%chk=000070914.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070914

0 1
 O  -0.2115000       2.876000      0.8156000    
 O   -1.182400       2.296500      -1.152300    
 O    3.741200     -0.7158000      -1.196400    
 O   -2.478100      -1.649400       1.216900    
 O    3.313500      -1.039200       1.008100    
 N   -1.515400     -0.2555000     -0.3807000    
 C  -0.7489000      0.5741000      0.5142000    
 C   0.6499000      1.0500000E-02  0.7923000    
 C    1.576700     -0.1075000     -0.4244000    
 C  -0.7404000       1.977500     -5.6000002E-02
 C   -2.318000      -1.301000      5.0099999E-02
 C    2.939700     -0.6800000     -9.9699996E-02
 C   -3.026200      -1.986300      -1.087700    
 H   -1.300700      0.6234000       1.461800    
 H    1.145100      0.6385000       1.544600    
 H   0.5477000     -0.9825000       1.249900    
 H    1.731000      0.8839000     -0.8644000    
 H    1.117100     -0.7585000      -1.176200    
 H   -1.448100     -7.1900003E-02  -1.378200    
 H   -3.501600      -2.902800     -0.7276000    
 H   -3.791400      -1.320200      -1.495700    
 H   -2.312500      -2.247400      -1.874400    
 H  -0.2212000       3.787000      0.4519000    
 H    4.631800      -1.069500     -0.9867000    


%chk=000070914-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000070914

0 1
O -0.113735 2.945117 0.778538
O -1.017506 2.368996 -1.281507
O 3.674381 -0.865049 -1.142297
O -2.127973 -1.724487 1.161565
O 3.235771 -1.104573 1.125764
N -1.539270 -0.183176 -0.466889
C -0.789307 0.649283 0.481792
C 0.608916 0.064654 0.850560
C 1.531494 -0.097044 -0.369347
C -0.675229 2.044996 -0.120049
C -2.197753 -1.327488 -0.042556
C 2.859117 -0.732124 -0.005742
C -2.998010 -2.065731 -1.109622
H -1.362092 0.714194 1.427894
H 1.076453 0.721978 1.603794
H 0.434015 -0.912188 1.331897
H 1.749365 0.872476 -0.859319
H 1.054461 -0.726392 -1.145136
H -1.671738 0.192416 -1.410587
H -2.612754 -3.095795 -1.202709
H -4.049184 -2.140589 -0.782092
H -2.964221 -1.580314 -2.099981
H -0.045830 3.845143 0.358472
H 4.537931 -1.284404 -0.877443


