%chk=000022443.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022443

0 1
 O    3.820200      0.1688000      0.9029000    
 O    3.178500       1.277300     -0.8888000    
 N    3.038900      0.4048000     -2.5000000E-02
 C   -1.626700      0.3418000      9.2500001E-02
 C   -3.010300     -0.2990000      0.2191000    
 C  -0.5387000     -0.5676000      0.6670000    
 C   -4.101700      0.6228000     -0.3245000    
 C   0.8154000      7.8199998E-02  0.5692000    
 C   -5.481700      3.8000001E-03 -0.1704000    
 C    1.865200     -0.4059000     -0.1060000    
 C    2.041000      -1.624900     -0.9359000    
 H   -1.415400      0.5513000     -0.9638000    
 H   -1.621100       1.305300      0.6179000    
 H   -3.027100      -1.250900     -0.3255000    
 H   -3.213900     -0.5257000       1.272800    
 H  -0.7460000     -0.7645000       1.726000    
 H  -0.5659000      -1.536700      0.1596000    
 H   -3.917000      0.8337000      -1.384200    
 H   -4.078300       1.581800      0.2062000    
 H   0.9138000       1.011500       1.124000    
 H   -6.246400      0.6792000     -0.5667000    
 H   -5.710600     -0.1879000      0.8828000    
 H   -5.549700     -0.9434000     -0.7150000    
 H    2.810000      -2.277700     -0.5087000    
 H    1.122800      -2.212700      -1.013800    
 H    2.341800      -1.361800      -1.956100    


%chk=000022443-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000022443

0 1
O 3.152562 1.477643 0.769820
O 4.206269 0.032109 -0.642434
N 3.165052 0.427284 0.016755
C -1.645211 0.334892 0.124468
C -3.051084 -0.297345 0.227946
C -0.524855 -0.636005 0.599610
C -4.175851 0.651806 -0.245035
C 0.832969 0.011228 0.576467
C -5.578531 0.014422 -0.144331
C 1.926079 -0.402243 -0.124400
C 2.081997 -1.591518 -1.033393
H -1.446627 0.636226 -0.923115
H -1.609564 1.262241 0.731222
H -3.082550 -1.229420 -0.373948
H -3.243836 -0.598088 1.279124
H -0.753312 -0.934605 1.644916
H -0.552538 -1.558966 -0.007512
H -3.980574 0.955255 -1.293684
H -4.146293 1.581721 0.358474
H 0.954812 0.922244 1.179921
H -6.364203 0.712306 -0.486787
H -5.811486 -0.270592 0.899004
H -5.644698 -0.899398 -0.764460
H 2.852499 -2.284687 -0.652688
H 1.128205 -2.135023 -1.119516
H 2.407869 -1.279890 -2.040826


