%chk=000128191.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128191

0 1
 O  -9.7000003E-03  -1.496700      -1.646600    
 O    1.638800       2.173900     -0.7500000    
 N   -2.311300     -9.0800002E-02 -0.6417000    
 C   -3.392000      9.9699996E-02  0.3313000    
 C   -1.016600     -3.7999999E-02  1.5799999E-02
 C   0.1181000     -0.2324000     -0.9974000    
 C   -4.732800      2.5100000E-02 -0.4067000    
 C   -3.306300      -1.014500       1.380000    
 C   -3.235900       1.468900       1.003400    
 C    1.473800     -0.1796000     -0.3278000    
 C    2.158100       1.021300     -0.2418000    
 C    2.003000      -1.351000      0.1890000    
 C    3.407000       1.052200      0.3788000    
 C    3.252000      -1.319900      0.8094000    
 C    3.954000     -0.1184000      0.9043000    
 H   -2.360400      0.6294000      -1.362200    
 H  -0.8389000      0.9181000      0.5175000    
 H  -0.9147000     -0.8406000      0.7529000    
 H   6.2799998E-02  0.5246000      -1.789200    
 H   -5.573500      0.1511000      0.2851000    
 H   -4.813500      0.8083000      -1.169600    
 H   -4.859300     -0.9424000     -0.9069000    
 H   -2.489300     -0.8815000       2.097100    
 H   -3.207400      -2.003300      0.9162000    
 H   -4.225100      -1.038500       1.979600    
 H   -4.143300       1.716900       1.568200    
 H   -2.415000       1.511900       1.726500    
 H   -3.093500       2.269100      0.2673000    
 H    1.470700      -2.296500      0.1424000    
 H  -0.8998000      -1.534100      -2.036700    
 H    3.965000       1.981200      0.4601000    
 H    3.676500      -2.230500       1.222000    
 H    4.925900     -9.4200000E-02   1.388300    
 H    2.264500       2.901300     -0.5907000    


%chk=000128191-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128191

0 1
O -0.332598 -1.522177 -1.250463
O 1.755434 2.139466 -0.751853
N -2.256706 0.194225 -0.599371
C -3.427892 0.108851 0.341930
C -0.911865 0.523844 -0.054834
C 0.147371 -0.172010 -0.974486
C -4.680005 -0.106311 -0.543059
C -3.246495 -1.111354 1.278123
C -3.595422 1.409003 1.180358
C 1.521196 -0.225069 -0.330536
C 2.312485 0.947946 -0.225999
C 2.049884 -1.432576 0.177519
C 3.591092 0.922394 0.375032
C 3.326432 -1.475222 0.785302
C 4.097447 -0.295255 0.883845
H -2.488990 0.803529 -1.398368
H -0.699195 1.608502 0.009429
H -0.827610 0.091793 0.956859
H 0.216596 0.411478 -1.919908
H -5.585018 -0.206400 0.081828
H -4.836626 0.750029 -1.228038
H -4.570000 -1.021576 -1.151507
H -2.368425 -1.000670 1.939064
H -3.114006 -2.033950 0.685908
H -4.136309 -1.229553 1.922547
H -4.468252 1.332756 1.855023
H -2.702240 1.598860 1.803088
H -3.747797 2.284654 0.520917
H 1.440213 -2.333177 0.061592
H -1.337277 -1.393253 -1.225430
H 4.187180 1.842303 0.446012
H 3.719105 -2.422723 1.169346
H 5.089229 -0.316578 1.348985
H 2.410965 2.878321 -0.700954


