%chk=000102611.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102611

0 1
 O    3.276500      -1.098800      0.1856000    
 O    2.072400       1.025700      -1.112800    
 C    1.923100     -0.7666000      0.4677000    
 C    1.583600      0.6771000      0.1846000    
 C    2.268900      -1.687600     -0.6469000    
 C   6.1200000E-02  0.9337000      0.2180000    
 C    2.275200       1.588300       1.207600    
 C  -0.7432000      0.1260000     -0.8099000    
 C   -2.209200      0.4510000     -0.7247000    
 C   -3.143300     -0.1601000      2.8400000E-02
 C   -4.597900      0.2139000      6.9100000E-02
 C   -2.767300      -1.302800      0.9332000    
 H    1.482500      -1.163100       1.371700    
 H    2.068700      -2.743800     -0.5123000    
 H    2.206800      -1.360600      -1.675800    
 H  -0.3189000      0.7188000       1.225600    
 H  -0.1218000       2.000500      2.8200001E-02
 H    1.941500       1.372100       2.228100    
 H    2.076600       2.643700      0.9890000    
 H    3.363800       1.464300       1.175600    
 H  -0.5737000     -0.9486000     -0.6930000    
 H  -0.4024000      0.3678000      -1.824100    
 H    3.043200      0.9688000      -1.095600    
 H   -2.527900       1.286200      -1.346700    
 H   -5.218600     -0.6372000     -0.2283000    
 H   -4.819900       1.043600     -0.6102000    
 H   -4.885800      0.5224000       1.079200    
 H   -3.210900      -2.232900      0.5627000    
 H   -1.692800      -1.463700       1.042200    
 H   -3.154600      -1.120300       1.942000    


%chk=000102611-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102611

0 1
O 3.468625 -1.011211 -0.093608
O 1.980172 1.053283 -1.249547
C 2.133579 -0.626358 0.527714
C 1.690059 0.799933 0.177556
C 2.183255 -1.718621 -0.489084
C 0.165951 0.996340 0.354039
C 2.485227 1.801338 1.047423
C -0.720097 0.054054 -0.504219
C -2.180107 0.452379 -0.443289
C -3.235708 -0.265017 0.040614
C -4.645174 0.307472 0.012216
C -3.136608 -1.660430 0.633339
H 2.055947 -0.897506 1.589706
H 2.125914 -2.763416 -0.162526
H 1.847406 -1.500101 -1.508653
H -0.092852 0.878895 1.424968
H -0.057186 2.046956 0.084816
H 2.244851 1.687058 2.120898
H 2.237908 2.831880 0.740702
H 3.572711 1.649267 0.920362
H -0.581933 -0.993939 -0.181214
H -0.358135 0.120488 -1.548998
H 2.922553 0.767600 -1.401288
H -2.393892 1.457635 -0.842023
H -5.324395 -0.336318 -0.582155
H -4.667260 1.321273 -0.423901
H -5.074606 0.361302 1.032869
H -3.742669 -2.378628 0.045477
H -2.103683 -2.043040 0.672041
H -3.544053 -1.674768 1.663967


