%chk=000095162.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095162

0 1
 O   -2.121400      -1.597900     -0.7894000    
 O   -4.379700     -0.7744000      0.5751000    
 O    4.401900       1.387000     -3.6400001E-02
 O    4.611900     -0.7091000      0.5811000    
 N    3.907800      0.2587000      0.2034000    
 C  -0.2371000     -0.2971000     -0.2758000    
 C   -2.627100      0.6893000     -0.2209000    
 C   -1.668900     -0.4891000     -0.4435000    
 C   0.3340000      0.9488000     -0.5348000    
 C   0.5651000      -1.358800      0.1427000    
 C    2.509700      7.1400002E-02  4.2900000E-02
 C    1.707500       1.133000     -0.3756000    
 C    1.938500      -1.174400      0.3020000    
 C   -4.014200      0.3677000      0.3021000    
 C   -4.927900       1.545000      0.5272000    
 H   -2.738400       1.206500      -1.180100    
 H   -2.180300       1.372300      0.5105000    
 H  -0.2631000       1.789300     -0.8773000    
 H   0.1370000      -2.335500      0.3532000    
 H    2.118500       2.116200     -0.5902000    
 H    2.532400      -2.023700      0.6302000    
 H   -5.039100       2.105900     -0.4041000    
 H   -5.913700       1.192200      0.8430000    
 H   -4.512300       2.187400       1.307300    


%chk=000095162-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000095162

0 1
O -2.439079 -1.375535 -0.961939
O -2.657209 2.436780 0.988424
O 4.220178 1.064475 1.042057
O 4.389525 -1.166281 0.595050
N 3.721360 -0.064641 0.666584
C -0.424574 -0.160079 -0.428998
C -2.678378 1.042360 -1.018077
C -1.873833 -0.253266 -0.816985
C 0.169015 1.057282 0.004570
C 0.357826 -1.347251 -0.483958
C 2.281382 -0.099825 0.290834
C 1.527947 1.090395 0.372773
C 1.717187 -1.325173 -0.131185
C -3.252451 1.544497 0.332062
C -4.537113 0.885099 0.792737
H -3.511340 0.797111 -1.697341
H -2.055879 1.839860 -1.453121
H -0.431700 1.968245 0.091596
H -0.125737 -2.274535 -0.806384
H 2.007997 2.008837 0.719606
H 2.342385 -2.220572 -0.172997
H -4.484187 -0.209519 0.647235
H -4.741203 1.125930 1.846956
H -5.381017 1.246506 0.173102


