%chk=000168943.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168943

0 1
 O   -4.196600     -0.4682000      0.6158000    
 O   -6.369700      -1.060700      0.1810000    
 O    6.599000     -0.5180000     -0.9822000    
 C   -1.725000     -0.2104000      0.4672000    
 C  -0.8861000      0.9424000     -0.1246000    
 C   -3.122600      0.1294000     -0.1274000    
 C   0.5604000      0.9502000      0.3831000    
 C    1.244100     -0.3963000      7.6000001E-03
 C   -1.068600      -1.532900      3.6899999E-02
 C   -1.742800       2.178300      0.1314000    
 C   -3.192400       1.679300      1.6000000E-03
 C   0.4065000      -1.614900      0.4690000    
 C    2.711900     -0.4479000      0.5320000    
 C    1.364200       2.120700     -0.1982000    
 C   -3.403800     -0.3290000      -1.554600    
 C   -1.814400     -0.1876000       2.020900    
 C    2.789800       2.118600      0.3426000    
 C    3.485400      0.7985000      0.1214000    
 C   -4.916900     -0.3285000      -1.612800    
 C    3.410000      -1.738000      5.4200001E-02
 C   -5.275800     -0.6737000     -0.1995000    
 C    4.915100      -1.696100      0.2515000    
 C    4.733100      0.7762000     -0.3740000    
 C    5.495200     -0.4918000     -0.4429000    
 H  -0.8377000      0.8167000      -1.218200    
 H   0.5641000       1.061300       1.474600    
 H    1.284100     -0.4440000      -1.092100    
 H   -1.084000      -1.635900      -1.054000    
 H   -1.622200      -2.388300      0.4415000    
 H   -1.533100       2.974900     -0.5900000    
 H   -1.570000       2.587400       1.133200    
 H   -3.776500       1.984900      0.8778000    
 H   -3.669700       2.143400     -0.8687000    
 H   0.4771000      -1.725600       1.556800    
 H   0.8209000      -2.535200      4.1700002E-02
 H    2.687300     -0.4609000       1.630900    
 H   0.8921000       3.074500      6.3900001E-02
 H    1.381000       2.062600      -1.294000    
 H   -3.074500      -1.360700      -1.717000    
 H   -2.948900      0.2969000      -2.327800    
 H  -0.8370000     -0.2365000       2.507000    
 H   -2.307800      0.7128000       2.400400    
 H   -2.390500      -1.047000       2.383900    
 H    2.767600       2.320300       1.421400    
 H    3.344100       2.945300     -0.1182000    
 H   -5.290100      -1.083600      -2.308500    
 H   -5.322100      0.6563000      -1.859800    
 H    3.197900      -1.900200      -1.011400    
 H    3.012400      -2.604400      0.5947000    
 H    5.364200      -2.599400     -0.1754000    
 H    5.177400      -1.648500       1.313800    
 H    5.252900       1.680200     -0.6716000    


%chk=000168943-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168943

0 1
O -4.236030 -0.508185 0.645541
O -6.371646 -1.324683 0.232238
O 6.758726 -0.572130 -0.907922
C -1.734075 -0.192289 0.465040
C -0.886938 0.986321 -0.116599
C -3.134422 0.166211 -0.139506
C 0.572143 0.985463 0.382429
C 1.243234 -0.372218 0.003827
C -1.078746 -1.525078 0.031172
C -1.761712 2.244733 0.132803
C -3.233945 1.719983 0.043414
C 0.405742 -1.591708 0.481232
C 2.723957 -0.455844 0.515717
C 1.388590 2.160172 -0.198636
C -3.427491 -0.283340 -1.602045
C -1.849920 -0.147613 2.016326
C 2.845727 2.130204 0.322519
C 3.520475 0.787463 0.115465
C -4.964527 -0.419699 -1.635275
C 3.413914 -1.758998 0.030731
C -5.325308 -0.815994 -0.199555
C 4.941866 -1.750706 0.243751
C 4.803019 0.715749 -0.366721
C 5.591013 -0.532773 -0.411866
H -0.838435 0.827686 -1.218908
H 0.573790 1.087821 1.489949
H 1.283374 -0.406302 -1.109833
H -1.098429 -1.617969 -1.073206
H -1.635548 -2.389263 0.442764
H -1.561429 3.042732 -0.603119
H -1.555537 2.667868 1.133930
H -3.797810 1.936631 0.967074
H -3.788719 2.184328 -0.791853
H 0.468824 -1.669832 1.584966
H 0.843865 -2.523847 0.079827
H 2.676435 -0.470914 1.630789
H 0.921823 3.125160 0.075260
H 1.385856 2.098902 -1.306478
H -2.971096 -1.266731 -1.805264
H -3.039156 0.439155 -2.337987
H -0.867118 -0.251084 2.505190
H -2.304843 0.791086 2.375364
H -2.495690 -0.972467 2.360712
H 2.819814 2.337642 1.415122
H 3.448058 2.934539 -0.137634
H -5.341993 -1.172039 -2.344853
H -5.467858 0.538190 -1.865476
H 3.201962 -1.886519 -1.050762
H 2.978380 -2.632102 0.548852
H 5.416263 -2.665438 -0.152271
H 5.172191 -1.709183 1.329234
H 5.328382 1.623808 -0.690568


