%chk=000096146.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096146

0 1
 O    1.099000       2.768300      0.8859000    
 O   -1.134500       2.796400     -0.8845000    
 N    2.756600      0.6615000      4.9899999E-02
 N   -2.751900      0.6688000     -4.0199999E-02
 N    1.441800      0.7707000     -0.2503000    
 N   -1.435700      0.7675000      0.2507000    
 C    4.754100     -0.6754000     -0.2198000    
 C   -4.744600     -0.6816000      0.2170000    
 C    5.310800      -1.818800     -0.7691000    
 C   -5.291500      -1.839400      0.7456000    
 C    5.512600      0.2070000      0.5317000    
 C   -5.513300      0.2132000     -0.5091000    
 C    6.663900      -2.087200     -0.5610000    
 C   -6.644700      -2.110100      0.5422000    
 C    6.865500     -6.1200000E-02  0.7396000    
 C   -6.866600     -5.7300001E-02 -0.7123000    
 C    7.441100      -1.208400      0.1933000    
 C   -7.432200      -1.219100     -0.1866000    
 C    3.324800     -0.3920000     -0.4392000    
 C   -3.315000     -0.3958000      0.4314000    
 C   0.6995000       1.837800      0.2004000    
 C  -0.7397000       1.854900     -0.2155000    
 H    4.715700      -2.510700      -1.358300    
 H   -4.688300      -2.541000       1.314900    
 H    5.090300       1.107200      0.9686000    
 H   -5.098600       1.124700     -0.9294000    
 H    7.112200      -2.980300     -0.9863000    
 H   -7.085200      -3.014600      0.9515000    
 H    7.471200      0.6228000       1.327000    
 H   -7.480100      0.6363000      -1.279800    
 H    8.494600      -1.417200      0.3553000    
 H   -8.485800      -1.429700     -0.3450000    
 H    2.764400      -1.127800      -1.046000    
 H   -2.747400      -1.143000       1.017300    
 H    1.025300      4.1099999E-02 -0.8214000    
 H   -1.004600      3.4600001E-02  0.8060000    


%chk=000096146-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096146

0 1
O 0.663936 -0.366092 1.674664
O -0.659246 -0.335456 -1.675834
N 3.041550 -0.347349 0.036013
N -3.036874 -0.352780 -0.037652
N 1.743418 -0.343393 -0.442498
N -1.738936 -0.355026 0.440995
C 5.412348 -0.340896 -0.474961
C -5.407682 -0.358316 0.473443
C 6.413937 -0.331820 -1.485173
C -6.409197 -0.366689 1.483741
C 5.804979 -0.352716 0.895092
C -5.800461 -0.348023 -0.896586
C 7.781255 -0.334577 -1.136926
C -7.776551 -0.365180 1.135616
C 7.170049 -0.355448 1.236951
C -7.165565 -0.346659 -1.238325
C 8.163429 -0.346403 0.224571
C -8.158859 -0.355229 -0.225854
C 4.000164 -0.337870 -0.869833
C -3.995440 -0.360759 0.868223
C 0.657592 -0.352931 0.409127
C -0.652779 -0.346874 -0.410335
H 6.118340 -0.322634 -2.542091
H -6.113498 -0.374511 2.540637
H 5.026104 -0.359614 1.664244
H -5.021645 -0.341561 -1.665797
H 8.545334 -0.327586 -1.921834
H -8.540555 -0.371780 1.920604
H 7.467049 -0.364547 2.291490
H -7.462661 -0.338829 -2.292848
H 9.224766 -0.348526 0.496777
H -9.220220 -0.354081 -0.497973
H 3.785264 -0.328217 -1.958211
H -3.780366 -0.368746 1.956594
H 1.510935 -0.333389 -1.453861
H -1.506213 -0.363294 1.452311


