%chk=000181741.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181741

0 1
O 0.321982 1.469894 0.745217
O 1.862230 -1.070519 -0.331430
O 3.224017 0.262363 0.876540
O -4.561241 -1.047263 1.132460
C 1.292786 1.272443 -0.317677
C 0.666126 0.962483 -1.662657
C 2.055404 2.593716 -0.293426
C 2.254129 0.148464 0.170539
C -0.888807 0.785233 0.742209
C -1.003710 -0.603909 0.583260
C -1.995217 1.598767 1.036119
C 2.661598 -2.248298 0.015549
C -2.255875 -1.195962 0.717362
C -3.250232 1.008295 1.183961
C -3.361405 -0.380261 1.017566
C 3.914301 -2.285271 -0.833695
H -0.159553 1.653465 -1.881028
H 1.394361 1.047789 -2.478825
H 0.258782 -0.059435 -1.710157
H 2.905540 2.590725 -0.984134
H 1.397134 3.431883 -0.553927
H 2.450680 2.798254 0.715921
H -0.123532 -1.212969 0.363439
H -1.857397 2.672079 1.158297
H 2.881489 -2.214741 1.097818
H 1.949504 -3.059690 -0.219629
H -2.395293 -2.269313 0.602434
H -4.118311 1.615606 1.421210
H 4.459425 -3.227686 -0.702990
H 3.683438 -2.176419 -1.900798
H 4.600509 -1.468088 -0.563468
H -5.302162 -0.436538 1.361444


%chk=000181741-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181741

0 1
O 0.087988 1.739136 0.279727
O 2.028018 -1.057250 -0.809317
O 2.184624 -0.066672 1.295726
O -4.577953 -1.132676 1.655225
C 1.194157 1.232557 -0.577272
C 0.714524 1.016937 -2.024698
C 2.236567 2.368494 -0.493038
C 1.836196 -0.012867 0.097975
C -1.046996 0.948252 0.569928
C -1.217613 -0.422496 0.249984
C -2.069482 1.636657 1.265073
C 2.722172 -2.277931 -0.279225
C -2.403511 -1.089547 0.625059
C -3.252247 0.969380 1.639119
C -3.420854 -0.399497 1.316347
C 4.241626 -2.111916 -0.358006
H 0.286222 1.965047 -2.393845
H 1.561029 0.730222 -2.670090
H -0.052488 0.231923 -2.105046
H 3.132706 2.120158 -1.088624
H 1.791330 3.297368 -0.887374
H 2.530343 2.527866 0.556881
H -0.447198 -0.987855 -0.280795
H -1.917251 2.692019 1.509617
H 2.387131 -2.443747 0.759628
H 2.356939 -3.084600 -0.934471
H -2.548998 -2.147191 0.386338
H -4.035582 1.516296 2.179906
H 4.733783 -3.050436 -0.042163
H 4.562129 -1.886192 -1.389744
H 4.584034 -1.304587 0.310708
H -5.220646 -0.561753 2.143972


