%chk=000126873.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126873

0 1
 O    5.031100      0.3536000      -1.006400    
 O   -7.036500      3.3000000E-03 -0.3508000    
 C    1.950500     -0.2725000     -9.2900001E-02
 C   0.9087000      0.7593000      0.3996000    
 C  -0.5015000      0.4638000     -0.1134000    
 C  -0.9157000     -0.9401000      0.3991000    
 C    3.219400      0.3362000      0.5441000    
 C    1.550100      -1.653800      0.4518000    
 C    1.555100       2.100000      7.3299997E-02
 C   0.1149000      -2.031100      4.2199999E-02
 C    3.051200       1.858300      0.3475000    
 C   -1.526100       1.513700      0.3351000    
 C   -2.315700      -1.305700     -0.1116000    
 C   -3.353500     -0.2519000      0.3049000    
 C    2.083700     -0.3425000      -1.637200    
 C   -2.932000       1.153100     -0.1461000    
 C    4.505400     -0.1746000     -2.7799999E-02
 C   -4.731900     -0.6048000     -0.2515000    
 C    5.124500      -1.364100      0.6548000    
 C   -5.781900      0.3998000      0.1854000    
 H   0.8608000      0.7051000       1.500400    
 H  -0.5026000      0.4619000      -1.210300    
 H  -0.9661000     -0.8997000       1.497500    
 H    3.231900      0.1444000       1.626000    
 H    1.614700      -1.659200       1.547500    
 H    2.236900      -2.428700      9.4499998E-02
 H    1.162400       2.910000      0.6962000    
 H    1.395300       2.379300     -0.9739000    
 H   7.8699999E-02  -2.240400      -1.033400    
 H  -0.1590000      -2.968000      0.5428000    
 H    3.649200       2.273300     -0.4703000    
 H    3.359000       2.383800       1.259400    
 H   -1.256700       2.499100     -6.1999999E-02
 H   -1.524700       1.598600       1.429100    
 H   -2.297400      -1.400300      -1.205300    
 H   -2.608800      -2.285000      0.2868000    
 H   -3.413700     -0.2541000       1.402200    
 H    2.805500      -1.114000      -1.929700    
 H    1.142700     -0.5972000      -2.131500    
 H    2.423500      0.6023000      -2.073000    
 H   -3.608500       1.916100      0.2515000    
 H   -2.969600       1.224200      -1.240500    
 H   -5.025700      -1.607900      8.3200000E-02
 H   -4.708000     -0.6551000      -1.347800    
 H    5.273000      -1.146900       1.715500    
 H    4.488900      -2.242400      0.5340000    
 H    6.099700      -1.574000      0.2060000    
 H   -5.867200      0.4542000       1.275100    
 H   -5.590500       1.402100     -0.2026000    
 H   -7.252200     -0.8696000      1.9500000E-02


%chk=000126873-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126873

0 1
O 5.205148 0.299520 -0.952955
O -7.263228 -0.131911 -0.207123
C 1.986241 -0.270122 -0.111351
C 0.932094 0.789459 0.363557
C -0.493553 0.496352 -0.145609
C -0.920473 -0.915267 0.358723
C 3.283111 0.353547 0.558987
C 1.558179 -1.660039 0.423419
C 1.601609 2.147898 0.049992
C 0.110537 -2.009805 -0.018321
C 3.121004 1.894407 0.334156
C -1.528013 1.554483 0.306213
C -2.342388 -1.265726 -0.138030
C -3.397563 -0.211547 0.287455
C 2.154284 -0.307201 -1.654232
C -2.956038 1.202229 -0.174066
C 4.601382 -0.213914 0.029757
C -4.801757 -0.595982 -0.245029
C 5.165032 -1.437634 0.744896
C -5.941117 0.295681 0.282693
H 0.892694 0.698702 1.475308
H -0.491490 0.485286 -1.257915
H -0.955908 -0.855347 1.471663
H 3.219790 0.114914 1.641147
H 1.606086 -1.653518 1.533368
H 2.248244 -2.452755 0.071001
H 1.196550 2.967333 0.669683
H 1.437408 2.428408 -1.007744
H 0.084584 -2.174625 -1.114517
H -0.191014 -2.970431 0.445407
H 3.755311 2.209695 -0.512265
H 3.464546 2.448803 1.225904
H -1.240548 2.552919 -0.076394
H -1.516588 1.622062 1.415541
H -2.332489 -1.341039 -1.246982
H -2.638065 -2.264527 0.244463
H -3.435961 -0.204775 1.400916
H 2.857461 -1.108276 -1.947309
H 1.197024 -0.501869 -2.165969
H 2.565143 0.637972 -2.046857
H -3.666844 1.968183 0.192066
H -2.989953 1.240312 -1.283879
H -5.015543 -1.649389 0.041329
H -4.805648 -0.561037 -1.353036
H 5.552728 -1.135075 1.737927
H 4.379046 -2.192945 0.927276
H 5.988838 -1.878814 0.162133
H -5.922729 0.318727 1.395343
H -5.845551 1.329697 -0.086160
H -7.400313 -1.081120 0.042424


