%chk=000139832.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139832

0 1
 O    1.645600      -1.470300     -0.1701000    
 O    3.460900      -2.504700      -1.113200    
 O   -3.466100     -0.4754000      0.6649000    
 O   -3.376400      -1.193400      -1.561300    
 C    2.698700      0.4384000      0.6830000    
 C    1.441500     -0.4201000      0.7919000    
 C    3.760400     -0.6272000      0.4146000    
 C    2.558000       1.495200     -0.4219000    
 C   0.1350000      0.2757000      0.5123000    
 C    1.355100       2.394900     -0.1515000    
 C   9.1100000E-02   1.602800      5.1399998E-02
 C    2.986100      -1.641200     -0.3919000    
 C    5.019200     -0.1532000     -0.2888000    
 C   -1.068000     -0.4204000      0.7116000    
 C   -1.149900       2.216600     -0.1750000    
 C   -2.295800      0.1950000      0.4701000    
 C   -2.336600       1.514100      2.9200001E-02
 C   -1.064800      -1.838200       1.197000    
 C   -1.251200       3.638100     -0.6295000    
 C   -3.927700      -1.162300     -0.4691000    
 C   -5.215200      -1.864400     -0.1539000    
 H    2.897200      0.9574000       1.629400    
 H    1.418000     -0.8706000       1.792300    
 H    4.032900      -1.114200       1.359900    
 H    2.441300       1.014800      -1.402300    
 H    3.460300       2.115600     -0.4732000    
 H    1.263000       3.075200      -1.005000    
 H    1.537200       3.001200      0.7442000    
 H    4.820100      0.1741000      -1.314700    
 H    5.486800      0.6710000      0.2588000    
 H    5.747500     -0.9692000     -0.3543000    
 H   -3.299100       1.987700     -0.1497000    
 H  -0.7289000      -2.511100      0.4017000    
 H  -0.4210000      -1.958600       2.073500    
 H   -2.051400      -2.185100       1.519700    
 H   -2.284200       4.002400     -0.6024000    
 H  -0.6687000       4.298100      2.1700000E-02
 H  -0.8971000       3.734800      -1.660800    
 H   -5.053600      -2.587200      0.6497000    
 H   -5.562800      -2.400600      -1.041500    
 H   -5.974100      -1.132400      0.1324000    


%chk=000139832-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000139832

0 1
O 1.869507 -1.525890 -0.288518
O 3.844411 -2.449874 -1.092031
O -3.409332 -0.794230 0.494702
O -4.595204 -0.113258 -1.425140
C 2.753336 0.484440 0.720160
C 1.511187 -0.439421 0.726718
C 3.908064 -0.541406 0.540628
C 2.639488 1.513877 -0.420142
C 0.178107 0.180421 0.368061
C 1.367220 2.365594 -0.249585
C 0.104029 1.529431 -0.076590
C 3.277360 -1.612426 -0.371143
C 5.259262 -0.035411 0.009804
C -0.996681 -0.615630 0.535259
C -1.169783 2.114618 -0.341107
C -2.236591 -0.004309 0.244909
C -2.334591 1.337788 -0.174122
C -0.923448 -2.055221 1.009599
C -1.297022 3.556792 -0.801131
C -4.525703 -0.786821 -0.380079
C -5.580636 -1.722428 0.167253
H 2.831893 1.015797 1.687623
H 1.437892 -0.973599 1.695105
H 4.077046 -1.042024 1.519573
H 2.601143 0.987703 -1.394351
H 3.528549 2.170287 -0.434764
H 1.254499 3.034833 -1.122533
H 1.487088 3.036434 0.628923
H 5.149935 0.460330 -0.969363
H 5.718625 0.679524 0.715503
H 5.948082 -0.886505 -0.127350
H -3.313993 1.773005 -0.384787
H -0.204463 -2.630611 0.402519
H -0.587015 -2.113465 2.063920
H -1.910409 -2.536801 0.952762
H -2.355936 3.855859 -0.871114
H -0.791605 4.256747 -0.109410
H -0.843674 3.708303 -1.800072
H -5.187634 -2.753428 0.206380
H -6.471987 -1.691109 -0.475349
H -5.847715 -1.434617 1.198479


