%chk=000101202.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101202

0 1
 O   -2.792800      -1.057300       1.057700    
 O   -1.182100      -1.987200       2.373000    
 O    4.505400       1.632700     -0.9115000    
 O    5.167400     -0.3046000      0.1693000    
 O   -5.371100       2.015900      -1.227800    
 C  -0.5820000      -1.098500      0.1705000    
 C   0.6573000     -0.3270000      0.7392000    
 C    1.824800     -8.2699999E-02 -0.2871000    
 C  -9.7099997E-02  -2.442800     -0.4609000    
 C    2.223500      -1.463000     -0.8653000    
 C    1.046800      -2.235000      -1.464200    
 C   -1.490400     -0.2577000     -0.7287000    
 C   0.3290000      0.9703000       1.510100    
 C   -1.513300      -1.440200       1.330400    
 C    2.988100      0.5833000      0.4517000    
 C   -2.909000     -0.5814000     -0.2906000    
 C    1.457200      0.8724000      -1.445300    
 C    1.544900       1.438100       2.316200    
 C   -1.196100      -3.287300      -1.118400    
 C    2.854500       1.253300       1.608800    
 C   -3.850000      0.5837000     -0.4063000    
 C    4.351400      0.5601000     -9.7099997E-02
 C   -4.085400       1.583900      0.5646000    
 C   -4.654100      0.8890000      -1.477700    
 C   -5.019300       2.432500      1.7000001E-02
 C    5.792200       1.749600      -1.527600    
 H    1.074400      -1.005100       1.505100    
 H   0.3074000      -3.061700      0.3542000    
 H    2.677200      -2.076900     -7.5099997E-02
 H    2.992200      -1.347400      -1.640400    
 H   0.6787000      -1.724200      -2.361200    
 H    1.415200      -3.211700      -1.803400    
 H   -1.362800     -0.4581000      -1.797500    
 H   -1.300400      0.8128000     -0.6023000    
 H  -0.5078000      0.8252000       2.202000    
 H   2.5699999E-02   1.769800      0.8263000    
 H   -3.315300      -1.411400     -0.8811000    
 H    2.292300      0.9852000      -2.147300    
 H   0.6197000      0.5129000      -2.043300    
 H    1.201200       1.876000      -1.089300    
 H    1.589000      0.8810000       3.260100    
 H    1.416800       2.494800       2.577000    
 H  -0.7895000      -4.250300      -1.447800    
 H   -2.007300      -3.505700     -0.4174000    
 H   -1.618400      -2.795200      -1.999600    
 H    3.722200       1.704200       2.085500    
 H   -3.633000       1.681600       1.541200    
 H   -4.824600      0.4320000      -2.441800    
 H   -5.509200       3.330000      0.3653000    
 H    6.569200       1.855900     -0.7646000    
 H    5.789200       2.646000      -2.153300    
 H    5.988800      0.8794000      -2.161300    


%chk=000101202-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101202

0 1
O -2.823144 -1.229679 0.919926
O -1.149784 -2.101577 2.255158
O 4.503415 0.753155 -1.244228
O 5.331280 1.188726 0.876963
O -5.770484 1.811893 -0.783995
C -0.545348 -1.056146 0.058754
C 0.638196 -0.266157 0.721221
C 1.820116 0.105866 -0.252753
C 0.028363 -2.362925 -0.611298
C 2.319411 -1.231709 -0.891366
C 1.183954 -2.020533 -1.577820
C -1.488672 -0.222049 -0.852078
C 0.189052 0.951874 1.561556
C -1.478270 -1.523390 1.203871
C 2.928560 0.756057 0.610564
C -2.943479 -0.610457 -0.455450
C 1.427764 1.117151 -1.374587
C 1.334971 1.349309 2.516085
C -1.043955 -3.239806 -1.294507
C 2.685416 1.286928 1.849505
C -3.920505 0.522420 -0.397930
C 4.348031 0.907694 0.144830
C -3.789751 1.761899 0.352993
C -5.131945 0.594484 -1.064458
C -4.922283 2.509095 0.100269
C 5.885238 0.941977 -1.746717
H 1.068020 -0.993649 1.445460
H 0.460048 -2.951538 0.226277
H 2.761676 -1.862114 -0.092259
H 3.120949 -1.015335 -1.616302
H 0.794170 -1.459380 -2.451758
H 1.595357 -2.966001 -1.983742
H -1.325192 -0.411996 -1.925849
H -1.339901 0.856067 -0.683587
H -0.713584 0.709166 2.153052
H -0.066149 1.810185 0.910605
H -3.333783 -1.412959 -1.106523
H 2.330535 1.399437 -1.941049
H 0.705419 0.687949 -2.088300
H 0.991568 2.041602 -0.955942
H 1.343299 0.672135 3.397221
H 1.178998 2.366517 2.928503
H -0.587360 -4.180950 -1.651761
H -1.860168 -3.512250 -0.600512
H -1.486212 -2.738420 -2.176816
H 3.539525 1.710234 2.396103
H -2.970434 2.038807 1.013940
H -5.665490 -0.075114 -1.733373
H -5.285782 3.477911 0.429384
H 6.241175 1.958965 -1.511337
H 5.811741 0.787239 -2.832674
H 6.566129 0.208592 -1.283270


