%chk=000086743.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086743

0 1
 O    5.386400     -0.9680000      0.2219000    
 O    3.353900      -2.013000      0.1742000    
 O    7.044800      0.6050000      0.1218000    
 C    2.293400      0.7605000      0.2324000    
 C    3.561000      0.3172000     -0.4761000    
 C    1.053300      0.1060000     -0.3763000    
 C  -0.2248000      0.5813000      0.3187000    
 C   -1.467200     -4.5899998E-02 -0.3175000    
 C   -2.781000      0.4509000      0.2932000    
 C   -4.023400     -0.1956000     -0.3259000    
 C    4.735700       1.233800     -0.2012000    
 C   -5.303200      0.3293000      0.3308000    
 C    4.041600      -1.016100      1.6500000E-02
 C   -6.579600     -0.3056000     -0.2284000    
 C    5.866900      0.2920000      4.4799998E-02
 C   -7.861100      0.2704000      0.3748000    
 C   -9.096800     -0.4023000     -0.2037000    
 H    2.187000       1.849200      0.1443000    
 H    2.345300      0.5280000       1.303600    
 H    3.411200      0.2408000      -1.560000    
 H    1.114500     -0.9846000     -0.3009000    
 H   0.9978000      0.3513000      -1.444200    
 H  -0.1872000      0.3226000       1.383700    
 H  -0.2945000       1.673800      0.2527000    
 H   -1.412800      -1.136900     -0.2151000    
 H   -1.473200      0.1708000      -1.393100    
 H   -2.841700       1.539800      0.1738000    
 H   -2.769700      0.2510000       1.371900    
 H   -4.049500      1.1600000E-02  -1.402200    
 H   -3.969100      -1.284100     -0.2059000    
 H    4.592200       1.849300      0.6922000    
 H    4.950500       1.869500      -1.064500    
 H   -5.355400       1.416900      0.1953000    
 H   -5.259500      0.1470000       1.411700    
 H   -6.547200      -1.387600     -5.0000001E-02
 H   -6.601000     -0.1656000      -1.316400    
 H   -7.851900      0.1358000       1.462500    
 H   -7.911200       1.348000      0.1809000    
 H   -9.150100     -0.2596000      -1.287700    
 H   -9.090900      -1.477500      2.0000001E-03
 H   -10.00230      2.3300000E-02  0.2400000    


%chk=000086743-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086743

0 1
O 5.490083 -1.100853 0.232066
O 3.392767 -2.098460 0.032242
O 7.239955 0.444646 0.319430
C 2.333637 0.821616 0.153726
C 3.667733 0.348798 -0.482562
C 1.075792 0.126517 -0.413392
C -0.227389 0.650585 0.230069
C -1.495521 -0.018799 -0.345860
C -2.803351 0.496898 0.295276
C -4.071601 -0.169837 -0.283567
C 4.900520 1.212150 -0.129847
C -5.381052 0.349554 0.351764
C 4.070757 -1.073570 -0.063991
C -6.649776 -0.315147 -0.228671
C 6.038539 0.234368 0.147567
C -7.959677 0.208356 0.403648
C -9.222089 -0.460837 -0.181682
H 2.251397 1.913844 -0.019953
H 2.380615 0.678348 1.252102
H 3.531669 0.316242 -1.583066
H 1.154289 -0.965767 -0.260462
H 1.033352 0.291544 -1.510877
H -0.190730 0.479090 1.326130
H -0.296987 1.749909 0.087950
H -1.425671 -1.117155 -0.203873
H -1.533615 0.150915 -1.442322
H -2.871751 1.596366 0.155806
H -2.767313 0.324573 1.391365
H -4.105310 -0.001831 -1.380520
H -4.005994 -1.268703 -0.140176
H 4.729276 1.806405 0.787582
H 5.200343 1.917141 -0.921586
H -5.446111 1.448860 0.209387
H -5.348764 0.180325 1.448576
H -6.588517 -1.414174 -0.083473
H -6.682265 -0.148933 -1.325981
H -7.926266 0.042023 1.499888
H -8.020169 1.306404 0.258186
H -9.294199 -0.285566 -1.271805
H -9.201453 -1.555257 -0.019894
H -10.143954 -0.067888 0.285399


