0.413511 1.023611
C 6.499710 1.316906 0.240387
C -3.707937 -0.482087 0.581721
C -5.115744 -0.174034 0.312754
C -5.531016 0.972513 -0.431020
C -6.122405 -1.052933 0.812130
C -6.896729 1.223010 -0.660636
C -7.490038 -0.800598 0.581870
C -7.884185 0.339857 -0.156304
H 1.727259 3.068731 -1.239662
H -1.128448 -1.073896 1.073755
H 1.094795 0.879337 2.370975
H 1.751485 -0.628974 -2.100076
H 1.578397 -2.250466 1.917764
H 3.933988 2.823937 -1.473928
H 3.758920 -0.308159 1.538980
H 2.200308 -2.910716 -3.012859
H 2.021843 -4.554182 1.006663
H -2.723280 1.183961 -0.388721
H 2.337213 -4.887959 -1.465424
H 6.411238 2.886252 -1.272697
H 6.252238 -0.262874 1.720074
H 7.592027 1.341078 0.323104
H -3.523971 -1.403266 1.157645
H -4.782402 1.665193 -0.829754
H -5.819860 -1.938742 1.384758
H -7.197651 2.106926 -1.233894
H -8.246746 -1.488548 0.974801
H -8.945973 0.539643 -0.338069


