%chk=000191796.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191796

0 1
O 1.634366 -2.202063 -0.543325
O -0.820180 2.633680 0.511493
O -1.032306 -2.111293 -0.547052
O -5.375201 -0.490995 2.178736
O -6.728376 -0.201887 -0.167917
O 7.402120 0.197152 0.093679
C -1.105250 0.209447 -0.020729
C 1.780198 0.196220 0.063635
C 1.054363 -0.977624 -0.208930
C -0.358766 1.371775 0.254956
C -0.357234 -0.963575 -0.255189
C -2.575446 0.121801 -0.083050
C 1.055552 1.367573 0.291775
C 3.253919 0.203423 0.102518
C -3.303658 -0.143279 1.091526
C -3.233646 0.265984 -1.313033
C 3.935883 0.909797 1.106145
C 3.985506 -0.494948 -0.881134
C -4.692216 -0.246370 1.016497
C -4.628281 0.162445 -1.393055
C -5.351585 -0.089117 -0.230336
C 5.331543 0.929311 1.140893
C 5.375218 -0.484835 -0.871892
C 6.030366 0.233095 0.144523
C 2.181668 -2.915813 0.601581
C -2.238258 2.921821 0.535714
H 1.565074 2.311152 0.484815
H -2.800234 -0.285412 2.047001
H -2.653361 0.446559 -2.217052
H 3.372617 1.444709 1.873310
H 3.443932 -1.055868 -1.650315
H -5.131459 0.271339 -2.350142
H 5.855553 1.473527 1.919015
H 5.959251 -1.010740 -1.623975
H -0.373643 -2.855444 -0.740817
H 1.395470 -3.120197 1.331521
H 2.994819 -2.335390 1.048439
H 2.559532 -3.835162 0.142108
H -2.690006 2.707419 -0.436849
H -2.235422 4.000647 0.740938
H -2.724241 2.369244 1.345581
H -6.355037 -0.577674 2.000929
H -7.131669 -0.177959 -1.068322
H 7.817528 0.724027 0.819786


%chk=000191796-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191796

0 1
O 1.653331 -2.145131 -1.016189
O -1.050853 2.327326 1.083260
O -0.969484 -2.055180 -1.202213
O -5.448729 0.623730 2.355168
O -6.881343 -0.246993 0.235712
O 7.486673 0.429026 0.354666
C -1.163198 0.103672 -0.061298
C 1.757527 0.097303 0.143257
C 1.049467 -0.968668 -0.465607
C -0.434302 1.180185 0.536897
C -0.365435 -0.950439 -0.588821
C -2.652295 0.016514 -0.046399
C 0.972082 1.168938 0.640443
C 3.244559 0.154457 0.224054
C -3.362239 0.372214 1.135080
C -3.384845 -0.453546 -1.168830
C 3.884125 0.747067 1.345854
C 4.068170 -0.336145 -0.830619
C -4.761328 0.270221 1.186113
C -4.792968 -0.553699 -1.122736
C -5.478162 -0.193377 0.051316
C 5.288098 0.851896 1.420391
C 5.469380 -0.234772 -0.770683
C 6.082326 0.361368 0.356321
C 2.252166 -3.059097 -0.010407
C -1.976443 3.100243 0.228987
H 1.449932 2.057849 1.060621
H -2.829116 0.730493 2.020362
H -2.851968 -0.754280 -2.073125
H 3.276709 1.113312 2.180553
H 3.595823 -0.794308 -1.704842
H -5.346203 -0.915819 -1.998705
H 5.757729 1.307033 2.302451
H 6.102163 -0.601289 -1.584444
H -0.216065 -2.647664 -1.489652
H 1.496679 -3.348467 0.744217
H 3.114591 -2.578937 0.483061
H 2.587539 -3.941077 -0.577664
H -1.793182 2.897077 -0.841883
H -1.773859 4.160454 0.453632
H -3.024157 2.854601 0.474014
H -6.420032 0.471949 2.211288
H -7.343715 -0.593523 -0.564016
H 7.819853 0.871985 1.174414


