%chk=000171159.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171159

0 1
 O  -6.0699999E-02  -1.191800     -2.3000001E-03
 O    2.409900      0.4238000     -0.4081000    
 O   -1.852000      0.9314000     -0.3306000    
 O   -1.347400      -5.701300       1.013500    
 O    7.016700       1.343300      0.5778000    
 O   -5.691700       3.287900       1.325400    
 C   0.1712000     -0.1987000      -1.004000    
 C    1.061200      0.8795000     -0.3997000    
 C   -1.171000      0.3710000      -1.448400    
 C  -0.4512000      -2.425300     -0.5830000    
 C  -0.6894000      -3.457000      0.5086000    
 C    3.291400       1.400100      0.1276000    
 C   -3.089800       1.512400     -0.7146000    
 C    4.718800      0.8767000      0.1012000    
 C   -3.784900       2.098500      0.5044000    
 C   -1.130400      -4.795800     -5.9700001E-02
 C    5.708300       1.893100      0.6468000    
 C   -5.109100       2.752200      0.1454000    
 H   0.6898000     -0.6466000      -1.861900    
 H    1.003500       1.796900     -0.9971000    
 H   0.7628000       1.099500      0.6323000    
 H   -1.005600       1.150600      -2.202500    
 H   -1.805000     -0.3981000      -1.899900    
 H   -1.371700      -2.310300      -1.162800    
 H   0.3406000      -2.782300      -1.252700    
 H   0.2197000      -3.583700       1.110200    
 H   -1.440100      -3.084600       1.217400    
 H    2.999100       1.629000       1.159400    
 H    3.222300       2.318600     -0.4673000    
 H   -3.726700      0.7459000      -1.171900    
 H   -2.907500       2.302300      -1.452900    
 H    4.995400      0.5956000     -0.9231000    
 H    4.786100     -5.8499999E-02  0.6717000    
 H   -3.127200       2.826900      0.9958000    
 H   -3.942700       1.316600       1.258200    
 H   -2.064000      -4.693700     -0.6219000    
 H  -0.3617000      -5.213200     -0.7179000    
 H    5.485800       2.133200       1.691300    
 H    5.687300       2.814800      5.6800000E-02
 H   -5.801700       2.021600     -0.2846000    
 H   -4.961400       3.567500     -0.5700000    
 H   -1.627300      -6.546100      0.6217000    
 H    7.626400       2.012800      0.9322000    
 H   -6.534400       3.698200       1.066400    


%chk=000171159-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171159

0 1
O -0.206240 -1.219420 -0.089224
O 2.197196 0.528522 -0.586176
O -1.975415 1.252101 -0.498415
O -0.649188 -5.849940 1.173888
O 6.881482 0.949763 0.484560
O -5.497625 3.995490 1.321007
C -0.060865 -0.140805 -1.082935
C 0.798621 0.950486 -0.443180
C -1.430262 0.383627 -1.543256
C -0.245837 -2.560648 -0.681393
C -0.428591 -3.555780 0.469994
C 3.107117 1.310222 0.254600
C -3.341103 1.693635 -0.790931
C 4.527033 0.795670 -0.006675
C -3.781603 2.609197 0.356172
C -0.433913 -5.008389 -0.015582
C 5.571556 1.515250 0.851814
C -5.217547 3.111904 0.177099
H 0.482757 -0.524959 -1.974117
H 0.639592 1.927825 -0.947207
H 0.514354 1.053603 0.622739
H -1.317010 0.958569 -2.491993
H -2.114471 -0.473106 -1.734415
H -1.087555 -2.646864 -1.408397
H 0.703511 -2.754470 -1.230357
H 0.388677 -3.418034 1.200167
H -1.377796 -3.343043 0.993816
H 2.826965 1.185994 1.325703
H 3.025367 2.394069 0.004529
H -4.012713 0.807911 -0.875035
H -3.367528 2.235476 -1.765696
H 4.777768 0.932736 -1.074034
H 4.565002 -0.287960 0.205003
H -3.099357 3.476115 0.417310
H -3.703004 2.059576 1.311011
H -1.247555 -5.164545 -0.759143
H 0.535589 -5.254123 -0.502923
H 5.359933 1.352016 1.931753
H 5.546679 2.609960 0.652929
H -5.925942 2.254089 0.157631
H -5.315442 3.667285 -0.782487
H -0.632376 -6.804023 0.908943
H 7.588042 1.375368 1.032622
H -6.426601 4.332550 1.257484


