%chk=000155287.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155287

0 1
 O   -2.988300      -2.069600      0.2472000    
 O  -0.2637000      -6.037500      0.2430000    
 O   0.2821000      0.9338000       4.594500    
 O    1.584200       3.535000      0.8097000    
 O   -5.035400       3.549500     -2.0099999E-02
 O   -5.977400       2.760700      -2.512800    
 O    5.441200       1.897900      0.8037000    
 O    6.813300       2.027300      -1.610000    
 C   -1.115300     -0.5005000      0.1175000    
 C   -2.615500     -0.6813000      0.4760000    
 C  -0.6817000      -1.926000      0.1921000    
 C   -1.797500      -2.748600      0.2426000    
 C  -0.3924000      0.4641000       1.029100    
 C   -3.513400      0.2405000     -0.3201000    
 C   0.5921000      -2.468900      0.1434000    
 C   -1.691900      -4.126500      0.2565000    
 C   0.2708000       1.567500      0.4923000    
 C  -0.3885000      0.2512000       2.407800    
 C   0.7228000      -3.859700      0.1697000    
 C   -3.868000       1.485600      0.1981000    
 C  -0.4127000      -4.683400      0.2261000    
 C   -3.985800     -0.1561000      -1.570700    
 C    1.786700      -1.646200      3.9900001E-02
 C   0.2787000       1.141400       3.249400    
 C   0.9378000       2.457900       1.333700    
 C   -4.696200       2.335200     -0.5355000    
 C   -4.814000      0.6933000      -2.304100    
 C   0.9418000       2.244800       2.712200    
 C   -5.169100       1.939000      -1.786600    
 C    2.270200      -1.221900      -1.127000    
 C    3.464700     -0.3665000      -1.250300    
 C    3.889700      0.3662000     -0.1545000    
 C    4.137000     -0.3126000      -2.460100    
 C    5.019400       1.176100     -0.2719000    
 C    5.266500      0.4971000      -2.577400    
 C    5.707800       1.241300      -1.483400    
 H   -1.010100     -0.1828000     -0.9293000    
 H   -2.817600     -0.5116000       1.542200    
 H   -2.579400      -4.749600      0.2906000    
 H   0.2688000       1.735500     -0.5819000    
 H  -0.8915000     -0.6084000       2.843500    
 H    1.708400      -4.320700      0.1359000    
 H   -3.497500       1.794000       1.172700    
 H   -3.713600      -1.117000      -1.998500    
 H    2.259300      -1.436300      0.9938000    
 H   -5.177000      0.3801000      -3.279200    
 H    1.464000       2.942700       3.362100    
 H    1.774600      -1.491900      -2.056800    
 H   -1.143500      -6.450500      0.2812000    
 H   0.7899000       1.644800       5.021800    
 H    1.485700       3.522000     -0.1579000    
 H   -4.616400       3.652300      0.8517000    
 H   -6.118900       3.578000      -2.004200    
 H    3.366200      0.3548000      0.7962000    
 H    3.805800     -0.8877000      -3.320700    
 H    5.798800      0.5434000      -3.523600    
 H    4.843600       1.732400       1.552900    
 H    6.974000       2.468600     -0.7577000    


%chk=000155287-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155287

0 1
O -3.120259 -1.981435 0.346997
O -0.408299 -6.058413 -0.234490
O 0.861484 0.877833 4.286318
O 1.936437 3.450607 0.293712
O -5.993562 3.312386 0.615580
O -6.543146 2.934096 -2.000005
O 4.650256 2.806424 -0.202029
O 7.080401 2.064369 -1.116166
C -1.259711 -0.401394 0.001157
C -2.735929 -0.532957 0.548433
C -0.797284 -1.866686 -0.029281
C -1.924850 -2.694826 0.145749
C -0.410471 0.562790 0.830194
C -3.755051 0.360947 -0.117486
C 0.476539 -2.447855 -0.302072
C -1.870095 -4.095879 0.091070
C 0.236844 1.653397 0.190995
C -0.182316 0.329527 2.204142
C 0.555612 -3.870399 -0.352134
C -4.383893 1.392293 0.623876
C -0.593141 -4.664858 -0.161621
C -4.077686 0.198780 -1.488342
C 1.631318 -1.568405 -0.504120
C 0.695869 1.168784 2.926586
C 1.140520 2.449466 0.924890
C -5.303810 2.246232 -0.008773
C -5.008364 1.051294 -2.117985
C 1.380355 2.234297 2.294260
C -5.622961 2.083941 -1.382647
C 2.945195 -1.877958 -0.751100
C 4.012033 -0.866788 -0.843124
C 3.776996 0.489452 -0.460406
C 5.314162 -1.211789 -1.302281
C 4.785457 1.452830 -0.560244
C 6.338778 -0.243123 -1.398406
C 6.081508 1.092027 -1.033443
H -1.303032 -0.010184 -1.035845
H -2.736793 -0.365477 1.642703
H -2.768862 -4.704352 0.235865
H 0.079927 1.827876 -0.881189
H -0.628365 -0.526893 2.718815
H 1.506196 -4.376119 -0.540287
H -4.150978 1.520835 1.689494
H -3.620705 -0.617779 -2.057342
H 1.387778 -0.506204 -0.426251
H -5.275781 0.930042 -3.171633
H 2.088625 2.875822 2.829873
H 3.255199 -2.923782 -0.886442
H -1.262557 -6.535087 -0.089121
H 1.537430 1.467227 4.704143
H 1.535050 3.734207 -0.564862
H -5.776866 3.385175 1.575345
H -6.878309 3.585425 -1.328527
H 2.806822 0.779718 -0.050811
H 5.524996 -2.246793 -1.595121
H 7.339450 -0.506228 -1.753487
H 3.713147 3.048661 0.068094
H 6.692296 2.927103 -0.806421


