%chk=000032848.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032848

0 1
 O    8.713400       1.896800      0.5057000    
 O   -5.661700      -1.163000       1.694600    
 N   -4.065500      -1.134600     -1.3400000E-02
 N    6.420400      0.3992000     -0.2694000    
 C   -1.272100      -1.620800     -0.5936000    
 C   -1.976000      -2.264800      0.6173000    
 C   -1.962700     -0.2976000     -0.9802000    
 C   -3.475200      -2.418400      0.3645000    
 C   -3.460600     -0.5069000      -1.195300    
 C   0.2150000      -1.437800     -0.3556000    
 C   0.6567000     -0.6071000      0.6721000    
 C    1.134300      -2.101600      -1.165000    
 C   -5.137900     -0.6238000      0.7210000    
 C    2.946500      -1.103000      8.2500003E-02
 C    4.408400     -0.9237000      0.3173000    
 C    4.983000      0.2504000     -0.4881000    
 C    2.024000     -0.4395000      0.8915000    
 C    2.501600      -1.934300     -0.9457000    
 C    6.971200       1.459500      -1.124800    
 C    6.705800      0.6920000       1.142100    
 C    8.468800       1.604000     -0.8705000    
 C    8.209700      0.8557000       1.343400    
 C   -5.695700      0.6738000      0.3206000    
 C   -6.732200      0.7255000     -0.6078000    
 C   -5.185900       1.846700      0.8717000    
 C   -7.262400       1.958400     -0.9880000    
 C   -5.716200       3.079500      0.4915000    
 C   -6.754500       3.135300     -0.4384000    
 H   -1.399600      -2.308900      -1.441900    
 H   -1.537300      -3.246600      0.8325000    
 H   -1.834100      -1.650300       1.515300    
 H   -1.822800      0.4542000     -0.1932000    
 H   -1.513600      0.1109000      -1.893600    
 H   -3.961500      -2.822700       1.258000    
 H   -3.658400      -3.121600     -0.4565000    
 H   -3.637000      -1.175600      -2.046200    
 H   -3.929900      0.4495000      -1.434300    
 H  -4.3699998E-02 -8.0200002E-02   1.313800    
 H   0.8036000      -2.752000      -1.970100    
 H    4.448500       1.176500     -0.2357000    
 H    4.797800      6.2399998E-02  -1.554000    
 H    4.940700      -1.850000      6.3100003E-02
 H    4.544100     -0.7898000       1.395700    
 H    2.357300      0.2129000       1.694400    
 H    3.210400      -2.455300      -1.583900    
 H    6.812800       1.217300      -2.181900    
 H    6.472200       2.414800     -0.9158000    
 H    6.191200       1.609300       1.456000    
 H    6.398300     -0.1213000       1.804200    
 H    9.017200      0.6977000      -1.155200    
 H    8.869100       2.432900      -1.463000    
 H    8.419200       1.134300       2.381200    
 H    8.750300     -7.5700000E-02   1.134600    
 H   -7.134600     -0.1858000      -1.042100    
 H   -4.376200       1.813700       1.596000    
 H   -8.070600       2.001800      -1.712200    
 H   -5.320400       3.996000      0.9190000    
 H   -7.167200       4.095300     -0.7345000    


%chk=000032848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000032848

0 1
O 9.026016 1.865113 0.325107
O -6.042043 -1.506224 1.122662
N -4.132744 -1.139224 -0.162543
N 6.490893 0.500372 -0.113072
C -1.269962 -1.663375 -0.605965
C -2.056576 -2.273712 0.589307
C -1.946145 -0.330428 -1.042856
C -3.556332 -2.435692 0.261203
C -3.448887 -0.539256 -1.329435
C 0.216372 -1.485694 -0.306324
C 0.661688 -0.681340 0.775870
C 1.199050 -2.121603 -1.105792
C -5.360257 -0.738990 0.365083
C 3.020849 -1.156248 0.241549
C 4.504364 -0.944141 0.502277
C 5.017876 0.353116 -0.178137
C 2.037466 -0.520706 1.043752
C 2.576678 -1.959357 -0.838441
C 6.983473 1.546727 -1.048072
C 7.000432 0.763815 1.258133
C 8.519387 1.591877 -1.030546
C 8.536861 0.827538 1.247630
C -5.862482 0.652761 0.060201
C -7.245942 0.815824 -0.206136
C -5.036905 1.802872 0.160993
C -7.787402 2.102663 -0.410266
C -5.582957 3.092475 -0.024100
C -6.956926 3.245349 -0.321766
H -1.363187 -2.371155 -1.457985
H -1.630766 -3.260288 0.853117
H -1.950516 -1.622965 1.478383
H -1.824611 0.426423 -0.243172
H -1.447971 0.064586 -1.948633
H -4.133587 -2.790842 1.129648
H -3.685099 -3.178760 -0.555759
H -3.558662 -1.232669 -2.193101
H -3.938582 0.406120 -1.605113
H -0.071144 -0.181169 1.421063
H 0.880487 -2.754605 -1.943837
H 4.488184 1.235296 0.266871
H 4.733244 0.316773 -1.247274
H 5.097434 -1.788728 0.105761
H 4.687374 -0.894417 1.592321
H 2.355482 0.098366 1.892389
H 3.316521 -2.467472 -1.469690
H 6.634502 1.305340 -2.070302
H 6.587780 2.559129 -0.778924
H 6.594775 1.726296 1.664008
H 6.683733 -0.051376 1.933913
H 8.923744 0.621878 -1.392654
H 8.901812 2.412497 -1.659936
H 8.929417 1.106595 2.239552
H 8.945333 -0.161901 0.948073
H -7.884032 -0.073574 -0.231139
H -3.976680 1.692800 0.417332
H -8.855415 2.216847 -0.626125
H -4.940057 3.974633 0.071077
H -7.379358 4.245431 -0.470481


