%chk=000073470.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073470

0 1
 O    2.203200       1.623400     -0.6958000    
 O   -2.848100      3.4299999E-02   2.510800    
 N   -3.510500     -0.8866000      -1.036000    
 C   -2.907700      0.2368000       1.093300    
 C   -1.556600      0.6425000      0.6034000    
 C   0.7836000      0.1441000      0.2584000    
 C   -3.411000      -1.050700      0.4126000    
 C  -0.4841000     -0.2516000      0.7234000    
 C   0.9167000       1.410500     -0.3026000    
 C    2.078600     -0.4492000      0.2004000    
 C   -1.380300       1.905400      3.3300001E-02
 C    2.908000      0.4981000     -0.3917000    
 C  -0.1307000       2.320600     -0.4357000    
 C    2.638300      -1.682100      0.5835000    
 C    4.267300      0.3059000     -0.6324000    
 C   -4.462100      0.1739000      -1.367400    
 C   -3.908200      -2.144600      -1.668100    
 C    4.002700      -1.904400      0.3539000    
 C    4.800900     -0.9262000     -0.2433000    
 H   -3.627000       1.052000      0.9624000    
 H   -4.382400      -1.327100      0.8469000    
 H   -2.743600      -1.887100      0.6573000    
 H  -0.6098000      -1.229900       1.177100    
 H   -2.218700       2.593100     -5.2900001E-02
 H   1.3900000E-02   3.298900     -0.8784000    
 H    2.031300      -2.452800       1.049100    
 H    4.880400       1.069500      -1.096400    
 H   -5.437700      2.3000000E-02 -0.8905000    
 H   -4.626200      0.2095000      -2.451500    
 H   -4.089400       1.168000      -1.107800    
 H   -3.934000      -2.037300      -2.758300    
 H   -4.894500      -2.483800      -1.330800    
 H   -3.178700      -2.932600      -1.450200    
 H   -3.738100     -0.2224000       2.807000    
 H    4.445500      -2.853300      0.6458000    
 H    5.856600      -1.126000     -0.4093000    


%chk=000073470-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000073470

0 1
O 2.374527 1.031355 -1.349300
O -2.435947 -0.931061 2.243554
N -4.252246 -0.258996 -1.000100
C -2.703975 -0.188937 0.999578
C -1.357293 0.155161 0.373086
C 1.063246 -0.070187 0.261313
C -3.604681 -1.054793 0.061975
C -0.161938 -0.399248 0.883897
C 1.058151 0.809203 -0.858928
C 2.463220 -0.423631 0.492897
C -1.322773 1.036831 -0.748757
C 3.218474 0.263870 -0.503468
C -0.108074 1.376426 -1.386586
C 3.148183 -1.237763 1.424514
C 4.611572 0.181689 -0.619306
C -5.470708 0.436768 -0.543437
C -4.461560 -1.002380 -2.258778
C 4.554407 -1.338365 1.330162
C 5.275964 -0.639212 0.323147
H -3.247643 0.751638 1.237012
H -4.366227 -1.583141 0.696789
H -2.972761 -1.834342 -0.398610
H -0.211742 -1.059681 1.752660
H -2.268902 1.431826 -1.132277
H -0.077557 2.050757 -2.246422
H 2.602082 -1.778924 2.204413
H 5.152568 0.725553 -1.398452
H -6.303289 -0.264954 -0.281727
H -5.832311 1.116278 -1.335618
H -5.251416 1.049452 0.348969
H -4.846738 -0.315095 -3.033704
H -5.186841 -1.848807 -2.162025
H -3.499234 -1.409800 -2.613726
H -3.298274 -1.215443 2.638442
H 5.101295 -1.964194 2.043624
H 6.366039 -0.736052 0.274689


