%chk=000064909.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064909

0 1
 O   0.5549000      -1.969200      -1.327400    
 N  -0.3079000      -2.291600      0.8047000    
 N  -0.5535000      -3.632300      0.5918000    
 C   0.4411000     -7.2999999E-02  0.1847000    
 C  -0.4329000      0.8445000     -0.6992000    
 C    1.913000      0.3065000      0.1357000    
 C   -1.895900      0.8190000     -0.3241000    
 C   0.2499000      -1.539200     -0.2164000    
 C    2.683800      0.1406000       1.269000    
 C    2.435800      0.8055000      -1.040500    
 C   -2.734100     -0.1065000     -0.9244000    
 C   -2.371800       1.721200      0.6136000    
 C    4.033800      0.4885000       1.224200    
 C    3.785900       1.153200      -1.085200    
 C   -4.085000     -0.1303000     -0.5779000    
 C   -3.722700       1.697300      0.9601000    
 C    4.584800      0.9946000      4.7200002E-02
 C   -4.579300      0.7714000      0.3643000    
 H   0.1098000      6.5800004E-02   1.223800    
 H  -0.3463000      0.5762000      -1.761000    
 H  -9.0099998E-02   1.886400     -0.6288000    
 H    2.264000     -0.2555000       2.188900    
 H    1.849500      0.9217000      -1.945200    
 H   -2.360900     -0.8122000      -1.661000    
 H   -1.712100       2.443900       1.085100    
 H    4.656200      0.3641000       2.105600    
 H    4.216800       1.542700      -2.003100    
 H  -0.5526000      -1.901100       1.709000    
 H   -4.752000     -0.8510000      -1.041900    
 H   -4.107600       2.399000       1.694400    
 H    5.636400       1.263900      1.1800000E-02
 H   -5.631100      0.7527000      0.6343000    
 H   -1.555100      -3.772700      0.7174000    
 H  -0.1008000      -4.140200       1.350700    


%chk=000064909-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064909

0 1
O 0.016183 -1.769156 -1.366574
N -0.180044 -2.347420 0.870961
N -0.469959 -3.717198 0.627278
C 0.398798 -0.007185 0.332820
C -0.442122 1.028225 -0.490826
C 1.901195 0.269776 0.208014
C -1.934779 0.934752 -0.209674
C 0.061116 -1.433326 -0.142829
C 2.617559 0.801811 1.309595
C 2.589357 0.041932 -1.012735
C -2.777427 0.109712 -1.000003
C -2.510130 1.653405 0.871070
C 3.994082 1.104006 1.198721
C 3.964984 0.340765 -1.122606
C -4.158161 0.006646 -0.716268
C -3.889884 1.550958 1.159012
C 4.672694 0.874349 -0.019708
C -4.719495 0.725091 0.365091
H 0.112537 0.095835 1.398735
H -0.234006 0.848176 -1.560783
H -0.064208 2.036429 -0.238258
H 2.095796 0.984435 2.257883
H 2.045263 -0.385826 -1.862507
H -2.341785 -0.452244 -1.834567
H -1.874370 2.308101 1.481504
H 4.534048 1.515342 2.059158
H 4.486377 0.156628 -2.068867
H -0.146364 -2.074249 1.854140
H -4.796207 -0.629585 -1.340454
H -4.318756 2.118462 1.993029
H 5.739917 1.106560 -0.108511
H -5.790800 0.647925 0.582799
H 0.298312 -4.153065 0.096959
H -1.355723 -3.806165 0.108602


