%chk=000185849.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185849

0 1
O -0.713984 -0.681845 -1.581113
O -0.752379 -1.434467 1.008379
O -2.689288 0.762723 -2.625161
O 4.365256 0.353079 0.430227
O 2.277701 2.140877 1.017145
O 3.908735 -1.730509 -1.383095
O -5.311946 -0.033913 1.450069
O -1.309096 -1.717894 3.208539
O -4.860892 0.739961 -3.352756
O 5.058200 1.681734 -1.299209
O 1.907590 0.970876 2.934868
O 3.389303 -3.259828 0.221778
O -6.368763 1.713050 0.417312
C -1.820773 -0.391417 -0.777404
C 0.523708 -0.321616 -1.069674
C -1.917011 -0.862631 0.559318
C -2.922983 0.262653 -1.358807
C 3.107809 0.178995 -0.135809
C 2.034984 1.018280 0.219819
C 2.847319 -0.907720 -0.996064
C 0.737516 0.784431 -0.232600
C 1.568282 -1.173015 -1.475447
C -4.174978 -0.069242 0.654729
C -3.091508 -0.702717 1.288058
C -4.118900 0.422614 -0.650405
C -0.461265 -1.749853 2.364233
C -3.710591 0.993326 -3.568743
C 5.302610 1.146493 -0.255139
C 2.194648 2.013278 2.409187
C 4.107413 -2.930975 -0.683401
C -6.382951 0.854618 1.253464
C 0.979056 -2.071299 2.398647
C -3.037662 1.555596 -4.766952
C 6.540758 1.146586 0.570028
C 2.502307 3.342401 2.993816
C 5.285815 -3.601725 -1.287228
C -7.410933 0.498698 2.265040
H -0.082520 1.437236 0.062491
H 1.365397 -2.026075 -2.121706
H -3.181967 -1.060833 2.318578
H -4.981663 0.917839 -1.112796
H 1.379267 -2.442657 1.432989
H 1.210410 -2.822218 3.168695
H 1.571299 -1.157422 2.635210
H -1.938500 1.596335 -4.656122
H -3.388517 2.581339 -4.967916
H -3.259258 0.949314 -5.660757
H 7.387283 0.731661 -0.000125
H 6.815029 2.173378 0.859863
H 6.434685 0.552694 1.493257
H 1.642675 3.723409 3.571147
H 3.356775 3.278281 3.687099
H 2.746560 4.097765 2.226228
H 5.720587 -3.024729 -2.122309
H 5.012070 -4.596145 -1.678048
H 6.078149 -3.753423 -0.536062
H -8.335527 0.150694 1.774635
H -7.674955 1.373978 2.880803
H -7.076785 -0.303423 2.946898


%chk=000185849-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185849

0 1
O -0.831854 -0.338558 -1.528248
O -0.928274 -1.383295 1.018321
O -2.952844 1.135641 -2.553072
O 4.364697 0.571216 0.460195
O 2.265927 2.261571 1.271359
O 3.888928 -1.423963 -1.483349
O -5.511002 0.184528 1.572578
O -1.561779 -1.888655 3.231980
O -2.971499 -0.940113 -3.656899
O 5.157338 1.567302 -1.518350
O 2.249209 0.756852 3.071889
O 3.181515 -3.240445 -0.166934
O -6.941777 1.471604 0.209003
C -1.968822 -0.147228 -0.717745
C 0.453980 -0.051805 -1.012591
C -2.090164 -0.706627 0.587943
C -3.077279 0.522763 -1.276827
C 3.072372 0.399869 -0.095912
C 2.001582 1.200096 0.355526
C 2.801298 -0.624150 -1.028852
C 0.688666 0.993349 -0.095004
C 1.501118 -0.854655 -1.502526
C -4.367097 0.130078 0.722608
C -3.287739 -0.562689 1.315450
C -4.287784 0.676921 -0.576050
C -0.692692 -1.879793 2.341463
C -2.832363 0.290620 -3.706109
C 5.381984 1.150234 -0.373834
C 2.416967 1.912715 2.647854
C 3.981241 -2.765183 -0.989923
C -6.725733 0.842179 1.263219
C 0.741235 -2.323817 2.444746
C -2.532958 1.148806 -4.909812
C 6.688837 1.145754 0.380429
C 2.779106 3.144803 3.438441
C 5.159639 -3.448716 -1.638082
C -7.688125 0.644020 2.411401
H -0.123249 1.623413 0.277664
H 1.286633 -1.664737 -2.202964
H -3.391571 -0.983503 2.315032
H -5.121469 1.207623 -1.033836
H 1.106853 -2.762078 1.502593
H 0.843968 -3.039833 3.274028
H 1.369696 -1.437801 2.662990
H -1.500598 1.534939 -4.836132
H -3.208893 2.019140 -4.941473
H -2.633947 0.551832 -5.827381
H 7.018697 0.105425 0.548784
H 7.452943 1.686448 -0.195699
H 6.560574 1.609929 1.372686
H 2.843881 2.896085 4.506950
H 3.745859 3.545323 3.087128
H 2.023708 3.933196 3.279487
H 4.950320 -3.608744 -2.710820
H 5.341076 -4.418241 -1.153021
H 6.057721 -2.812413 -1.574071
H -7.908990 -0.430391 2.537184
H -8.618894 1.192970 2.210036
H -7.236570 0.996787 3.354251


