%chk=000004327.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004327

0 1
 O    1.358700      0.2353000      0.8333000    
 N   -2.851500      -1.873600      0.4639000    
 N    1.951600      -1.831400     -0.1184000    
 N   -2.311400      0.3803000      9.7099997E-02
 N   -4.459900     -0.2477000      0.9896000    
 N  -0.7896000       4.855400     -0.1340000    
 N    5.924000     -0.7096000      0.3964000    
 C   -1.670400      -2.522900      4.1700002E-02
 C   -1.717400      -3.808200     -0.4980000    
 C   0.7284000      -2.490500     -0.2441000    
 C  -0.4476000      -1.864100      0.1686000    
 C  -0.5414000      -4.434900     -0.9106000    
 C   0.6814000      -3.776000     -0.7838000    
 C   -3.013200      -4.537400     -0.6441000    
 C   -3.224900     -0.5180000      0.5192000    
 C   -2.702100       1.669900      0.1640000    
 C    2.192300     -0.5501000      0.3950000    
 C   -1.724800       2.630600     -0.2889000    
 C    3.612100     -0.1105000      0.3711000    
 C   -3.938400       2.073600      0.6253000    
 C   -4.784600       1.061300       1.029100    
 C  -0.7995000       2.303400      -1.274200    
 C   -1.677700       3.909000      0.2444000    
 C    3.911400       1.228000      0.3071000    
 C    4.613700      -1.041700      0.4139000    
 C   0.1302000       3.250100      -1.690100    
 C    5.248500       1.608900      0.2871000    
 C   9.3599997E-02   4.500400      -1.094000    
 C    6.208100      0.6106000      0.3333000    
 H  -0.4362000     -0.9026000      0.6529000    
 H  -0.5598000      -5.436400      -1.332100    
 H    1.589800      -4.276600      -1.109400    
 H   -3.620800      -2.492400      0.6980000    
 H   -3.436300      -4.766400      0.3394000    
 H   -3.729800      -3.942800      -1.220400    
 H   -2.886600      -5.487200      -1.175500    
 H    2.738300      -2.355700     -0.4905000    
 H   -4.269600       3.103400      0.6636000    
 H   -5.779400       1.280600       1.402100    
 H  -0.7828000       1.322200      -1.742100    
 H   -2.345700       4.242000       1.032700    
 H    3.141100       1.991900      0.2660000    
 H    4.447900      -2.108800      0.5043000    
 H   0.8600000       3.017100      -2.457000    
 H    5.530700       2.654300      0.2355000    
 H   0.7973000       5.274000      -1.382900    
 H    7.265100      0.8552000      0.3197000    


%chk=000004327-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004327

0 1
O 1.543549 0.387675 -0.499216
N -2.944922 -1.839358 -0.161657
N 2.042871 -1.886729 -0.180688
N -2.427867 0.509074 -0.029530
N -4.711849 -0.370460 -0.193863
N -1.470454 5.264999 0.615908
N 6.139690 -0.782292 0.492708
C -1.688446 -2.486585 -0.144014
C -1.717508 -3.921628 -0.119291
C 0.755746 -2.504920 -0.159191
C -0.459222 -1.777729 -0.161143
C -0.484283 -4.606236 -0.110726
C 0.745752 -3.923426 -0.130045
C -3.027017 -4.690364 -0.101784
C -3.333249 -0.505937 -0.128029
C -2.927079 1.792483 0.005080
C 2.383620 -0.548490 -0.321628
C -1.940127 2.896887 0.136356
C 3.863175 -0.259902 -0.268197
C -4.324584 2.028821 -0.080380
C -5.174544 0.903925 -0.173922
C -0.555444 2.660351 -0.069908
C -2.334476 4.219000 0.488934
C 4.340858 0.909837 -0.912611
C 4.804176 -1.056859 0.437535
C 0.351400 3.730922 0.064792
C 5.716518 1.208958 -0.864558
C -0.143588 5.012455 0.397348
C 6.579182 0.331896 -0.164000
H -0.467078 -0.689830 -0.177858
H -0.488677 -5.701828 -0.088822
H 1.686869 -4.487119 -0.125556
H -3.767844 -2.445737 -0.210775
H -3.646015 -4.443896 0.784147
H -3.641485 -4.495309 -1.004224
H -2.837796 -5.775844 -0.072078
H 2.824670 -2.545377 -0.149269
H -4.742316 3.036531 -0.090854
H -6.261956 1.020685 -0.236588
H -0.197437 1.661428 -0.324193
H -3.382158 4.460233 0.701974
H 3.624174 1.554091 -1.431828
H 4.490642 -1.932887 1.020800
H 1.422814 3.567311 -0.084712
H 6.119827 2.098888 -1.357119
H 0.527583 5.872969 0.499798
H 7.657104 0.521323 -0.112922


