%chk=000185447.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185447

0 1
O -3.504594 -0.503315 -0.121807
O -2.239681 -2.490715 0.168444
O 1.987718 0.007246 0.154811
O -2.099540 2.237387 -0.356681
O 0.663650 2.164016 -0.368283
C -2.130837 -0.215777 -0.085099
C -1.385306 -1.405817 0.090157
C -1.501349 1.021849 -0.203385
C 0.638762 -0.183588 0.073094
C -0.077656 1.022709 -0.130662
C -0.007228 -1.437696 0.175183
C -3.599827 -1.953472 0.024582
C 2.838121 -1.180244 0.265154
C 4.257450 -0.661679 0.213017
C -3.552848 2.221705 -0.464647
C 0.492436 3.197977 0.641400
C 4.427195 0.816784 0.288394
C 5.271763 -1.524639 0.119891
H 0.527383 -2.367752 0.316071
H -4.021997 -2.364774 -0.901615
H -4.140172 -2.167666 0.955688
H 2.613253 -1.855627 -0.580484
H 2.617283 -1.673047 1.229537
H -3.854518 1.637065 -1.340422
H -3.780420 3.285921 -0.587060
H -3.991545 1.808154 0.449594
H 4.194276 1.187791 1.297398
H 3.723863 1.332872 -0.392258
H 5.441040 1.143609 0.031800
H -0.548162 3.540558 0.648384
H 1.166774 3.979529 0.276098
H 0.802779 2.824967 1.619169
H 5.156832 -2.594848 0.065730
H 6.306003 -1.216983 0.088408


%chk=000185447-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185447

0 1
O -3.562637 -0.534871 0.364854
O -2.217148 -2.483839 0.666967
O 2.010172 0.069234 -0.047261
O -2.261269 2.236044 -0.294376
O 0.511085 2.250423 -0.550754
C -2.178991 -0.225607 0.140523
C -1.390629 -1.371627 0.333422
C -1.586349 1.023358 -0.124136
C 0.623024 -0.108004 0.033036
C -0.154972 1.070792 -0.181989
C 0.003189 -1.364498 0.291330
C -3.589698 -2.019803 0.357145
C 2.856705 -1.118993 0.199858
C 4.304593 -0.676146 0.141972
C -3.624366 2.184699 -0.861118
C 0.455483 3.348734 0.437988
C 4.673738 0.510679 1.007009
C 5.196701 -1.353219 -0.626393
H 0.568500 -2.282501 0.455955
H -3.869825 -2.372453 -0.656175
H -4.274377 -2.367478 1.143812
H 2.646750 -1.898122 -0.559567
H 2.613328 -1.522447 1.208070
H -3.610987 1.691863 -1.850908
H -3.922140 3.238247 -0.968708
H -4.317092 1.651194 -0.189285
H 4.443069 0.313337 2.072777
H 4.076840 1.391639 0.709274
H 5.745215 0.757439 0.921173
H -0.586788 3.674854 0.599870
H 1.046432 4.164771 -0.005448
H 0.911823 3.030816 1.395516
H 4.893408 -2.194159 -1.261528
H 6.258115 -1.081857 -0.643303


