%chk=000190140.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190140

0 1
O -0.184918 0.266431 0.686188
O -2.068588 -1.288166 0.787653
O -0.769684 1.368384 2.569126
O -3.837111 -2.052623 1.974571
C 0.169125 -0.918093 1.477769
C -1.148412 -1.627465 1.875676
C 1.109975 -1.698469 0.593856
C -0.982955 -3.140633 1.968070
C -0.430808 -3.696170 0.653822
C 0.825459 -2.990441 0.225264
C 2.351424 -1.070814 0.168345
C 3.252054 -1.820288 -0.659463
C 1.738191 -3.729572 -0.613232
C 2.899433 -3.168104 -1.041214
C 2.712882 0.233501 0.538688
C 4.459254 -1.249378 -1.086287
C 3.921390 0.807740 0.116706
C 4.812729 0.054910 -0.712562
C -0.679800 1.362937 1.360475
C -3.415115 -1.510971 0.977127
C 4.295918 2.150892 0.497880
C 6.051860 0.663495 -1.138607
C -1.026181 2.437243 0.401292
C -4.172120 -1.002683 -0.191560
C 5.473963 2.690279 0.076027
C 6.368690 1.932942 -0.757801
C -1.739357 3.549319 0.877173
C -0.653150 2.356232 -0.948992
C -5.538190 -1.312594 -0.288622
C -3.548387 -0.219161 -1.174425
C -2.079528 4.578519 -0.003246
C -0.995560 3.391050 -1.822244
C -6.276583 -0.840263 -1.375415
C -4.295003 0.250436 -2.257683
C -1.707810 4.499318 -1.350165
C -5.655471 -0.060365 -2.358024
H 0.689955 -0.572109 2.406360
H -1.572716 -1.189007 2.809412
H -1.963708 -3.607727 2.205287
H -0.313363 -3.396171 2.812979
H -1.193662 -3.570424 -0.149850
H -0.263497 -4.787331 0.748921
H 1.468744 -4.746729 -0.895509
H 3.592504 -3.718581 -1.677534
H 2.041585 0.827749 1.159943
H 5.133939 -1.828201 -1.716741
H 3.609793 2.713514 1.129994
H 6.719445 0.078183 -1.768947
H 5.766240 3.700716 0.357765
H 7.299438 2.402530 -1.071602
H -2.021007 3.599985 1.932516
H -0.094928 1.484270 -1.304504
H -6.011786 -1.917611 0.488874
H -2.482140 0.016829 -1.081614
H -2.633745 5.442846 0.360241
H -0.704381 3.335481 -2.870171
H -7.336227 -1.077628 -1.456449
H -3.816309 0.859941 -3.022484
H -1.973409 5.305491 -2.034294
H -6.235382 0.307407 -3.204557


%chk=000190140-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190140

0 1
O -0.176699 0.455129 0.648630
O -2.123484 -1.348463 0.569802
O -0.693253 1.474835 2.683266
O -3.970483 -1.618519 1.973371
C 0.117889 -0.816624 1.392269
C -1.218875 -1.503845 1.749561
C 1.078416 -1.642550 0.547085
C -1.014229 -2.999069 2.025903
C -0.455366 -3.683921 0.764508
C 0.783264 -2.976850 0.232104
C 2.343871 -1.055939 0.121876
C 3.245247 -1.847519 -0.713594
C 1.689538 -3.737793 -0.590057
C 2.868706 -3.190851 -1.067347
C 2.767620 0.243357 0.502500
C 4.478532 -1.301704 -1.143645
C 4.010005 0.786265 0.087055
C 4.889005 -0.000378 -0.768923
C -0.606195 1.534162 1.428839
C -3.497125 -1.412175 0.827515
C 4.431651 2.106750 0.482290
C 6.143492 0.567860 -1.192444
C -0.923352 2.730471 0.599052
C -4.300112 -1.209500 -0.413410
C 5.650956 2.624505 0.055718
C 6.516710 1.846974 -0.791479
C -1.388629 3.896534 1.261451
C -0.775081 2.726114 -0.812765
C -5.712465 -1.308080 -0.315816
C -3.692628 -0.922006 -1.663827
C -1.703320 5.050975 0.516717
C -1.088903 3.885393 -1.552418
C -6.512591 -1.123357 -1.461562
C -4.498466 -0.738085 -2.807225
C -1.553511 5.047520 -0.891162
C -5.906978 -0.838891 -2.709232
H 0.589970 -0.518032 2.351256
H -1.693483 -0.992578 2.603989
H -1.973183 -3.445887 2.339097
H -0.302890 -3.109125 2.868255
H -1.239571 -3.700650 -0.018271
H -0.207461 -4.739454 0.982680
H 1.424317 -4.774041 -0.831921
H 3.544340 -3.780626 -1.698058
H 2.127027 0.864784 1.133332
H 5.136775 -1.912503 -1.774709
H 3.770975 2.700093 1.125670
H 6.801674 -0.027579 -1.836690
H 5.960230 3.629893 0.361838
H 7.472728 2.271543 -1.117253
H -1.497119 3.873587 2.350860
H -0.415066 1.820418 -1.308612
H -6.156508 -1.526455 0.661078
H -2.603225 -0.843770 -1.721738
H -2.064610 5.949701 1.027926
H -0.972954 3.885073 -2.641549
H -7.602596 -1.199491 -1.385472
H -4.031767 -0.515202 -3.772843
H -1.798290 5.945536 -1.469623
H -6.529472 -0.695162 -3.599650


