%chk=000107260.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107260

0 1
 O    1.488600       2.794600     -0.3524000    
 O  -0.4101000       2.046300      0.4679000    
 N   -3.186000      0.2602000      0.3043000    
 N   0.7558000       1.860300      4.8000000E-02
 C   -1.972000     -0.4314000     -0.1391000    
 C  -0.8993000     -0.3448000      0.9619000    
 C   0.5079000     -0.5446000      0.4522000    
 C   -2.339800      -1.874100     -0.4863000    
 C    1.268200      0.5338000      2.4300000E-02
 C    1.016000      -1.835600      0.4235000    
 C   -4.193800      0.2465000     -0.7428000    
 C    2.564900      0.3171000     -0.4422000    
 C    2.312600      -2.052300     -4.3200001E-02
 C    3.087000     -0.9760000     -0.4760000    
 H   -1.593800      6.0899999E-02  -1.044800    
 H   -1.098700      -1.180700       1.654600    
 H   -1.008500      0.4801000       1.672500    
 H   -2.975800      -1.943800      -1.374800    
 H   -2.849500      -2.375600      0.3445000    
 H   -1.448000      -2.461000     -0.7248000    
 H   -2.951000       1.227500      0.5275000    
 H   0.4313000      -2.685100      0.7645000    
 H   -4.985700      0.9552000     -0.4757000    
 H   -4.684900     -0.7264000     -0.8381000    
 H   -3.796900      0.5616000      -1.713700    
 H    3.200300       1.128400     -0.7884000    
 H    2.720000      -3.058700     -6.7699999E-02
 H    4.096700      -1.145300     -0.8388000    


%chk=000107260-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107260

0 1
O 1.732030 2.829346 -0.218536
O -0.432664 2.149436 -0.089409
N -3.257620 0.167822 0.355153
N 0.837447 1.901664 -0.113503
C -2.013591 -0.440532 -0.181321
C -0.951531 -0.393247 0.964444
C 0.475307 -0.556203 0.472143
C -2.266532 -1.885269 -0.657215
C 1.304902 0.491862 -0.031267
C 1.071534 -1.845937 0.523104
C -4.373210 0.296234 -0.606288
C 2.635165 0.268098 -0.465299
C 2.387424 -2.090934 0.080675
C 3.175849 -1.028156 -0.420961
H -1.618027 0.151229 -1.043785
H -1.189039 -1.199365 1.682426
H -1.066286 0.569028 1.493366
H -2.950340 -1.909397 -1.523940
H -2.719163 -2.479664 0.157873
H -1.321320 -2.363672 -0.970885
H -3.035369 1.083435 0.772191
H 0.475881 -2.670248 0.930360
H -5.174426 0.902507 -0.148035
H -4.802636 -0.695073 -0.834646
H -4.085831 0.775845 -1.573913
H 3.218849 1.119630 -0.824247
H 2.799406 -3.104435 0.133422
H 4.199292 -1.206904 -0.765007


