%chk=000073684.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073684

0 1
 O    4.133100     -0.9351000      0.9404000    
 O    5.819000      0.3324000     -0.2026000    
 N   -4.096600       1.186500      0.6602000    
 N    2.148200      0.7927000     -0.1919000    
 C   -2.347800      0.1529000     -0.2591000    
 C   -2.797600       1.371500      0.2498000    
 C   -1.028500      7.3700003E-02 -0.7524000    
 C  -0.2137000       1.210900     -0.7180000    
 C   -3.424900     -0.7824000     -0.1425000    
 C   -1.994800       2.517200      0.2910000    
 C   -4.501200     -0.1079000      0.4343000    
 C  -0.6919000       2.413800     -0.2036000    
 C    1.189900       1.162500      -1.232500    
 C  -0.4660000      -1.196100      -1.314500    
 C   -3.582500      -2.144100     -0.4759000    
 C   -2.475700       3.821800      0.8339000    
 C   -5.729600     -0.7259000      0.6954000    
 C    3.499200      0.7456000     -0.7290000    
 C    4.499000      0.3229000      0.3547000    
 C   -4.805000      -2.775600     -0.2209000    
 C   -5.861400      -2.075100      0.3561000    
 C    4.073000      -2.023400      2.8700000E-02
 C    6.809900     -4.9699999E-02  0.7424000    
 C    3.678000      -3.276000      0.7813000    
 C    8.168100     -1.3100000E-02  7.4800000E-02
 H   -4.681200       1.900000       1.072400    
 H  -4.5899998E-02   3.289700     -0.1811000    
 H    1.450100       2.158500      -1.618900    
 H    1.269000      0.5098000      -2.110100    
 H  -0.8386000      -2.062400     -0.7645000    
 H   0.6185000      -1.285700      -1.216300    
 H  -0.7362000      -1.295000      -2.370100    
 H   -2.795000      -2.723100     -0.9440000    
 H    2.108100       1.469100      0.5704000    
 H   -3.497100       3.767100       1.220300    
 H   -2.457600       4.584500      4.8200000E-02
 H   -1.829400       4.148400       1.655600    
 H   -6.553000     -0.1807000       1.144500    
 H    3.795400       1.733700      -1.105100    
 H    3.560000      7.2600000E-02  -1.592000    
 H    4.475600       1.064300       1.163400    
 H   -4.931700      -3.823300     -0.4806000    
 H   -6.803400      -2.583800      0.5448000    
 H    3.317700      -1.849900     -0.7423000    
 H    5.045100      -2.171300     -0.4528000    
 H    6.796500      0.6450000       1.589500    
 H    6.622400      -1.062400       1.113400    
 H    4.403200      -3.494700       1.572100    
 H    3.620700      -4.135900      0.1079000    
 H    2.706100      -3.143200       1.268100    
 H    8.381800      0.9894000     -0.3104000    
 H    8.195000     -0.6954000     -0.7813000    
 H    8.957100     -0.2967000      0.7770000    


%chk=000073684-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000073684

0 1
O 4.137798 -0.991514 1.025380
O 5.847070 0.162839 -0.249442
N -4.159949 1.208832 0.639902
N 2.177349 0.646468 -0.337538
C -2.301016 0.198602 -0.286170
C -2.829858 1.425321 0.240313
C -0.960335 0.142689 -0.762865
C -0.191510 1.339211 -0.705912
C -3.377183 -0.791730 -0.198918
C -2.079310 2.621046 0.313022
C -4.514645 -0.124478 0.384010
C -0.759356 2.537373 -0.177395
C 1.244925 1.396096 -1.211705
C -0.397515 -1.155423 -1.311122
C -3.505577 -2.159103 -0.552860
C -2.670058 3.900106 0.873799
C -5.740548 -0.780490 0.618957
C 3.593887 0.752909 -0.728166
C 4.534836 0.252125 0.383064
C -4.729155 -2.823738 -0.321632
C -5.834052 -2.142254 0.258954
C 3.846871 -2.113242 0.098998
C 6.952708 -0.014988 0.717639
C 3.647479 -3.358021 0.962434
C 8.245166 -0.137980 -0.087312
H -4.770425 1.911572 1.049074
H -0.135997 3.440929 -0.153288
H 1.545662 2.468508 -1.316576
H 1.318658 0.960230 -2.229586
H -0.519266 -1.973856 -0.576616
H 0.678246 -1.069028 -1.522865
H -0.927983 -1.461846 -2.234098
H -2.671237 -2.702018 -1.004981
H 2.011917 0.825462 0.660861
H -2.990064 3.777991 1.927953
H -3.555775 4.232066 0.295988
H -1.933929 4.720903 0.847037
H -6.594166 -0.257000 1.063825
H 3.906279 1.799222 -0.965267
H 3.773332 0.157152 -1.644823
H 4.566806 0.960188 1.240035
H -4.831618 -3.879846 -0.593860
H -6.773140 -2.681163 0.428031
H 2.930185 -1.866618 -0.471509
H 4.696134 -2.237928 -0.602314
H 6.984759 0.864077 1.398194
H 6.763288 -0.919279 1.328760
H 4.559926 -3.585440 1.541297
H 3.408489 -4.231216 0.327498
H 2.816824 -3.205745 1.673377
H 8.407581 0.763290 -0.703566
H 8.200766 -1.012031 -0.759954
H 9.110127 -0.260634 0.590134


