%chk=000159971.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159971

0 1
 O   -1.442700       1.361900      4.1900001E-02
 O    1.026200       2.489200     -0.7405000    
 O   -3.699700       1.809600      3.3100002E-02
 C   0.7335000      0.1311000     -0.2630000    
 C    1.394600      -1.251200      9.2600003E-02
 C  -0.6783000      0.1940000      0.3406000    
 C   -1.532600     -0.9091000     -0.2548000    
 C    1.625400       1.382900     -3.8400002E-02
 C   0.4584000      -2.401200     -0.4091000    
 C    2.756100      -1.346300     -0.6369000    
 C  -0.9925000      -2.283000      9.7400002E-02
 C    2.997300       1.173900     -0.7078000    
 C   -2.900100     -0.4946000      0.2518000    
 C    3.669500     -0.1499000     -0.3593000    
 C    1.627600      -1.491000       1.604400    
 C    1.775600       1.846400       1.412800    
 C   -2.776600       1.012800      9.5700003E-02
 C   -4.041900      -1.075500     -0.5605000    
 H   0.5747000      0.1172000      -1.354900    
 H  -0.6252000      0.1280000       1.434000    
 H   -1.535000     -0.8140000      -1.352600    
 H   0.8627000      -3.378900     -0.1183000    
 H   0.4384000      -2.396000      -1.507400    
 H    2.588400      -1.406900      -1.720500    
 H    3.275800      -2.270700     -0.3552000    
 H   -1.605300      -3.061800     -0.3702000    
 H   -1.035700      -2.453400       1.178700    
 H    3.669000       2.006100     -0.4605000    
 H    2.881100       1.221900      -1.799800    
 H   -3.024200     -0.7235000       1.316500    
 H    3.991700     -0.1432000      0.6869000    
 H    4.583200     -0.2543000     -0.9567000    
 H    2.408800     -0.8591000       2.024800    
 H   0.7268000      -1.340900       2.204200    
 H    1.955300      -2.523300       1.780100    
 H    2.263400       2.828700       1.447300    
 H   0.7998000       1.985800       1.889000    
 H    2.370700       1.173200       2.027600    
 H   0.9089000       2.236700      -1.672000    
 H   -5.004500     -0.7121000     -0.1847000    
 H   -3.975500     -0.7849000      -1.614700    
 H   -4.046800      -2.168500     -0.5046000    


%chk=000159971-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159971

0 1
O -1.385058 1.402431 0.049762
O 1.054065 2.458357 -0.925233
O -3.654385 1.921841 -0.067849
C 0.788646 0.092850 -0.303946
C 1.436717 -1.295774 0.104321
C -0.607962 0.134109 0.316020
C -1.521283 -0.960321 -0.262938
C 1.662706 1.376495 -0.105227
C 0.493945 -2.442159 -0.403378
C 2.807972 -1.394182 -0.627687
C -0.972609 -2.347332 0.109378
C 3.043916 1.150458 -0.763725
C -2.920158 -0.476468 0.182976
C 3.724058 -0.176137 -0.355166
C 1.666315 -1.496334 1.630839
C 1.771369 1.887710 1.348721
C -2.772964 1.059994 0.047743
C -4.128996 -1.013878 -0.600204
H 0.649990 0.044737 -1.406681
H -0.557552 0.052451 1.419266
H -1.480767 -0.863971 -1.370249
H 0.930479 -3.417747 -0.112083
H 0.476151 -2.419596 -1.513075
H 2.626413 -1.462724 -1.720952
H 3.317853 -2.331739 -0.327118
H -1.580309 -3.147338 -0.354170
H -1.019471 -2.503406 1.205486
H 3.695093 2.014511 -0.534120
H 2.879005 1.158649 -1.858833
H -3.057422 -0.687678 1.266504
H 4.017844 -0.147969 0.712584
H 4.664660 -0.290928 -0.927113
H 2.432897 -0.815602 2.033151
H 0.753009 -1.355388 2.235028
H 2.018747 -2.529977 1.808793
H 2.250426 2.882075 1.328578
H 0.774371 2.005362 1.810905
H 2.375780 1.227505 1.993938
H 0.102531 2.555949 -0.645813
H -5.050431 -0.484815 -0.302262
H -3.991328 -0.864685 -1.686330
H -4.267966 -2.093236 -0.412844


