%chk=000015497.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015497

0 1
 O    2.061800       2.393400     -0.2461000    
 N   -3.151600      0.5951000     -0.2762000    
 N    1.163800      0.3426000      0.4071000    
 C   -3.187500     -0.8349000     -0.6135000    
 C   -4.494700       1.188700     -0.3355000    
 C   -4.101900      -1.604500      0.3411000    
 C   -5.451800      0.4854000      0.6280000    
 C   -5.507300      -1.014200      0.3589000    
 C   -2.237300       1.308300      -1.167600    
 C  -0.8036000      0.7814000      -1.057600    
 C  -0.1972000      0.8890000      0.3402000    
 C    3.609800      0.8024000      0.6641000    
 C    2.221900       1.256300      0.2085000    
 C    1.305000      -1.037800      0.6481000    
 C    4.108700     -0.1973000     -0.3315000    
 C    2.359800      -1.793400      0.2734000    
 C    3.521100      -1.391500     -0.4983000    
 C    4.576900       1.981200      0.7875000    
 C   0.1542000      -1.741100       1.336300    
 C    4.050100      -2.409000      -1.467000    
 H   -2.210500      -1.307800     -0.5564000    
 H   -3.543300     -0.9756000      -1.643400    
 H   -4.898800       1.141000      -1.355400    
 H   -4.445900       2.247600     -5.3800002E-02
 H   -3.680200      -1.579200       1.354000    
 H   -4.149200      -2.657400      4.0600002E-02
 H   -6.455300      0.9153000      0.5328000    
 H   -5.126100      0.6593000       1.661500    
 H   -5.992800      -1.194900     -0.6080000    
 H   -6.114800      -1.511500       1.122800    
 H   -2.567200       1.238300      -2.212300    
 H   -2.227200       2.374100     -0.9062000    
 H  -0.7160000     -0.2396000      -1.444100    
 H  -0.1851000       1.378300      -1.742300    
 H  -0.1544000       1.952500      0.6111000    
 H  -0.8412000      0.4443000       1.102000    
 H    3.528400      0.3510000       1.661200    
 H    4.984000      5.5500001E-02 -0.9247000    
 H    2.339400      -2.859100      0.5009000    
 H    4.723700       2.491200     -0.1718000    
 H    4.193900       2.721600       1.498700    
 H    5.557300       1.647100       1.144900    
 H   0.4227000      -2.761800       1.634600    
 H  -0.7095000      -1.831300      0.6829000    
 H  -0.1250000      -1.225600       2.261500    
 H    3.282000      -2.675000      -2.201500    
 H    4.359200      -3.319600     -0.9423000    
 H    4.919000      -2.036400      -2.020300    


%chk=000015497-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015497

0 1
O 2.195807 2.600761 -0.166996
N -3.048293 0.396455 -0.445256
N 1.166396 0.606145 0.491437
C -3.258339 -0.947736 -1.045862
C -4.349799 1.032185 -0.105683
C -4.016609 -1.879399 -0.078342
C -5.146424 0.169156 0.893906
C -5.368764 -1.254535 0.334085
C -2.194417 1.269850 -1.296915
C -0.694320 0.922123 -1.182040
C -0.153388 1.250034 0.227405
C 3.652602 0.792177 0.682494
C 2.305663 1.423968 0.290037
C 1.183647 -0.779064 0.841607
C 3.974670 -0.246653 -0.378314
C 2.126996 -1.686391 0.393630
C 3.281162 -1.426780 -0.469526
C 4.747727 1.862035 0.829104
C 0.020183 -1.263440 1.696442
C 3.690498 -2.529252 -1.433858
H -2.275341 -1.384813 -1.298334
H -3.837419 -0.865679 -2.004867
H -4.972637 1.191675 -1.026240
H -4.145884 2.027880 0.330583
H -3.394510 -2.041691 0.824054
H -4.171012 -2.864035 -0.560355
H -6.115038 0.659096 1.111642
H -4.579611 0.110449 1.843510
H -6.032262 -1.199618 -0.553934
H -5.880443 -1.890870 1.080639
H -2.508542 1.225626 -2.369824
H -2.344740 2.316475 -0.966172
H -0.535879 -0.151346 -1.400809
H -0.122132 1.489702 -1.939553
H -0.004217 2.337937 0.325782
H -0.887118 0.919199 0.979202
H 3.498263 0.262664 1.646846
H 4.798281 -0.024326 -1.069995
H 1.949722 -2.733158 0.676205
H 4.851008 2.441189 -0.104237
H 4.501392 2.577107 1.632723
H 5.715664 1.384381 1.065952
H 0.197710 -2.305705 2.007457
H -0.946866 -1.227793 1.159889
H -0.090323 -0.645877 2.607699
H 2.897639 -2.731571 -2.179004
H 3.871944 -3.478493 -0.892180
H 4.614653 -2.267646 -1.977134


