%chk=000025421.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025421

0 1
 O   0.4109000       1.093800     -2.6600000E-02
 O   -1.191100       2.083900       1.315500    
 O    3.351100      0.3612000      0.5866000    
 C   -2.166500     -0.8673000      6.5300003E-02
 C   -3.146600      0.2276000      0.3146000    
 C   -1.845000      0.5408000     -0.3419000    
 C   -1.490100      -1.449000       1.261000    
 C   -2.403300      -1.858300      -1.025400    
 C   -4.371000      0.3144000     -0.5041000    
 C  -0.8551000       1.328900      0.4144000    
 C   -5.547000     -0.3081000     -0.2959000    
 C   -6.707100     -0.1122000      -1.231900    
 C   -5.810100      -1.233300      0.8584000    
 C    1.441900       1.818500      0.6517000    
 C    2.741900       1.422400      2.3900000E-02
 C    3.444300       1.929300      -1.020700    
 C    4.493800      0.1765000     -0.1253000    
 C    4.597500       1.115600      -1.124900    
 C    5.350500     -0.9400000      0.2982000    
 C    5.066300      -2.276500     -0.3672000    
 C    4.634700      -3.368300      0.2743000    
 H   -3.293300      0.5572000       1.338500    
 H   -1.852900      0.7616000      -1.406000    
 H   -1.416800     -0.7474000       2.099200    
 H   -2.041900      -2.323300       1.624000    
 H  -0.4745000      -1.773000       1.008600    
 H   -3.121800      -2.620400     -0.7047000    
 H   -2.784100      -1.403700      -1.946500    
 H   -1.468800      -2.367700      -1.286100    
 H   -4.301500      0.9734000      -1.368400    
 H   -6.467400      0.5679000      -2.056000    
 H   -7.562600      0.3076000     -0.6926000    
 H   -7.007200      -1.070300      -1.668700    
 H   -4.944300      -1.350100       1.516500    
 H   -6.079800      -2.228400      0.4897000    
 H   -6.637600     -0.8528000       1.466000    
 H    1.279400       2.895600      0.5318000    
 H    1.438700       1.563200       1.717400    
 H    3.177000       2.774000      -1.639000    
 H    5.402300       1.204500      -1.840800    
 H    6.398100     -0.6870000      9.0499997E-02
 H    5.286200      -1.049600       1.388800    
 H    5.238900      -2.337800      -1.439100    
 H    4.457400      -4.290600     -0.2680000    
 H    4.450700      -3.360900       1.342800    


%chk=000025421-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025421

0 1
O 0.128902 1.452260 -0.582388
O -0.620548 0.823816 1.550766
O 3.025361 0.709047 0.351382
C -1.857648 -1.647785 -0.067597
C -2.952968 -0.596980 0.185409
C -1.598836 -0.160151 -0.471824
C -1.138999 -2.236774 1.144759
C -2.000532 -2.629373 -1.230733
C -4.217600 -0.516215 -0.589605
C -0.687108 0.713961 0.299913
C -5.424625 -0.056243 -0.141693
C -6.636985 -0.043636 -1.058459
C -5.685197 0.471650 1.257892
C 1.181151 2.325158 0.050849
C 2.536025 1.851208 -0.325268
C 3.488271 2.279262 -1.238178
C 4.306396 0.432626 -0.170089
C 4.616641 1.378851 -1.137613
C 5.019782 -0.765336 0.388786
C 4.348706 -2.088000 0.037681
C 3.949509 -3.012182 0.944804
H -3.011135 -0.283650 1.234144
H -1.605847 0.042458 -1.546263
H -1.030140 -1.499465 1.957004
H -1.708015 -3.104195 1.529819
H -0.126230 -2.587647 0.868229
H -2.653606 -3.474978 -0.942788
H -2.429610 -2.163223 -2.134589
H -1.010951 -3.040078 -1.504242
H -4.166733 -0.865451 -1.631651
H -6.399799 -0.437754 -2.062021
H -7.033798 0.984579 -1.178087
H -7.462018 -0.652393 -0.636703
H -4.789647 0.475515 1.899137
H -6.463842 -0.133552 1.763932
H -6.072658 1.509079 1.214116
H 1.006353 3.335592 -0.350578
H 1.018081 2.304972 1.143379
H 3.390859 3.132872 -1.906518
H 5.541202 1.423887 -1.709964
H 6.049537 -0.753434 -0.019179
H 5.104655 -0.680570 1.489093
H 4.193734 -2.271645 -1.035916
H 3.481050 -3.953313 0.635915
H 4.073062 -2.850871 2.022836


