%chk=000239013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239013

0 1
O -2.462148 0.370895 0.164502
O 2.259272 1.723502 -0.671986
O 3.420162 -1.626727 -1.657928
O 2.133588 0.179885 0.985254
O 1.596539 -2.825266 -1.054039
C -0.061446 -0.436420 -1.292974
C 1.475748 -0.374063 -1.326792
C -0.618532 -1.073918 -0.015828
C -2.141651 -1.048764 0.006902
C 1.990422 0.474817 -0.175136
C 2.102918 -1.758058 -1.294067
C -3.785757 0.736443 0.224533
C 2.757092 2.744062 0.255726
C 4.266857 -2.823641 -1.634594
C -4.875043 -0.139566 0.141476
C -3.959848 2.128880 0.381088
C 4.217865 2.492690 0.560297
C 4.626615 -3.166179 -0.205647
C -6.165383 0.399216 0.217313
C -5.253609 2.631962 0.453056
C -6.360568 1.772134 0.371070
H -0.469723 0.593861 -1.396420
H -0.416176 -0.998352 -2.181159
H 1.789986 0.121194 -2.293435
H -0.262180 -2.125399 0.075180
H -0.224182 -0.546892 0.881900
H -2.552671 -1.596186 0.872809
H -2.597532 -1.408677 -0.930484
H 2.122557 2.732788 1.159623
H 2.583214 3.659877 -0.338700
H 5.127952 -2.473941 -2.233269
H 3.730818 -3.639958 -2.149948
H -4.742000 -1.208119 0.023643
H -3.087226 2.772895 0.444471
H 4.660115 3.324168 1.121663
H 4.804790 2.358001 -0.357850
H 4.347900 1.580874 1.163347
H 5.390655 -3.950865 -0.158945
H 3.749112 -3.525768 0.353804
H 5.010877 -2.291009 0.335890
H -7.025021 -0.268099 0.154990
H -5.410682 3.703697 0.574645
H -7.366279 2.178625 0.428721


%chk=000239013-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239013

0 1
O -2.518093 0.563474 0.151080
O 2.356575 1.812380 -0.499084
O 3.475056 -1.648568 -1.624668
O 2.553344 -0.020171 0.935002
O 1.437042 -2.764738 -1.429332
C -0.012126 -0.261699 -1.168075
C 1.536699 -0.280877 -1.318462
C -0.545914 -0.844319 0.158946
C -2.074065 -0.845071 0.208592
C 2.216530 0.466064 -0.167781
C 2.097690 -1.702389 -1.440774
C -3.897619 0.820164 0.169294
C 2.952527 2.701626 0.549781
C 4.200413 -2.957113 -1.697147
C -4.898654 -0.182035 0.239119
C -4.261987 2.189801 0.112821
C 4.480722 2.678334 0.466693
C 4.522793 -3.467960 -0.290533
C -6.260994 0.200207 0.250970
C -5.622700 2.552936 0.125589
C -6.632916 1.560952 0.194632
H -0.360758 0.780509 -1.276204
H -0.433297 -0.842277 -2.011504
H 1.802942 0.255468 -2.248311
H -0.197996 -1.887227 0.272704
H -0.161269 -0.270663 1.021729
H -2.437944 -1.306041 1.149549
H -2.501373 -1.401670 -0.652131
H 2.596966 2.362365 1.538553
H 2.535878 3.693319 0.312681
H 5.108545 -2.715138 -2.271674
H 3.573138 -3.673954 -2.255924
H -4.635538 -1.242887 0.284181
H -3.468562 2.942042 0.060633
H 4.904001 3.399925 1.189962
H 4.824914 2.958826 -0.543622
H 4.869794 1.675891 0.711331
H 5.134723 -4.386530 -0.360139
H 3.599362 -3.708374 0.261968
H 5.088888 -2.713423 0.281451
H -7.032488 -0.576581 0.304791
H -5.896932 3.613098 0.081647
H -7.689919 1.846922 0.204367


