%chk=000094093.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094093

0 1
 O    1.022400     -0.6555000      -2.178500    
 O    1.993000       1.133200      -3.143800    
 O   -3.887800       3.024900       1.193700    
 O   -1.710500       2.595600      0.7022000    
 N   -1.126700     -7.0699997E-02 -0.2688000    
 C   0.7353000      -1.512900      -1.043100    
 C    1.622300      -1.297700      0.1546000    
 C  -0.6947000      -1.279200     -0.7355000    
 C    2.532700     -0.2362000      0.1641000    
 C    2.659300      0.6145000     -0.9393000    
 C   -2.487100     -0.1070000     -6.0800001E-02
 C   -1.776500      -2.116100     -0.8357000    
 C    3.340100     -1.7500000E-02   1.309000    
 C   -2.922400      -1.386900     -0.4112000    
 C    1.534900      -2.155000       1.262600    
 C    1.869800      0.3995000      -2.170900    
 C    3.227700     -0.8798000       2.409400    
 C   -3.356800      0.8851000      0.4057000    
 C    3.564200       1.683900     -0.9068000    
 C    2.332700      -1.946000       2.383500    
 C    4.240800       1.057300       1.323100    
 C   -4.292400      -1.693800     -0.2914000    
 C    4.348800       1.903900      0.2225000    
 C   -4.711100      0.5575000      0.5168000    
 C   -5.174000     -0.7113000      0.1739000    
 C   -2.883900       2.210100      0.7651000    
 H   0.8866000      -2.537700      -1.403500    
 H  -0.5390000      0.7346000     -0.1015000    
 H   -1.753200      -3.142400      -1.176400    
 H   0.8376000      -2.989200       1.257800    
 H    3.839900     -0.7302000       3.296200    
 H    3.676000       2.355300      -1.754300    
 H    2.254900      -2.611500       3.238100    
 H    4.867600       1.244500       2.192300    
 H   -4.666600      -2.678900     -0.5550000    
 H    5.049700       2.733400      0.2430000    
 H   -5.446000       1.276000      0.8718000    
 H   -6.231600     -0.9431000      0.2682000    
 H   -3.556400       3.916800       1.433000    


%chk=000094093-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094093

0 1
O 1.236324 -1.186304 -2.249319
O 2.000203 0.647531 -3.372584
O -3.511654 3.050217 1.536136
O -1.354413 2.284862 1.146190
N -1.026892 -0.209675 -0.099432
C 0.772822 -1.806438 -0.948242
C 1.686209 -1.478359 0.223765
C -0.661862 -1.428391 -0.702214
C 2.458459 -0.273859 0.187602
C 2.509514 0.535652 -1.000620
C -2.407835 -0.131694 -0.031877
C -1.820121 -2.139724 -1.022314
C 3.206191 0.133234 1.356558
C -2.949722 -1.337365 -0.607276
C 1.705633 -2.284938 1.366307
C 1.896183 0.058342 -2.275231
C 3.193647 -0.709548 2.515008
C -3.236124 0.899813 0.489674
C 3.231420 1.737401 -1.004616
C 2.468449 -1.903906 2.512371
C 3.932304 1.368369 1.314191
C -4.357498 -1.496404 -0.657738
C 3.931711 2.161775 0.162265
C -4.638288 0.706203 0.422466
C -5.186493 -0.473940 -0.143472
C -2.603942 2.095826 1.064454
H 0.800618 -2.883722 -1.180006
H -0.420337 0.530542 0.266127
H -1.849274 -3.111359 -1.512786
H 1.112145 -3.206314 1.394694
H 3.760420 -0.404627 3.402152
H 3.263223 2.325153 -1.927606
H 2.468640 -2.550167 3.396216
H 4.492371 1.683042 2.202598
H -4.799895 -2.399385 -1.092769
H 4.486235 3.105514 0.144393
H -5.293548 1.488368 0.816183
H -6.274521 -0.590019 -0.181523
H -3.000703 3.821797 1.900376


