%chk=000220507.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220507

0 1
O -4.730841 -1.006925 0.420888
O 5.210824 -0.747086 -1.507670
C -2.384480 -0.485313 0.225118
C -1.666413 0.748158 -0.405734
C -0.344401 1.055929 0.318137
C -3.782324 -0.414296 -0.486281
C -2.738464 1.852345 -0.429091
C -4.077242 1.109603 -0.622265
C -1.505536 -1.714523 -0.066965
C 0.461642 -0.228168 0.488013
C 1.901735 -0.031718 0.967962
C 0.423188 2.144894 -0.460255
C -2.596191 -0.360813 1.740385
C -0.077446 -1.445238 0.317358
C 1.842134 2.359952 0.084009
C 2.539526 1.028350 0.069683
C -3.877086 -1.141522 -1.826021
C 2.752553 -1.331700 0.971079
C 1.859403 0.470468 2.429270
C 3.313570 -1.694886 -0.400861
C 3.575365 0.788797 -0.748178
C 4.159773 -0.553990 -0.934911
H -1.415497 0.492068 -1.466997
H -0.566589 1.444024 1.345190
H -2.557054 2.576638 -1.238322
H -2.741993 2.429461 0.511116
H -4.807759 1.410091 0.149284
H -4.531577 1.353710 -1.593485
H -1.540789 -1.993343 -1.139169
H -1.892565 -2.595912 0.482803
H -0.141591 3.094989 -0.422011
H 0.483729 1.868028 -1.532329
H -3.263612 -1.159337 2.098190
H -1.655704 -0.439017 2.292668
H -3.075505 0.586051 2.007535
H 0.510269 -2.353521 0.465289
H 1.813714 2.783472 1.107844
H 2.376011 3.112008 -0.529987
H -3.775007 -2.225856 -1.691303
H -4.839020 -0.967174 -2.319290
H -3.095592 -0.813688 -2.520951
H 2.153954 -2.174442 1.370217
H 3.597802 -1.210801 1.680412
H -5.608171 -1.089778 0.008097
H 1.442474 -0.296650 3.092257
H 2.860634 0.722633 2.795419
H 1.234086 1.363326 2.542203
H 2.497357 -1.902104 -1.123373
H 3.913109 -2.624903 -0.349733
H 4.034000 1.569011 -1.356143


%chk=000220507-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220507

0 1
O -4.788252 -1.221394 0.274120
O 5.067230 -0.851420 -1.816970
C -2.421882 -0.500229 0.233147
C -1.691599 0.731079 -0.382421
C -0.358571 1.053304 0.324342
C -3.803700 -0.441579 -0.514185
C -2.769415 1.850875 -0.421542
C -4.136611 1.092999 -0.512652
C -1.538231 -1.744898 -0.009350
C 0.468095 -0.233079 0.526122
C 1.932703 -0.025643 1.010042
C 0.421001 2.141865 -0.468613
C -2.653610 -0.335925 1.760824
C -0.084168 -1.468306 0.353491
C 1.868012 2.369334 0.059361
C 2.562334 1.026239 0.079403
C -3.786066 -1.006749 -1.951476
C 2.811783 -1.309010 1.035052
C 1.893922 0.511199 2.482439
C 3.319312 -1.755583 -0.350909
C 3.583017 0.737079 -0.790713
C 4.093856 -0.628185 -1.032973
H -1.431388 0.463963 -1.429586
H -0.591732 1.478943 1.325932
H -2.617842 2.537426 -1.273316
H -2.721988 2.463617 0.499374
H -4.767250 1.310811 0.368128
H -4.710385 1.382269 -1.412919
H -1.586126 -2.066074 -1.070087
H -1.908579 -2.603739 0.585512
H -0.141342 3.094558 -0.435723
H 0.484105 1.832302 -1.531309
H -3.310126 -1.142818 2.123884
H -1.693973 -0.389628 2.304355
H -3.140794 0.623471 2.009816
H 0.536958 -2.360807 0.501909
H 1.823209 2.819218 1.069697
H 2.401850 3.078676 -0.598302
H -3.593664 -2.093621 -1.947736
H -4.768194 -0.836728 -2.435287
H -3.023808 -0.516396 -2.583505
H 2.267429 -2.130280 1.536233
H 3.693077 -1.092474 1.671150
H -5.644550 -1.236270 -0.223819
H 1.552110 -0.299084 3.151873
H 2.903715 0.825862 2.805465
H 1.210851 1.366134 2.616065
H 2.466926 -2.022927 -1.008188
H 3.971011 -2.644144 -0.281345
H 4.019743 1.527068 -1.415708


