%chk=000186449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186449

0 1
O -0.017331 -1.087748 -1.091471
O 3.223632 1.587538 -2.167139
O -0.896269 0.841673 -1.901869
O -1.188539 -0.224329 3.093149
O -0.156315 0.769965 1.383067
C 2.139123 -0.015524 -0.747130
C 3.482499 -0.707278 -0.463575
C 4.212846 -0.062619 0.722089
C 1.279576 -0.824172 -1.722721
C 5.536291 -0.781759 1.018742
C 2.380127 1.390198 -1.321328
C 6.270677 -0.145983 2.196956
C 1.492422 2.469083 -0.794390
C -0.998319 -0.138581 -1.205799
C -2.187769 -0.576397 -0.405478
C -2.233129 -0.464761 0.995409
C -3.283180 -1.092596 -1.106213
C -3.383942 -0.879591 1.684401
C -4.426959 -1.500624 -0.410631
C -4.476466 -1.395422 0.981916
C -1.091798 0.097517 1.757732
H 1.567868 0.071619 0.219980
H 3.313798 -1.781969 -0.258798
H 4.121982 -0.654911 -1.370619
H 3.567694 -0.075384 1.621062
H 4.410859 1.006277 0.505846
H 1.645125 -1.855304 -1.881901
H 1.116772 -0.323256 -2.693859
H 5.346732 -1.852154 1.229651
H 6.184320 -0.759346 0.119862
H 7.215610 -0.662553 2.399325
H 6.508905 0.906342 2.001994
H 5.672866 -0.182099 3.114296
H 1.258331 2.359697 0.274405
H 0.516834 2.442972 -1.319612
H 1.917101 3.467122 -0.960408
H -3.247459 -1.173430 -2.195019
H -3.416201 -0.799378 2.776131
H -5.280543 -1.901517 -0.960426
H -5.367387 -1.715977 1.523795
H -0.432086 0.148557 3.626081


%chk=000186449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186449

0 1
O -0.121257 -1.342250 -0.579545
O 2.627442 1.150862 -2.238328
O -0.710269 0.449515 -1.957211
O -1.849921 -0.752444 3.196075
O -0.533861 0.416270 1.688782
C 2.155409 -0.277820 -0.329867
C 3.616456 -0.810441 -0.224063
C 4.554989 0.102295 0.596613
C 1.285171 -1.307132 -1.091487
C 5.970309 -0.497116 0.760834
C 2.163786 1.082899 -1.068385
C 6.916820 0.412953 1.572745
C 1.654278 2.294741 -0.314214
C -0.999346 -0.381548 -1.065329
C -2.371173 -0.551512 -0.471517
C -2.630432 -0.601789 0.929305
C -3.444196 -0.698073 -1.381476
C -3.948084 -0.856465 1.389122
C -4.754962 -0.938684 -0.915027
C -5.005017 -1.033165 0.473081
C -1.564163 -0.264237 1.913252
H 1.733861 -0.152210 0.684488
H 3.590332 -1.816385 0.243396
H 4.021687 -0.930319 -1.248412
H 4.115062 0.282754 1.600192
H 4.640554 1.091936 0.103743
H 1.632730 -2.335194 -0.901299
H 1.278387 -1.092947 -2.175503
H 5.892911 -1.487644 1.254619
H 6.403551 -0.681984 -0.242925
H 7.921044 -0.037439 1.676386
H 7.037125 1.396943 1.081716
H 6.519965 0.592238 2.590062
H 2.303276 2.483592 0.564345
H 0.641903 2.097695 0.081189
H 1.646575 3.182295 -0.965245
H -3.239020 -0.631040 -2.454467
H -4.129789 -0.893954 2.466436
H -5.574098 -1.055603 -1.632267
H -6.018445 -1.226614 0.839310
H -1.131294 -0.459080 3.818378


