%chk=000013052.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013052

0 1
 O   -1.590800       1.437900       1.214300    
 O    2.849700       2.056500     -0.3641000    
 O   -3.194000       1.366500     -0.3970000    
 N   -3.240500      -1.385200     -7.3299997E-02
 C  -0.9614000     -0.9614000     -0.8674000    
 C   -1.998000     -0.6709000      0.2264000    
 C   0.4552000     -0.6887000     -0.4144000    
 C   0.9958000      0.5720000     -0.6030000    
 C    1.183400      -1.706400      0.1784000    
 C   -2.343900      0.8039000      0.2785000    
 C    2.303100      0.8227000     -0.1861000    
 C    2.490700      -1.455800      0.5950000    
 C    3.050700     -0.1912000      0.4129000    
 H   -1.173900     -0.3808000      -1.775700    
 H   -1.019900      -2.015100      -1.175200    
 H   -1.655100      -1.004200       1.212500    
 H   0.4128000       1.359400      -1.073100    
 H   0.7554000      -2.693500      0.3268000    
 H   -3.608600      -1.086100     -0.9756000    
 H   -3.949500      -1.158200      0.6227000    
 H    3.072600      -2.245000       1.061900    
 H    4.069600     -2.0999999E-03  0.7398000    
 H   -1.806000       2.393300       1.270800    
 H    2.193500       2.633400     -0.7916000    


%chk=000013052-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013052

0 1
O -2.362545 1.134974 1.751559
O 2.940583 2.075899 -0.614914
O -2.039267 1.705235 -0.478190
N -3.358214 -1.205724 -0.201101
C -0.972418 -1.065249 -0.877615
C -2.027676 -0.700480 0.197671
C 0.454618 -0.737716 -0.459656
C 1.019583 0.527231 -0.758575
C 1.230738 -1.685931 0.254671
C -2.099931 0.822037 0.409870
C 2.336723 0.833887 -0.343744
C 2.547437 -1.368173 0.662366
C 3.111278 -0.109455 0.368583
H -1.232660 -0.533044 -1.812839
H -1.085549 -2.148194 -1.061543
H -1.755755 -1.167967 1.158501
H 0.421862 1.267107 -1.308124
H 0.808306 -2.671906 0.481469
H -3.700328 -0.822938 -1.089047
H -4.064570 -1.181886 0.540547
H 3.143043 -2.107575 1.209280
H 4.128354 0.154027 0.672977
H -2.470308 2.120803 1.849127
H 2.317596 2.666038 -1.107775


