%chk=000031241.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031241

0 1
 O    1.325200       2.159800      0.1218000    
 C   0.9440000     -0.2489000      0.1782000    
 C  -0.4139000     -0.8832000     -0.1616000    
 C   -1.593400      1.3500000E-02  0.2354000    
 C    2.127800      -1.163200     -0.1834000    
 C   -2.926200     -0.6094000     -0.1812000    
 C    1.149600       1.106000     -0.4807000    
 C    3.484200     -0.6709000      0.3064000    
 C   -4.097300      0.2961000      0.1651000    
 H   0.9693000     -7.5700000E-02   1.262800    
 H  -0.5049000      -1.850900      0.3466000    
 H  -0.4604000      -1.079800      -1.240300    
 H   -1.582300      0.1771000       1.319800    
 H   -1.498400      0.9959000     -0.2415000    
 H    2.175800      -1.293400      -1.271900    
 H    1.952700      -2.157900      0.2449000    
 H   -3.056600      -1.576500      0.3181000    
 H   -2.928300     -0.7985000      -1.261000    
 H    1.134100       1.095800      -1.585100    
 H    3.478900     -0.5295000       1.391700    
 H    4.260800      -1.403000      6.3000001E-02
 H    3.759900      0.2777000     -0.1642000    
 H   -4.142600      0.4835000       1.242600    
 H   -4.014100       1.259400     -0.3484000    
 H   -5.039700     -0.1702000     -0.1387000    


%chk=000031241-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000031241

0 1
O 1.417897 2.222657 -0.011308
C 0.979462 -0.206872 0.198729
C -0.393012 -0.809949 -0.220537
C -1.611406 0.042956 0.200198
C 2.146003 -1.181481 -0.152226
C -2.959215 -0.600637 -0.197147
C 1.198953 1.105793 -0.537605
C 3.525135 -0.713325 0.360293
C -4.176574 0.249215 0.226370
H 0.984556 -0.000622 1.286707
H -0.478585 -1.820109 0.229571
H -0.406000 -0.959434 -1.321358
H -1.588280 0.200461 1.298296
H -1.542575 1.052402 -0.255324
H 2.179899 -1.324039 -1.252536
H 1.903274 -2.172030 0.280984
H -3.032151 -1.608669 0.260645
H -2.979232 -0.756163 -1.295483
H 1.158306 0.998815 -1.658022
H 3.514040 -0.576469 1.457403
H 4.308003 -1.454834 0.118019
H 3.822281 0.251592 -0.089442
H -4.195763 0.394632 1.322950
H -4.142904 1.250630 -0.242699
H -5.127912 -0.230721 -0.068077


