%chk=000095068.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095068

0 1
 O   6.5300003E-02   2.549600     -0.8287000    
 O    2.107500      -2.573000      0.2197000    
 O    1.879300      -1.059100      -1.478000    
 N   0.1128000      0.3446000     -4.1000000E-03
 N   -4.590800     -0.7736000     -0.1247000    
 C    1.053500     -0.5024000      0.6935000    
 C    2.027600      0.4875000       1.307600    
 C    1.990900       1.687400      0.3628000    
 C   0.6043000       1.628500     -0.2330000    
 C   -1.180800     -0.1420000     -0.4402000    
 C    1.717900      -1.390100     -0.3132000    
 C   -2.236100      0.1216000      0.6309000    
 C   -3.551400     -0.3789000      0.2077000    
 H   0.5275000      -1.096900       1.447200    
 H    3.040700      9.3400002E-02   1.434000    
 H    1.661400      0.7990000       2.294100    
 H    2.725800       1.587800     -0.4420000    
 H    2.147100       2.627700      0.8970000    
 H   -1.452800      0.3872000      -1.361600    
 H   -1.104400      -1.209000     -0.6785000    
 H   -1.946000     -0.3623000       1.571000    
 H   -2.299800       1.196300      0.8391000    
 H    2.542600      -3.148700     -0.4448000    


%chk=000095068-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000095068

0 1
O -0.064208 2.595205 -0.730309
O 2.355538 -2.512645 0.370378
O 1.589581 -1.453670 -1.556619
N 0.092272 0.384376 0.060110
N -4.664599 -0.820825 -0.256742
C 1.058173 -0.515690 0.695605
C 2.143337 0.465926 1.268512
C 2.017366 1.729092 0.383598
C 0.584215 1.677042 -0.163200
C -1.205857 -0.048065 -0.460774
C 1.665116 -1.504839 -0.313051
C -2.330495 0.132761 0.605970
C -3.625548 -0.387026 0.138662
H 0.605548 -1.113656 1.507517
H 3.146297 0.012309 1.258248
H 1.886719 0.700267 2.315492
H 2.715124 1.716566 -0.473835
H 2.181105 2.669547 0.932655
H -1.440371 0.573261 -1.342260
H -1.144886 -1.100415 -0.787696
H -2.056886 -0.388382 1.543157
H -2.431191 1.208196 0.840645
H 2.765751 -3.144734 -0.280264


