%chk=000130540.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130540

0 1
 O    3.278500      0.9153000      -1.716100    
 O    1.690800       2.532100     -0.2027000    
 O    3.710000      -2.159700       1.371200    
 O   -1.952300       1.470600       1.856300    
 N  -0.9254000      0.2001000      0.2269000    
 N   -3.312100      0.2133000      0.5441000    
 N   -4.699800      -1.078600     -0.8024000    
 C    2.631200     -0.3324000      0.2741000    
 C   0.4071000      0.6313000      0.5664000    
 C    1.293300     -0.5575000      0.9803000    
 C    2.197100      0.2987000      -1.046300    
 C    1.116800       1.296600     -0.6258000    
 C    3.434600      -1.611600      9.3599997E-02
 C   -1.083100     -0.6996000     -0.8123000    
 C   -2.062100      0.6704000      0.9255000    
 C   -2.276100      -1.152100      -1.193300    
 C   -3.448600     -0.6368000     -0.4396000    
 H    3.235800      0.3709000      0.8627000    
 H   0.3577000       1.335000       1.405800    
 H   0.8664000      -1.530700      0.7122000    
 H    1.427000     -0.5742000       2.068600    
 H    1.789500     -0.4620000      -1.718800    
 H   0.4552000       1.541300      -1.462800    
 H    4.383500      -1.405200     -0.4117000    
 H    2.880900      -2.353200     -0.4919000    
 H    2.267800       2.360100      0.5601000    
 H    3.636000       1.608100      -1.135400    
 H  -0.2015000      -1.053100      -1.327300    
 H    4.225000      -2.972100       1.229300    
 H   -2.410500      -1.858100      -2.001800    
 H   -5.528100     -0.7538000     -0.3153000    
 H   -4.838300      -1.738400      -1.560800    


%chk=000130540-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130540

0 1
O 3.664275 1.688005 -0.445367
O 1.271345 2.460040 0.001496
O 3.856186 -2.574296 1.101411
O -1.308743 2.170920 0.447975
N -0.950779 -0.107263 -0.003527
N -3.170980 0.878821 -0.118466
N -5.014163 -0.405709 -0.694040
C 2.797451 -0.532847 0.363870
C 0.489166 0.098328 0.334006
C 1.383941 -1.161484 0.308095
C 2.709126 0.621467 -0.675118
C 1.223078 1.132285 -0.588909
C 3.938588 -1.504078 0.087655
C -1.472421 -1.332825 -0.351076
C -1.827077 1.052492 0.121003
C -2.821883 -1.501790 -0.605591
C -3.660109 -0.334010 -0.471053
H 2.956531 -0.083562 1.363444
H 0.515852 0.528858 1.355206
H 1.280457 -1.719259 -0.645771
H 1.198873 -1.858013 1.141835
H 2.902672 0.220584 -1.690315
H 0.742223 1.162995 -1.587959
H 4.903854 -0.961812 0.152765
H 3.838260 -1.932995 -0.934878
H 0.318486 2.667252 0.271345
H 3.125422 2.440935 -0.059657
H -0.773754 -2.168974 -0.409198
H 4.678329 -3.123889 1.067870
H -3.216951 -2.481413 -0.880193
H -5.559270 0.447837 -0.579984
H -5.471684 -1.271901 -0.964073


