%chk=000185670.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185670

0 1
O -0.285916 0.594786 -0.079203
O -4.726966 -1.370518 0.839327
O -5.807949 0.868179 0.152988
O -4.106714 3.062219 -0.761721
O 5.137975 -1.704343 -0.723597
O 3.962263 2.473662 1.397838
O 5.985879 0.613251 0.445670
O -2.113511 -3.013013 0.396906
C -2.392191 -0.641851 0.292080
C -1.676649 0.535981 -0.047871
C 0.435936 -0.549790 0.247332
C 1.880682 -0.230849 0.261174
C -3.798744 -0.493417 0.399271
C -1.628711 -1.894903 0.404872
C -0.164967 -1.725491 0.485860
C -4.434834 0.724564 0.007971
C -2.255237 1.747630 -0.390656
C -3.664784 1.833754 -0.391007
C 2.318008 0.973168 0.799503
C 2.785212 -1.169341 -0.267634
C 4.151575 -0.881665 -0.237365
C 3.703491 1.263012 0.821053
C 4.635497 0.341753 0.305122
C -4.373301 -2.572028 1.576966
C -6.584278 0.038845 -0.758549
C -5.537591 3.329804 -0.758127
C 4.737569 -2.978266 -1.291996
C 5.342441 2.914646 1.505687
C 6.744504 0.585036 -0.795431
H 0.395902 -2.626113 0.738657
H -1.651186 2.614529 -0.653045
H 1.618271 1.709176 1.199219
H 2.413578 -2.098661 -0.689014
H -5.322038 -2.799264 2.077687
H -3.573370 -2.377923 2.294312
H -4.083396 -3.356050 0.861138
H -6.307241 0.241148 -1.794183
H -7.607643 0.357600 -0.537805
H -6.437636 -1.018020 -0.505565
H -5.967046 3.092187 0.223205
H -6.020438 2.746852 -1.546440
H -5.558866 4.405315 -0.968018
H 4.105906 -2.821744 -2.170944
H 4.242639 -3.593212 -0.534309
H 5.708422 -3.408006 -1.571627
H 5.756628 3.082991 0.508254
H 5.935257 2.173701 2.055642
H 5.230458 3.848908 2.067830
H 6.320072 1.284153 -1.518111
H 6.767426 -0.437560 -1.192582
H 7.737616 0.899277 -0.457766


%chk=000185670-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185670

0 1
O -0.308767 0.662015 0.312531
O -4.660361 -1.711081 -0.199077
O -5.924665 0.656162 0.269206
O -4.316978 3.092590 0.642731
O 5.254025 -1.922361 0.099410
O 4.033346 2.800640 0.615092
O 6.072999 0.695634 0.535503
O -2.041842 -2.991001 -0.722653
C -2.388486 -0.664549 -0.015648
C -1.714696 0.568736 0.253386
C 0.480544 -0.459543 0.032612
C 1.924778 -0.172633 0.130196
C -3.824008 -0.608820 -0.006036
C -1.566445 -1.854986 -0.364531
C -0.117179 -1.652817 -0.305032
C -4.520441 0.622964 0.170006
C -2.376896 1.782269 0.465057
C -3.785603 1.829950 0.400595
C 2.374259 1.151168 0.317927
C 2.875861 -1.226603 0.032185
C 4.249043 -0.940608 0.129460
C 3.755584 1.448344 0.397955
C 4.718739 0.402247 0.308071
C -4.548384 -2.862379 0.728135
C -6.682805 0.240752 -0.933465
C -5.705754 3.443893 0.290192
C 4.831533 -3.324932 0.038268
C 5.326021 3.389521 0.223149
C 7.044714 0.301808 -0.509511
H 0.489991 -2.520699 -0.568543
H -1.813675 2.697332 0.657332
H 1.665143 1.977570 0.390433
H 2.539374 -2.258274 -0.087624
H -5.482586 -3.426565 0.582375
H -4.482390 -2.503342 1.771926
H -3.672204 -3.469512 0.450636
H -6.469901 0.926966 -1.777546
H -7.742626 0.315618 -0.645374
H -6.425409 -0.794427 -1.207832
H -6.424941 2.918166 0.935459
H -5.916751 3.210348 -0.769716
H -5.751392 4.532443 0.449606
H 4.289388 -3.542302 -0.902238
H 4.196597 -3.587179 0.905872
H 5.764854 -3.905700 0.071420
H 5.586066 3.120749 -0.818713
H 6.132102 3.068132 0.900032
H 5.160592 4.475869 0.296251
H 6.808252 0.810522 -1.464908
H 7.042416 -0.790576 -0.649025
H 8.020969 0.642583 -0.132542


