%chk=000200120.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200120

0 1
O -3.078740 -0.488004 -1.041950
O -4.610993 0.096583 2.123842
O 6.038136 -0.872293 -1.994374
O -5.137660 0.292852 -1.593915
C -1.628887 -0.229084 0.826999
C -0.806916 0.895224 0.118923
C 0.648211 0.892669 0.605601
C 1.272114 -0.474225 0.198998
C -3.071082 0.104956 0.293879
C -1.045180 -1.582600 0.394834
C -1.665288 2.157507 0.306216
C 0.448168 -1.654897 0.757978
C 2.778827 -0.551457 0.617769
C -3.121247 1.647402 0.214422
C 1.443807 2.055146 -0.005412
C 2.923438 2.001087 0.427451
C -1.641039 -0.112460 2.356293
C 3.496111 0.660158 0.011204
C -4.208204 -0.495296 1.148960
C 2.981151 -0.531473 2.144679
C 3.348632 -1.869130 0.120984
C 3.682185 3.210792 -0.121905
C 4.534859 0.529482 -0.826160
C -4.747217 -1.825699 0.730121
C 4.383956 -1.975097 -0.713659
C 5.082064 -0.776874 -1.250613
C -4.131982 -0.294252 -1.910451
C -3.788569 -0.935103 -3.209992
H -0.800176 0.666125 -0.980538
H 0.667524 0.987186 1.718980
H 1.248952 -0.541534 -0.918888
H -1.184861 -1.721148 -0.696318
H -1.588543 -2.416450 0.874461
H -1.453438 2.915465 -0.463851
H -1.475172 2.637908 1.280787
H 0.555106 -1.698600 1.859694
H 0.859637 -2.609392 0.374952
H -3.739116 2.053026 1.041058
H -3.614809 1.979981 -0.714711
H 1.000244 3.019955 0.304762
H 1.374566 2.036267 -1.110106
H 2.972409 2.053995 1.549184
H -0.626485 0.008126 2.755056
H -2.226000 0.751288 2.703374
H -2.076206 -0.999012 2.830264
H 4.048407 -0.552820 2.399941
H 2.550082 0.368397 2.599726
H 2.510927 -1.395533 2.627669
H 2.848948 -2.757747 0.515599
H 4.734677 3.199584 0.187474
H 3.661696 3.247639 -1.217991
H 3.247530 4.148777 0.242491
H 5.053710 1.384417 -1.263670
H -4.019898 -2.432966 0.177846
H -5.099439 -2.403126 1.597376
H -5.626515 -1.682725 0.077362
H 4.783901 -2.932112 -1.049583
H -2.820141 -1.459087 -3.183393
H -3.735524 -0.179858 -4.011585
H -4.561749 -1.661835 -3.505445


%chk=000200120-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200120

0 1
O -3.021660 -0.421755 -1.146127
O -4.815796 -0.008634 1.991127
O 5.978244 -0.964938 -2.197746
O -5.229329 0.203028 -1.581049
C -1.670829 -0.245491 0.890437
C -0.826592 0.883775 0.210286
C 0.652093 0.895304 0.654452
C 1.278873 -0.495629 0.315355
C -3.097408 0.084265 0.275248
C -1.046873 -1.614979 0.528936
C -1.684881 2.156007 0.405797
C 0.454421 -1.661162 0.930299
C 2.835258 -0.547869 0.671139
C -3.157393 1.643308 0.289037
C 1.434692 2.039646 -0.024319
C 2.951885 2.022095 0.331884
C -1.754115 -0.085105 2.434578
C 3.511781 0.646924 -0.018149
C -4.262911 -0.600893 1.027981
C 3.074279 -0.468869 2.220600
C 3.413932 -1.877284 0.219315
C 3.683433 3.212197 -0.318845
C 4.518832 0.476698 -0.931910
C -4.660708 -2.016777 0.636971
C 4.418936 -2.020531 -0.689277
C 5.041429 -0.843807 -1.338344
C -4.131104 -0.247794 -1.979319
C -3.798578 -0.675475 -3.391695
H -0.829136 0.651438 -0.877164
H 0.698237 1.058036 1.752010
H 1.225985 -0.605416 -0.791205
H -1.140021 -1.783279 -0.559873
H -1.577706 -2.442025 1.040614
H -1.461548 2.931217 -0.347423
H -1.500663 2.603970 1.400870
H 0.543365 -1.649511 2.033313
H 0.863011 -2.630194 0.590167
H -3.783492 1.960595 1.139600
H -3.655367 2.006863 -0.624205
H 1.009084 3.016312 0.276086
H 1.326814 1.962391 -1.126789
H 3.022801 2.147243 1.434373
H -0.748651 -0.043600 2.884402
H -2.298620 0.823621 2.739159
H -2.282711 -0.943264 2.887135
H 4.155022 -0.389239 2.431627
H 2.569986 0.401118 2.674433
H 2.699733 -1.378140 2.722768
H 2.997523 -2.769887 0.705147
H 4.756190 3.229632 -0.055112
H 3.601397 3.184106 -1.421258
H 3.235559 4.161910 0.025871
H 4.993430 1.332913 -1.422408
H -3.834950 -2.575196 0.167374
H -5.030912 -2.547260 1.529361
H -5.492886 -1.961007 -0.089639
H 4.813644 -3.004154 -0.969372
H -3.300284 -1.659374 -3.393034
H -3.098356 0.048309 -3.846574
H -4.717490 -0.714276 -3.994220


