%chk=000228564.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228564

0 1
O 3.931030 0.910310 -0.470471
O -0.598497 2.082730 0.548882
O 0.563060 -2.218221 -1.358299
O -1.900905 -1.556982 -0.838292
O -6.644693 -1.436147 -1.471522
O -7.962424 -0.479989 0.723509
C 4.449853 2.160870 0.158272
C 3.433095 3.294831 -0.014967
C 2.063508 2.912545 0.554577
C 1.648893 1.554865 0.078983
C 2.608885 0.622067 -0.404244
C 4.739376 1.809575 1.611290
C 5.718128 2.387135 -0.658512
C 2.249829 -0.652531 -0.890208
C 0.320975 1.145427 0.070632
C -0.113556 -0.111414 -0.390612
C 0.887154 -1.005772 -0.879284
C 3.287229 -1.624554 -1.380010
C -1.520549 -0.478198 -0.379805
C -2.432774 0.539133 0.195283
C -1.928094 1.729685 0.592449
C 3.655952 -2.602369 -0.301641
C -3.869987 0.246795 0.324695
C 4.820441 -2.621970 0.363203
C -4.529558 -0.486106 -0.682417
C -4.586078 0.698214 1.444902
C 5.932211 -1.647544 0.120811
C 5.098281 -3.656217 1.413825
C -5.890456 -0.735299 -0.552465
C -5.957923 0.452643 1.571538
C -6.618286 -0.261863 0.570688
H 3.328700 3.539568 -1.092245
H 3.808061 4.215591 0.469339
H 1.305826 3.668465 0.256325
H 2.083503 2.929726 1.665047
H 5.262259 2.619519 2.129552
H 3.818564 1.592705 2.169260
H 5.361282 0.906082 1.684216
H 5.493520 2.505635 -1.726875
H 6.258988 3.278032 -0.322990
H 6.402088 1.530911 -0.580273
H 2.886847 -2.183708 -2.256369
H 4.173595 -1.069598 -1.755152
H -2.467072 2.585429 0.999125
H 2.867928 -3.323439 -0.081822
H -0.468469 -2.397062 -1.321518
H -3.965341 -0.873318 -1.533135
H -4.076318 1.233117 2.244208
H 5.537402 -0.655494 -0.158814
H 6.568405 -1.512636 1.001888
H 6.574961 -1.989318 -0.701197
H 6.045629 -4.175562 1.219553
H 5.171171 -3.195560 2.407841
H 4.314825 -4.422679 1.470384
H -6.517679 0.801718 2.438240
H -6.074673 -1.828866 -2.179422
H -8.319317 -1.021906 -0.036754


%chk=000228564-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228564

0 1
O 3.972453 0.986178 -0.504504
O -0.639465 2.119338 0.536993
O 0.525940 -2.226272 -1.358521
O -1.887325 -1.625646 -0.834263
O -6.746754 -1.704181 -1.271658
O -8.108931 -0.432862 0.681168
C 4.477148 2.223184 0.210474
C 3.462612 3.368664 -0.009854
C 2.061498 3.006305 0.524416
C 1.657091 1.618394 0.061185
C 2.611430 0.680989 -0.434075
C 4.660174 1.853034 1.696370
C 5.820243 2.509149 -0.473720
C 2.255908 -0.610876 -0.923246
C 0.319077 1.196405 0.061820
C -0.115371 -0.073659 -0.404165
C 0.893726 -0.977063 -0.900495
C 3.304814 -1.597785 -1.416473
C -1.519544 -0.458119 -0.379058
C -2.477272 0.521410 0.176855
C -1.974946 1.751320 0.561069
C 3.705780 -2.581519 -0.323027
C -3.929385 0.242026 0.321515
C 4.928081 -2.724074 0.265042
C -4.600182 -0.638286 -0.575198
C -4.690701 0.866477 1.350426
C 6.152888 -1.889157 -0.069209
C 5.153835 -3.783062 1.334403
C -5.978980 -0.851942 -0.443751
C -6.079334 0.652718 1.470746
C -6.736388 -0.204966 0.568704
H 3.408234 3.577992 -1.095260
H 3.837789 4.282656 0.486426
H 1.319433 3.747800 0.178060
H 2.047095 3.061428 1.631296
H 5.035443 2.723536 2.265272
H 3.712428 1.521054 2.153209
H 5.388945 1.030064 1.792698
H 5.673054 2.735808 -1.543788
H 6.317084 3.372101 0.004919
H 6.487257 1.633358 -0.393065
H 2.863153 -2.171272 -2.253233
H 4.178491 -1.048045 -1.798576
H -2.589968 2.579165 0.918005
H 2.889606 -3.241762 0.005154
H -0.508268 -2.283254 -1.261055
H -4.021878 -1.160250 -1.343010
H -4.191631 1.497828 2.093295
H 5.920194 -1.038676 -0.729384
H 6.607832 -1.485705 0.858239
H 6.931545 -2.509818 -0.557002
H 5.963220 -4.480787 1.038924
H 5.469018 -3.321597 2.292217
H 4.242223 -4.376293 1.522316
H -6.662027 1.125181 2.266589
H -6.185024 -2.179209 -1.929571
H -8.382568 -1.078420 -0.023445


