%chk=000024442.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024442

0 1
 O    4.506800      0.2124000      0.2387000    
 O    3.302200       2.153400      0.1581000    
 O    5.113000      -1.994700      0.1975000    
 C   -3.864100      0.4539000      0.3020000    
 C   -2.529800      0.1329000     -0.3749000    
 C   -4.980300     -0.4597000     -0.2069000    
 C    2.293800      2.9200001E-02 -0.4749000    
 C   -1.421600       1.069200      0.1112000    
 C    2.806300      -1.347800     -0.1175000    
 C   -6.319600     -0.1170000      0.4450000    
 C   0.9829000      0.3575000      0.1592000    
 C  -0.1055000      0.7333000     -0.5279000    
 C    3.375900      0.9420000      2.1000000E-02
 C    4.265700      -1.120400      0.1028000    
 C   -7.425700      -1.044000     -3.3399999E-02
 H   -3.762800      0.3417000       1.388300    
 H   -4.130200       1.500100      0.1081000    
 H   -2.638800      0.2218000      -1.463200    
 H   -2.255800     -0.9088000     -0.1643000    
 H   -5.068300     -0.3635000      -1.296000    
 H   -4.723300      -1.504700      5.4000001E-03
 H    2.257100      0.1381000      -1.566200    
 H   -1.675600       2.106000     -0.1400000    
 H   -1.346900       1.016100       1.204200    
 H    2.652800      -2.051400     -0.9406000    
 H    2.369100      -1.748600      0.8027000    
 H   -6.592200      0.9192000      0.2136000    
 H   -6.233900     -0.1944000       1.535200    
 H   0.9225000      0.2852000       1.243200    
 H  -5.1700000E-02  0.8154000      -1.610800    
 H   -7.558900     -0.9689000      -1.117300    
 H   -7.198800      -2.085900      0.2139000    
 H   -8.374400     -0.7803000      0.4445000    


%chk=000024442-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000024442

0 1
O 4.716501 0.268910 0.156312
O 3.468601 2.242553 0.081592
O 5.360616 -1.976282 0.139937
C -3.931632 0.455763 0.287786
C -2.559375 0.090534 -0.320761
C -5.077054 -0.459779 -0.198810
C 2.365149 0.044355 -0.457874
C -1.417484 1.016167 0.180596
C 2.953490 -1.355154 -0.146119
C -6.448734 -0.098907 0.416087
C 1.043991 0.359653 0.209374
C -0.084737 0.705955 -0.459888
C 3.492984 1.020228 -0.050890
C 4.452770 -1.148624 0.049621
C -7.588543 -1.018437 -0.072316
H -3.867082 0.404971 1.394863
H -4.173604 1.510581 0.039552
H -2.620136 0.148485 -1.427383
H -2.310346 -0.961442 -0.075330
H -5.147718 -0.405673 -1.305499
H -4.834090 -1.515360 0.044973
H 2.247878 0.168261 -1.553047
H -1.695954 2.066522 -0.048657
H -1.334583 0.943720 1.282488
H 2.774340 -2.101450 -0.935861
H 2.536539 -1.768458 0.791147
H -6.691275 0.955498 0.171401
H -6.376836 -0.151791 1.521747
H 1.031656 0.302622 1.308068
H -0.051829 0.768372 -1.560475
H -7.701083 -0.961148 -1.171530
H -7.385328 -2.074344 0.188527
H -8.557188 -0.739003 0.381070


