%chk=000155338.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155338

0 1
 O    4.979300      0.2524000     -0.2911000    
 O    4.179700      -1.873900      1.7500000E-02
 C    2.757200      5.6000002E-02  0.4516000    
 C    1.496000     -0.6309000     -3.6499999E-02
 C   0.2428000      0.1440000      0.3696000    
 C    2.965900       1.417700     -0.1789000    
 C   -1.024300     -0.5343000     -0.1538000    
 C   -2.276800      0.2587000      0.2234000    
 C    4.463400       1.575600     -0.1109000    
 C   -3.546600     -0.4378000     -0.2716000    
 C    4.015200     -0.6639000      3.5799999E-02
 C   -4.799800      0.3405000      0.1356000    
 C   -6.101500     -0.3301000     -0.3083000    
 C   -7.350400      0.4261000      0.1176000    
 H    2.768000      0.1327000       1.545700    
 H    1.446800      -1.645200      0.3797000    
 H    1.525700     -0.7515000      -1.127200    
 H   0.1953000      0.2220000       1.462600    
 H   0.2825000       1.165200     -2.6200000E-02
 H    2.439900       2.226500      0.3361000    
 H    2.646400       1.415900      -1.228600    
 H   -1.092300      -1.548800      0.2572000    
 H  -0.9678000     -0.6304000      -1.245000    
 H   -2.218700       1.266500     -0.2054000    
 H   -2.322600      0.3730000       1.313300    
 H    4.843700       2.230000     -0.9003000    
 H    4.800600       1.952100      0.8605000    
 H   -3.513800     -0.5358000      -1.363300    
 H   -3.596300      -1.451600      0.1436000    
 H   -4.753300       1.350700     -0.2896000    
 H   -4.813700      0.4570000       1.226600    
 H   -6.146100      -1.344900      0.1046000    
 H   -6.103200     -0.4312000      -1.400200    
 H   -7.359100       1.434900     -0.3071000    
 H   -8.248000     -9.7000003E-02 -0.2264000    
 H   -7.401900      0.5118000       1.207600    


%chk=000155338-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000155338

0 1
O 5.143927 0.130241 -0.217461
O 4.202113 -1.956137 0.179313
C 2.811557 0.120296 0.421275
C 1.523116 -0.565043 -0.080033
C 0.239472 0.185629 0.336605
C 3.145274 1.494296 -0.211543
C -1.050393 -0.505537 -0.159469
C -2.337924 0.237734 0.262354
C 4.688265 1.553368 -0.138637
C -3.631308 -0.439632 -0.244079
C 4.069506 -0.723331 0.133997
C -4.917184 0.304343 0.181968
C -6.212212 -0.366299 -0.330589
C -7.491020 0.382942 0.102582
H 2.750114 0.222851 1.526343
H 1.500717 -1.599269 0.314635
H 1.565489 -0.652146 -1.184810
H 0.206602 0.269285 1.443555
H 0.266757 1.224020 -0.054487
H 2.676553 2.343767 0.311214
H 2.808464 1.507110 -1.264594
H -1.081797 -1.544830 0.228385
H -1.019921 -0.588197 -1.265991
H -2.299784 1.280903 -0.116424
H -2.372624 0.310822 1.369654
H 5.163331 2.084597 -0.977333
H 5.051078 1.966577 0.820124
H -3.598625 -0.509980 -1.351597
H -3.670421 -1.483467 0.131871
H -4.876574 1.350189 -0.189013
H -4.954025 0.369705 1.289762
H -6.251515 -1.411595 0.038450
H -6.175841 -0.429389 -1.437458
H -7.489458 1.421929 -0.278160
H -8.402036 -0.114899 -0.277632
H -7.567471 0.431146 1.205421


