%chk=000235423.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235423

0 1
O 5.479331 -2.145738 -2.070308
O 6.538752 -0.033568 -2.293752
O -0.149276 -1.008665 2.643554
O -3.407721 -0.129011 -2.089806
O -4.697325 1.573329 2.247546
O -5.323326 1.258365 -0.400904
C 2.252583 -0.471231 1.349655
C 0.915150 -0.244238 0.635783
C 3.402414 -0.305953 0.394628
C -0.261692 -0.504358 1.548668
C 3.825483 -1.432446 -0.362394
C 4.876541 -1.224659 -1.223748
C -1.606085 -0.069622 1.022321
C 4.027444 0.934855 0.258146
C 5.512432 0.046000 -1.357763
C 5.109166 1.141373 -0.629965
C -2.491280 0.540508 1.922653
C -1.955036 -0.274655 -0.306237
C -3.229434 0.138819 -0.760506
C -3.743709 0.963290 1.468215
C 6.546417 -1.419519 -2.766277
C -4.136474 0.767011 0.116120
C -4.667483 0.238084 -2.712592
C -4.391515 1.774167 3.652061
C -6.522844 0.800079 0.282719
H 2.262427 -1.482461 1.813941
H 2.344265 0.225151 2.209631
H 0.863909 0.788851 0.230830
H 0.843015 -0.904156 -0.256412
H 3.344414 -2.400361 -0.259646
H 3.681922 1.781946 0.849922
H 5.588611 2.110918 -0.725949
H -2.191742 0.660914 2.961602
H -1.286987 -0.756234 -1.017738
H 6.304823 -1.412917 -3.837075
H 7.504271 -1.870480 -2.475875
H -4.851709 1.312223 -2.589424
H -4.481385 -0.028510 -3.759133
H -5.480973 -0.348753 -2.278083
H -5.308824 2.259589 4.009265
H -4.232117 0.812761 4.149241
H -3.529384 2.438882 3.760456
H -6.547290 1.207697 1.301321
H -7.313801 1.236216 -0.336107
H -6.565257 -0.290494 0.289215


%chk=000235423-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235423

0 1
O 5.118390 -2.573306 -2.009176
O 6.499411 -0.694318 -2.575538
O 0.063209 0.294344 2.907222
O -3.249312 0.889573 -2.113284
O -5.020868 0.961939 2.466205
O -5.494896 1.192851 -0.272229
C 2.391670 0.069783 1.355271
C 1.020078 0.261869 0.664825
C 3.516881 -0.087843 0.342138
C -0.143091 0.363087 1.656875
C 3.723969 -1.350115 -0.294824
C 4.748487 -1.439600 -1.237159
C -1.533741 0.542593 1.123668
C 4.342857 1.012775 -0.000381
C 5.561772 -0.335099 -1.569200
C 5.382593 0.911015 -0.967361
C -2.598322 0.630687 2.060493
C -1.809844 0.624645 -0.257941
C -3.137196 0.788580 -0.722435
C -3.916473 0.810722 1.611045
C 6.359554 -2.166717 -2.720319
C -4.212572 0.889509 0.208823
C -4.492015 0.507522 -2.808157
C -4.750712 1.002085 3.908482
C -6.609317 0.298995 0.117334
H 2.330776 -0.813120 2.017715
H 2.582531 0.933671 2.016387
H 1.037805 1.172194 0.032247
H 0.824488 -0.578060 -0.032398
H 3.108132 -2.219557 -0.044861
H 4.181301 1.973908 0.500615
H 6.014056 1.765130 -1.224798
H -2.341992 0.570173 3.121671
H -1.023784 0.554688 -1.014152
H 6.257899 -2.414414 -3.788235
H 7.226569 -2.661007 -2.241759
H -5.278526 1.263135 -2.660783
H -4.200586 0.444715 -3.868403
H -4.854612 -0.479276 -2.461291
H -5.731249 1.169543 4.377631
H -4.321204 0.046045 4.263354
H -4.065105 1.832997 4.159521
H -6.737348 0.293129 1.210811
H -7.497130 0.721715 -0.376831
H -6.421832 -0.728187 -0.253017


