%chk=000243723.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243723

0 1
O -0.927785 0.890745 -1.753049
O 1.662938 2.347376 -1.741285
O -4.363395 -0.157620 1.347667
O 0.817549 -2.806191 -1.313317
O -1.070743 -3.394331 0.363515
O 4.600280 -0.978499 1.575154
O 4.824497 1.870031 1.606246
C 1.137816 -0.548830 -1.995166
C 0.206186 0.498352 -2.602400
C 2.127043 0.039882 -1.029185
C 0.908729 1.833610 -2.863542
C 0.351107 -1.688619 -1.310006
C -0.903754 -1.294739 -0.685289
C -1.453571 -0.007335 -0.883125
C 2.333227 1.423506 -0.962938
C -2.612956 0.438161 -0.218401
C -3.254027 -0.471055 0.664416
C -4.996015 1.210495 1.242197
C 2.892736 -0.787975 -0.186321
C -1.606251 -2.159427 0.197270
C -2.767256 -1.776485 0.869880
C -3.180313 1.763207 -0.382304
C 3.244299 2.006230 -0.065710
C -4.283646 2.120698 0.289755
C 3.800072 -0.241034 0.712302
C 3.977340 1.175507 0.783523
C -4.926807 1.705753 2.681985
C -6.407504 0.868227 0.779648
C 4.332229 -2.399345 1.664948
C 5.639420 1.121384 2.545593
H 1.727172 -1.017610 -2.834147
H -0.283594 0.110993 -3.527881
H 1.609082 1.755189 -3.716077
H 0.180030 2.655415 -3.027164
H 2.756444 -1.871476 -0.253473
H -3.297343 -2.440442 1.542383
H -2.663866 2.438542 -1.068370
H 3.372501 3.087256 -0.030638
H -4.731150 3.106184 0.189138
H -5.540132 2.600414 2.831604
H -5.273937 0.935494 3.383493
H -3.896131 1.956514 2.967190
H -7.079432 1.728728 0.863744
H -6.414582 0.538770 -0.267633
H -6.831233 0.048576 1.375468
H -1.600643 -3.957563 0.992935
H 3.299678 -2.576915 1.980657
H 5.042693 -2.710585 2.440073
H 4.552553 -2.887690 0.710747
H 6.195181 1.922044 3.045890
H 6.304819 0.439747 2.004109
H 4.998143 0.571938 3.242588


%chk=000243723-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243723

0 1
O -0.787164 0.873947 -1.749778
O 1.721940 2.311720 -1.999131
O -4.493017 -0.295942 1.094779
O 0.906399 -2.951080 -1.492900
O -1.238885 -3.675717 0.021017
O 4.530769 -0.927830 1.673791
O 4.850081 1.913173 1.587652
C 1.184348 -0.622544 -2.104783
C 0.248136 0.427888 -2.717381
C 2.143319 0.023209 -1.097236
C 1.007186 1.691375 -3.122332
C 0.387371 -1.793959 -1.481595
C -0.909396 -1.443184 -0.873874
C -1.418699 -0.105261 -0.984262
C 2.362999 1.421706 -1.105365
C -2.597528 0.328742 -0.330147
C -3.302727 -0.622444 0.461102
C -4.807278 1.174605 1.357132
C 2.859118 -0.763830 -0.162204
C -1.692546 -2.363363 -0.094807
C -2.871703 -1.960047 0.562938
C -3.181591 1.657440 -0.508033
C 3.238715 2.017613 -0.173465
C -4.251835 2.045645 0.241002
C 3.757502 -0.186734 0.757603
C 3.936374 1.234701 0.763741
C -4.155387 1.526848 2.714316
C -6.341706 1.212303 1.425509
C 4.401539 -2.386906 1.626784
C 4.801879 1.642671 3.039485
H 1.772041 -1.077215 -2.927176
H -0.280456 0.005364 -3.596760
H 1.728292 1.432844 -3.924872
H 0.316505 2.469929 -3.483015
H 2.704049 -1.846548 -0.179787
H -3.461166 -2.661747 1.163151
H -2.747263 2.312633 -1.267533
H 3.390553 3.099903 -0.177704
H -4.727350 3.022498 0.097893
H -4.382737 2.574365 2.983652
H -4.542355 0.864767 3.509278
H -3.058294 1.419897 2.658010
H -6.684002 2.231142 1.681170
H -6.780944 0.924758 0.455764
H -6.706657 0.515247 2.199109
H -1.859187 -4.199478 0.591251
H 3.370015 -2.709795 1.866845
H 5.097871 -2.761652 2.391618
H 4.687835 -2.781600 0.633011
H 5.556616 2.315256 3.475138
H 5.045302 0.589909 3.254511
H 3.800817 1.889982 3.443587


