%chk=000157798.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157798

0 1
 O   5.0000002E-04  -2.496700      8.9999998E-04
 O    4.558500      0.3383000       1.260600    
 O   -4.556600      0.3392000      -1.260400    
 O    1.923000       1.752400      -1.539200    
 O   -1.920700       1.753800       1.538700    
 O    4.179800       1.540400      -1.190200    
 O   -4.177500       1.542300       1.189800    
 C    1.124000      -1.792700      0.3082000    
 C   -1.142400      -1.780200     -0.3121000    
 C    2.652500      1.8700000E-02 -0.1606000    
 C   -2.650800      1.9800000E-02  0.1610000    
 C    1.500200     -0.7017000     -0.4753000    
 C   -1.498800     -0.7009000      0.4762000    
 C    1.899900      -2.163200       1.406500    
 C   -1.898900      -2.163300      -1.404900    
 C    3.428400     -0.3517000      0.9377000    
 C   -3.426800     -0.3510000     -0.9370000    
 C    3.052100      -1.442700       1.721300    
 C   -3.050900      -1.442500      -1.720100    
 C    3.028100       1.154000     -0.9920000    
 C   -3.026000       1.155500      0.9919000    
 C    2.168200       2.885100      -2.380600    
 C   -2.165500       2.887100       2.379600    
 H   0.9151000     -0.4418000      -1.354300    
 H  -0.9118000     -0.4436000       1.353700    
 H    1.611600      -3.012000       2.020500    
 H   -1.607300      -3.012600      -2.015300    
 H    3.647100      -1.742800       2.579700    
 H   -3.645900      -1.743000      -2.578400    
 H    4.962100     -6.3900001E-02   2.048900    
 H   -4.960400     -6.3299999E-02  -2.048400    
 H    2.776800       2.591700      -3.241200    
 H    2.659200       3.679700      -1.811000    
 H    1.204700       3.254900      -2.741100    
 H   -1.201900       3.256600       2.740000    
 H   -2.774200       2.594400       3.240200    
 H   -2.656200       3.681600       1.809600    


%chk=000157798-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157798

0 1
O -0.000426 -2.415885 0.001491
O 4.946919 0.039352 1.139117
O -4.945444 0.042247 -1.139821
O 2.156018 1.770651 -1.624129
O -2.154409 1.773168 1.623564
O 4.200315 2.079575 -0.555808
O -4.198357 2.082604 0.554733
C 1.197625 -1.715816 0.298241
C -1.197769 -1.715162 -0.296310
C 2.818439 0.100461 -0.051326
C -2.817489 0.102435 0.051622
C 1.564185 -0.510659 -0.325427
C -1.563807 -0.509437 0.326596
C 2.079636 -2.354115 1.197684
C -2.079812 -2.353248 -1.195869
C 3.708644 -0.543910 0.861863
C -3.707721 -0.541753 -0.861682
C 3.327577 -1.768974 1.469473
C -3.327218 -1.767369 -1.468526
C 3.171939 1.385664 -0.721839
C -3.170404 1.388207 0.721365
C 2.403439 3.043118 -2.334960
C -2.401241 3.046186 2.333624
H 0.898368 -0.018338 -1.037318
H -0.897956 -0.017251 1.038553
H 1.779332 -3.296386 1.664364
H -1.779943 -3.295950 -1.661965
H 4.016057 -2.263705 2.166521
H -4.015712 -2.261949 -2.165669
H 5.451935 -0.519597 1.783435
H -5.450529 -0.516647 -1.784134
H 3.321769 2.971651 -2.942308
H 2.514609 3.871379 -1.614645
H 1.517983 3.186373 -2.970412
H -1.515897 3.189215 2.969283
H -3.319818 2.975650 2.940705
H -2.511635 3.874117 1.612812


