%chk=000112971.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112971

0 1
 O   -3.257300      0.5411000      2.2900000E-02
 O   -3.537300      -1.691400      7.4100003E-02
 C    1.010100      5.3300001E-02 -0.2657000    
 C  -0.4325000      0.2329000      0.2037000    
 C    1.879900       1.231600      0.1934000    
 C    1.582600      -1.277800      0.2395000    
 C    3.339000       1.049000     -0.2184000    
 C    3.042200      -1.456200     -0.1722000    
 C   -1.017300       1.540500     -0.3080000    
 C    3.901900     -0.2791000      0.2780000    
 C   -1.310700     -0.9112000     -0.2819000    
 C   -2.419200       1.692600      0.2446000    
 C   -2.781500     -0.7254000     -9.8999999E-03
 H    1.027100      3.2299999E-02  -1.364900    
 H  -0.4552000      0.2487000       1.302800    
 H    1.548800       2.174100     -0.2518000    
 H    1.820200       1.344800       1.283100    
 H    1.504400      -1.332200       1.332600    
 H    1.028800      -2.129300     -0.1684000    
 H    3.940400       1.874700      0.1785000    
 H    3.418500       1.092800      -1.311700    
 H    3.104500      -1.557200      -1.262800    
 H    3.435700      -2.384500      0.2572000    
 H   -1.049400       1.533900      -1.404600    
 H  -0.4503000       2.419900      5.7999999E-03
 H    4.925500     -0.4072000     -9.1300003E-02
 H    3.956400     -0.2654000       1.373500    
 H   -1.031200      -1.839300      0.2283000    
 H   -1.198600      -1.062800      -1.362100    
 H   -2.399800       1.880200       1.324000    
 H   -2.913400       2.548700     -0.2263000    


%chk=000112971-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112971

0 1
O -3.390490 0.555043 0.032815
O -3.659609 -1.696654 -0.129256
C 1.030786 0.069670 -0.260628
C -0.442997 0.264043 0.211747
C 1.944235 1.238805 0.202277
C 1.623258 -1.281635 0.230596
C 3.418741 1.046059 -0.225531
C 3.098511 -1.472932 -0.194429
C -1.098152 1.557513 -0.328398
C 3.983911 -0.299672 0.281507
C -1.345459 -0.926445 -0.204207
C -2.499174 1.731001 0.260610
C -2.861924 -0.738702 -0.078140
H 1.031054 0.055476 -1.375185
H -0.434799 0.327703 1.322891
H 1.576802 2.202396 -0.199459
H 1.892954 1.312049 1.310001
H 1.554281 -1.318078 1.339325
H 1.025085 -2.128757 -0.154460
H 4.031223 1.888556 0.150381
H 3.483827 1.073191 -1.333315
H 3.153111 -1.543627 -1.300837
H 3.481060 -2.432467 0.204498
H -1.149763 1.517437 -1.434996
H -0.509099 2.452285 -0.057363
H 5.025635 -0.436703 -0.067441
H 4.014210 -0.289587 1.390978
H -1.108829 -1.844250 0.359753
H -1.162263 -1.169145 -1.272087
H -2.448750 1.886675 1.355801
H -3.045075 2.572853 -0.195449


