%chk=000242696.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242696

0 1
O -4.361066 -0.609199 -0.757969
O -4.296095 -1.843955 1.129980
O -2.140490 3.319046 1.441494
O -2.028909 2.969260 -0.789263
O 6.210097 -0.338682 -0.426015
C -2.192534 -1.336170 -0.081231
C -1.670565 0.107437 -0.331547
C -1.471470 -1.936471 1.141664
C -0.161364 0.108700 -0.447553
C 0.047056 -1.983597 0.948844
C 0.633518 -0.831191 0.175987
C -2.097483 1.079788 0.790527
C -2.007954 -2.200340 -1.334937
C -3.701578 -1.326389 0.214108
C 2.070279 -0.751379 0.055816
C 0.431640 1.149560 -1.232802
C 2.646540 0.292728 -0.721694
C 1.787490 1.241855 -1.369316
C -2.073784 2.507982 0.326797
C 2.947627 -1.682760 0.690698
C 4.057517 0.388840 -0.854186
C 4.313992 -1.594041 0.566355
C 4.862688 -0.540992 -0.219225
C -5.808720 -0.538306 -0.660488
C -2.130311 4.752810 1.211630
C 7.141986 -1.254891 0.195377
H -2.122642 0.469417 -1.296811
H -1.857570 -2.955349 1.348404
H -1.722330 -1.347151 2.046827
H 0.316815 -2.925637 0.420465
H 0.527673 -2.046672 1.948997
H -1.438983 0.961913 1.681249
H -3.122864 0.857137 1.159750
H -0.958968 -2.203954 -1.661868
H -2.298361 -3.242170 -1.159510
H -2.605245 -1.822298 -2.176180
H -0.230181 1.875215 -1.719427
H 2.240004 2.031339 -1.967228
H 2.522621 -2.486373 1.294308
H 4.501226 1.184750 -1.447642
H 4.962837 -2.311374 1.057730
H -6.226815 -1.480667 -1.026192
H -6.054098 0.301785 -1.318999
H -6.115937 -0.353228 0.374324
H -1.126933 5.052681 0.894088
H -2.385454 5.156295 2.196958
H -2.873299 5.019707 0.452961
H 6.990707 -2.269032 -0.184565
H 7.055966 -1.206434 1.284418
H 8.107025 -0.851141 -0.139505


%chk=000242696-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242696

0 1
O -4.449596 -0.721816 -0.854579
O -4.330627 -1.841694 1.176479
O -1.915761 3.350896 1.513719
O -2.281220 3.007190 -0.757726
O 6.292497 -0.285160 -0.388840
C -2.237408 -1.354431 -0.093133
C -1.720048 0.107362 -0.332119
C -1.505860 -1.946815 1.137958
C -0.193307 0.126044 -0.462760
C 0.023906 -2.007338 0.931404
C 0.623731 -0.824885 0.174176
C -2.178128 1.077423 0.802233
C -2.003415 -2.218536 -1.368350
C -3.749070 -1.349872 0.181050
C 2.063722 -0.726581 0.051490
C 0.406309 1.175104 -1.242675
C 2.655292 0.352523 -0.717267
C 1.785989 1.292673 -1.365778
C -2.126372 2.541114 0.394966
C 2.956130 -1.666525 0.662185
C 4.073486 0.454369 -0.832302
C 4.345151 -1.557187 0.541861
C 4.911086 -0.480853 -0.213372
C -5.924343 -0.681900 -0.708593
C -1.890408 4.811750 1.253723
C 7.202697 -1.245886 0.236955
H -2.166138 0.482413 -1.272156
H -1.894709 -2.957758 1.355034
H -1.746212 -1.334595 2.026166
H 0.286848 -2.935653 0.382155
H 0.505352 -2.105430 1.924103
H -1.581853 0.947560 1.720175
H -3.233992 0.872986 1.074863
H -0.933992 -2.229861 -1.637058
H -2.330103 -3.261315 -1.200137
H -2.569269 -1.808452 -2.221695
H -0.253611 1.887006 -1.750836
H 2.224230 2.097580 -1.967115
H 2.550232 -2.500526 1.242971
H 4.522432 1.268583 -1.410496
H 4.988137 -2.297285 1.027961
H -6.332815 -1.706307 -0.688084
H -6.277546 -0.129822 -1.590543
H -6.204043 -0.164224 0.224537
H -1.061240 5.059595 0.570113
H -1.740667 5.269043 2.241568
H -2.842285 5.137572 0.801625
H 7.044218 -2.269678 -0.154979
H 7.094244 -1.249631 1.339283
H 8.211651 -0.900367 -0.032558


