%chk=000157159.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157159

1 1
 O   -4.569300       1.285900      0.3423000    
 O    4.781900      -1.915100      0.4865000    
 O    5.955500      0.5269000     -0.1221000    
 O   -5.973700      -1.053500      3.3799998E-02
 N  -0.3783000       1.249500      0.2689000    
 C   0.3293000       2.538600      0.4771000    
 C    1.536800       2.615800     -0.4375000    
 C   0.3115000      8.2400002E-02  0.1108000    
 C    1.783800      0.1790000      8.5100003E-02
 C    2.404100       1.414100     -0.1941000    
 C   -1.731100       1.263000      0.2958000    
 C  -0.4072000      -1.114500     -5.0700001E-02
 C   -2.481900      9.8399997E-02  0.1450000    
 C   -1.805700      -1.118100     -3.4100000E-02
 C    2.619700     -0.9278000      0.3186000    
 C    3.799700       1.521100     -0.2754000    
 C    4.011900     -0.8151000      0.2536000    
 C   -3.886200      0.1150000      0.1680000    
 C    4.601300      0.4070000     -4.8799999E-02
 C   -2.548300      -2.301000     -0.1922000    
 C   -4.611600      -1.066100      1.1700000E-02
 C   -3.943100      -2.273300     -0.1688000    
 C   -4.909400       2.013700     -0.8337000    
 C    5.110200      -2.726000     -0.6397000    
 H   0.6029000       2.568200       1.538800    
 H  -0.3543000       3.366200      0.2618000    
 H    2.085000       3.542400     -0.2345000    
 H    1.228800       2.624600      -1.489700    
 H   -2.186400       2.234400      0.4528000    
 H   0.1184000      -2.054100     -0.2059000    
 H    2.198100      -1.900100      0.5641000    
 H    4.253200       2.481300     -0.5101000    
 H   -2.044600      -3.254900     -0.3334000    
 H   -4.493800      -3.202000     -0.2923000    
 H    6.181300       1.446900     -0.3425000    
 H   -6.301500      -1.960700     -9.0700001E-02
 H   -4.017900       2.252700      -1.422000    
 H   -5.386900       2.949700     -0.5307000    
 H   -5.616900       1.444500      -1.444800    
 H    5.732300      -3.556300     -0.2944000    
 H    5.675200      -2.149400      -1.378800    
 H    4.202700      -3.134600      -1.095500    


%chk=000157159-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157159

1 1
O -4.425250 1.601387 0.049085
O 4.564039 -2.299389 0.361689
O 6.056228 0.165329 -0.196400
O -6.099167 -0.798488 -0.262279
N -0.354518 1.297521 0.045261
C 0.435302 2.554113 0.286870
C 1.675677 2.587340 -0.615664
C 0.346123 0.077892 -0.106518
C 1.818187 0.114147 -0.104141
C 2.501402 1.336410 -0.375361
C -1.713952 1.360338 0.034663
C -0.421587 -1.082931 -0.272841
C -2.514643 0.210472 -0.120050
C -1.844785 -1.068838 -0.276754
C 2.574941 -1.065140 0.114897
C 3.905809 1.339862 -0.420854
C 3.984759 -1.073220 0.071077
C -3.955731 0.314732 -0.121960
C 4.659869 0.163374 -0.197762
C -2.639133 -2.239986 -0.442274
C -4.703580 -0.876765 -0.277158
C -4.030689 -2.128476 -0.439116
C -5.864062 1.968851 -0.041071
C 5.959643 -2.628317 -0.017799
H 0.736400 2.557177 1.351050
H -0.231352 3.411023 0.100921
H 2.255099 3.497713 -0.383580
H 1.366799 2.662200 -1.677359
H -2.174691 2.342062 0.158495
H 0.096191 -2.031817 -0.429168
H 2.100630 -2.019959 0.358231
H 4.434942 2.280818 -0.621879
H -2.162233 -3.215872 -0.567765
H -4.641734 -3.032302 -0.561310
H 6.424022 1.064881 -0.383878
H -6.521696 -1.685693 -0.377154
H -6.269778 1.694705 -1.026989
H -5.862668 3.060098 0.091494
H -6.439092 1.475789 0.755954
H 6.036938 -3.707717 0.177673
H 6.677538 -2.067206 0.598245
H 6.135303 -2.417418 -1.086218


