%chk=000085372.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085372

0 1
 O   -2.025000      -2.091700     -0.4068000    
 C   0.7497000      0.3284000     -4.3200001E-02
 C   4.1999999E-02 -0.8886000     -0.1992000    
 C  -2.9700000E-02   1.509800      5.1899999E-02
 C   -1.436700       1.504900     -2.4999999E-03
 C    2.189500      0.3023000      9.1000004E-03
 C   -2.112300      0.2810000     -0.1579000    
 C   -1.362700     -0.8990000     -0.2541000    
 C    2.864200     -0.9420000     -9.6799999E-02
 C   0.7415000      -2.094300     -0.3001000    
 C    2.131100      -2.120900     -0.2496000    
 C   0.5634000       2.879400      0.2197000    
 C   -2.183000       2.692000      9.4599999E-02
 C   -3.516600      0.2690000     -0.2130000    
 C    3.002500       1.453600      0.1620000    
 C    4.267400      -1.002400     -4.9500000E-02
 C   -3.576700       2.666600      3.8600001E-02
 C   -4.243300       1.455500     -0.1152000    
 C    4.397400       1.380000      0.2076000    
 C    5.030100      0.1513000      0.1018000    
 C   -2.381900      -2.780000      0.7847000    
 C   -3.111100      -4.054900      0.4181000    
 H   0.2322000      -3.046200     -0.4325000    
 H    2.635300      -3.081900     -0.3347000    
 H    1.095500       2.924000       1.176700    
 H    1.165300       3.119400     -0.6640000    
 H  -6.0699999E-02   3.762100      0.2901000    
 H   -1.801700       3.694300      0.2150000    
 H   -4.073800     -0.6559000     -0.3420000    
 H    2.696900       2.473900      0.2580000    
 H    4.783100      -1.957600     -0.1309000    
 H   -4.142900       3.590600      0.1142000    
 H   -5.328100       1.433600     -0.1613000    
 H    4.987700       2.284600      0.3258000    
 H    6.113500      8.8799998E-02  0.1366000    
 H   -1.486200      -3.025800       1.366200    
 H   -3.032300      -2.153900       1.406100    
 H   -3.401400      -4.611000       1.313800    
 H   -4.010200      -3.830400     -0.1654000    
 H   -2.478100      -4.695000     -0.2055000    


%chk=000085372-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085372

0 1
O -1.981425 -2.173215 -0.436622
C 0.776795 0.384151 0.013169
C 0.079596 -0.891390 -0.154079
C 0.001135 1.560805 0.247225
C -1.428720 1.519102 0.054865
C 2.256876 0.348545 -0.043079
C -2.103481 0.268078 -0.244423
C -1.328497 -0.924687 -0.264035
C 2.941542 -0.922534 0.028205
C 0.816904 -2.138866 -0.144577
C 2.183248 -2.157063 0.007405
C 0.595132 2.851006 0.800932
C -2.245837 2.704170 0.127264
C -3.520813 0.248384 -0.477144
C 3.071328 1.504345 -0.259132
C 4.367063 -0.973898 0.026990
C -3.622551 2.659719 -0.094914
C -4.270192 1.419893 -0.403983
C 4.474988 1.433613 -0.284970
C 5.136130 0.190401 -0.106270
C -2.528035 -2.761389 0.820099
C -3.238638 -4.056494 0.437690
H 0.243570 -3.062518 -0.263227
H 2.731197 -3.105837 0.046913
H 1.534156 2.661313 1.342630
H 0.801040 3.611008 0.020758
H -0.105721 3.309545 1.519719
H -1.776057 3.671159 0.327625
H -3.985920 -0.706447 -0.741558
H 2.603897 2.467887 -0.463399
H 4.855394 -1.952949 0.102972
H -4.212569 3.581916 -0.048668
H -5.348731 1.401286 -0.594846
H 5.058288 2.344535 -0.459279
H 6.230238 0.138743 -0.109773
H -1.688122 -2.946363 1.520798
H -3.222169 -2.035783 1.290026
H -3.654383 -4.544437 1.338192
H -4.065481 -3.855242 -0.265246
H -2.537279 -4.756890 -0.047854


