%chk=000156514.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156514

0 1
 O    4.805700       1.324200      -1.917300    
 O    5.023400       2.960000      0.3189000    
 C    1.915500      -1.744800      0.5429000    
 C   0.4128000      -1.367800      0.3293000    
 C    2.769300     -0.4557000      0.4780000    
 C   7.0799999E-02 -0.7224000      -1.024000    
 C    2.035100      -2.381000       1.956400    
 C    2.437500      -2.845100     -0.3873000    
 C   -1.406900     -0.4582000      -1.128800    
 C    3.398400     -0.1616000     -0.7002000    
 C    2.846500      0.3187000       1.602700    
 C   -2.059300      0.6494000     -0.7254000    
 C   -3.547100      0.8647000     -0.8964000    
 C    4.167300       1.000700     -0.7585000    
 C    3.615800       1.481000       1.544400    
 C    1.745100      -3.808600      -1.008000    
 C   -4.263700       1.015500      0.4484000    
 C    4.276200       1.821900      0.3639000    
 C   -1.307900       1.790600     -9.3300000E-02
 C   -5.743600       1.192900      0.2537000    
 C   -6.696100      0.2411000      0.2600000    
 C   -8.164400      0.4864000      5.8300000E-02
 C   -6.330300      -1.202000      0.4824000    
 H  -0.2124000      -2.260800      0.4685000    
 H   0.1044000     -0.6752000       1.125900    
 H   0.3443000      -1.396300      -1.844100    
 H   0.6451000      0.1900000      -1.200100    
 H    1.520900      -1.801400       2.731000    
 H    3.081800      -2.504800       2.262200    
 H    1.569700      -3.375400       1.983400    
 H    3.521400      -2.906300     -0.4935000    
 H   -1.988600      -1.261300      -1.578000    
 H    3.308200     -0.7687000      -1.594500    
 H    2.326800      0.1068000       2.528200    
 H   -3.982700      2.5200000E-02  -1.453800    
 H   -3.708300       1.758100      -1.513400    
 H    3.686700       2.115800       2.423800    
 H   0.6673000      -3.885100     -0.9344000    
 H    2.260900      -4.552100      -1.606600    
 H   -3.899600       1.904100      0.9789000    
 H   -4.039700      0.1713000       1.109500    
 H   -1.593600       1.897200      0.9581000    
 H  -0.2212000       1.696000     -0.1114000    
 H   -1.549000       2.726300     -0.6098000    
 H   -6.058900       2.220000      7.5000003E-02
 H    5.288700       2.157300      -1.778200    
 H    4.982800       3.400000       1.185300    
 H   -8.731600      0.1429000      0.9293000    
 H   -8.523600     -4.7400001E-02 -0.8273000    
 H   -8.379400       1.550800     -8.2500003E-02
 H   -5.261400      -1.414900      0.4135000    
 H   -6.814900      -1.828900     -0.2749000    
 H   -6.679800      -1.528800       1.467300    


%chk=000156514-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156514

0 1
O 5.231381 1.192045 -1.756483
O 5.260107 2.929519 0.315069
C 1.969250 -1.846599 0.535881
C 0.474019 -1.421111 0.345734
C 2.867801 -0.584445 0.523528
C 0.175791 -0.528793 -0.892234
C 2.093224 -2.585719 1.910923
C 2.446059 -2.860531 -0.508125
C -1.311886 -0.301323 -1.073316
C 3.666385 -0.266560 -0.605286
C 2.861169 0.320284 1.617877
C -2.032071 0.821832 -0.780523
C -3.539512 0.853344 -1.017611
C 4.446996 0.903362 -0.633365
C 3.637556 1.502187 1.596504
C 1.696672 -3.566460 -1.390264
C -4.383230 0.874258 0.298324
C 4.432112 1.790175 0.472818
C -1.428977 2.099109 -0.219501
C -5.867853 0.984631 0.019994
C -6.860187 0.105741 0.345868
C -8.306596 0.390319 -0.031369
C -6.649532 -1.199476 1.093997
H -0.151858 -2.335680 0.305329
H 0.152948 -0.871362 1.252660
H 0.585219 -1.016472 -1.798202
H 0.717829 0.427013 -0.784950
H 1.769564 -1.941590 2.747888
H 3.135889 -2.897212 2.102837
H 1.455949 -3.488018 1.910683
H 3.526249 -3.075691 -0.456690
H -1.869860 -1.164066 -1.473762
H 3.685050 -0.916864 -1.484743
H 2.248842 0.115608 2.501518
H -3.848043 -0.025985 -1.613921
H -3.805407 1.753399 -1.612348
H 3.620472 2.187856 2.453488
H 0.616467 -3.419298 -1.500015
H 2.153996 -4.322554 -2.038535
H -4.066365 1.743797 0.910836
H -4.143091 -0.029260 0.887226
H -1.884034 2.360102 0.756064
H -0.339375 2.028091 -0.070493
H -1.626814 2.952603 -0.898495
H -6.161218 1.894891 -0.528984
H 5.705598 2.051091 -1.601196
H 5.225292 3.521207 1.103672
H -8.952923 0.431811 0.868447
H -8.715279 -0.413322 -0.676516
H -8.409123 1.348315 -0.570501
H -5.591025 -1.399796 1.325455
H -7.037226 -2.053211 0.502997
H -7.211998 -1.196891 2.049311


