%chk=000118870.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118870

0 1
 O   0.8475000       1.689600     -0.1484000    
 O   -3.357800       1.041400      1.8900000E-02
 O   -1.261900       2.553600     -4.3200001E-02
 N    5.334100     -7.8900002E-02 -0.3213000    
 N   -3.082400      -1.208200      6.8999999E-03
 C    3.940500     -0.2883000     -0.2633000    
 C    6.245000      -1.206000     -0.3498000    
 C    5.872900       1.265900     -0.3672000    
 C    1.174600     -0.7172000     -0.1469000    
 C    1.699700      0.5696000     -0.1773000    
 C    3.072500      0.8009000     -0.2353000    
 C    3.431500      -1.588400     -0.2330000    
 C    2.051600      -1.804400     -0.1752000    
 C  -0.2683000     -0.8861000     -8.9599997E-02
 C   -1.083200      0.1793000     -6.0600001E-02
 C    6.482300      -1.755500       1.046600    
 C    6.099600       1.814500       1.031300    
 C   -2.498400     -2.3000000E-02 -1.2200000E-02
 C  -0.5381000       1.563800     -8.3800003E-02
 C   -4.595200      0.4657000      6.2600002E-02
 C   -4.422800     -0.9106000      5.4900002E-02
 C   -5.825800       1.109100      0.1069000    
 C   -5.555700      -1.735900      9.3999997E-02
 C   -6.945900      0.2717000      0.1456000    
 C   -6.816200      -1.122600      0.1394000    
 H    5.919400      -1.990500      -1.042300    
 H    7.217900     -0.8900000     -0.7481000    
 H    6.846500       1.252500     -0.8749000    
 H    5.279100       1.952100     -0.9801000    
 H    3.400400       1.833700     -0.2375000    
 H    4.053600      -2.476500     -0.2514000    
 H    1.675100      -2.824200     -0.1529000    
 H  -0.6419000      -1.905800     -7.4500002E-02
 H    6.962200      -1.014100       1.691600    
 H    5.558700      -2.070600       1.540100    
 H    7.146800      -2.624300      0.9963000    
 H    5.180100       1.813000       1.624700    
 H    6.850100       1.232700       1.573500    
 H    6.462600       2.845800      0.9742000    
 H   -5.915200       2.188200      0.1111000    
 H   -5.467000      -2.817200      8.9599997E-02
 H   -7.938900      0.7135000      0.1812000    
 H   -7.709100      -1.742200      0.1702000    


%chk=000118870-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000118870

0 1
O 0.911653 1.705760 -0.156641
O -3.448020 1.120548 0.018813
O -1.149215 2.716754 -0.080505
N 5.398127 -0.109082 -0.352903
N -3.135003 -1.180639 0.001183
C 4.021821 -0.303343 -0.268254
C 6.338351 -1.254172 -0.356396
C 5.974625 1.256606 -0.344275
C 1.166666 -0.730047 -0.160254
C 1.737382 0.582398 -0.184883
C 3.118189 0.805285 -0.232023
C 3.456236 -1.634709 -0.232070
C 2.077358 -1.829809 -0.185052
C -0.250826 -0.852548 -0.105416
C -1.101470 0.259013 -0.075976
C 6.630508 -1.846053 1.043413
C 6.060760 1.904873 1.058388
C -2.536860 0.015371 -0.020070
C -0.559271 1.625202 -0.100171
C -4.717839 0.505369 0.068230
C -4.521113 -0.906557 0.057261
C -5.973878 1.119474 0.119650
C -5.637432 -1.770151 0.099569
C -7.083961 0.241336 0.161810
C -6.916994 -1.174064 0.151794
H 5.950922 -2.042638 -1.028428
H 7.282784 -0.902257 -0.808975
H 6.987328 1.190423 -0.780840
H 5.386067 1.901539 -1.023657
H 3.461214 1.841045 -0.239222
H 4.108940 -2.510138 -0.240259
H 1.674832 -2.849084 -0.162188
H -0.716443 -1.844529 -0.084763
H 7.102263 -1.095754 1.701292
H 5.704641 -2.193087 1.533887
H 7.318505 -2.707089 0.955639
H 5.067751 1.962628 1.535834
H 6.726536 1.328266 1.723894
H 6.461891 2.931717 0.976411
H -6.088837 2.206262 0.126601
H -5.506988 -2.855934 0.091756
H -8.094695 0.661011 0.203045
H -7.806006 -1.813093 0.185553


