%chk=000002881.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002881

-2 1
 O   -2.004000      -2.392800      0.7793000    
 O    1.056700      -2.969500     -0.6442000    
 O   -2.006600      -4.936400     -0.3547000    
 O   -2.448300       2.435300      0.8284000    
 O    3.223700       1.362000     -0.8746000    
 O   -2.736300      -1.001000      -1.349500    
 O    2.284400      -1.871100       1.427500    
 O   -2.999700       4.755600     -0.3412000    
 O    4.602300       3.359300      0.2053000    
 O   -3.466300       3.732500      -2.333600    
 O    4.702600       2.301800       2.231400    
 C  -0.7849000      -4.344000      9.2900001E-02
 C   -1.113000      -3.404300       1.245700    
 C  -0.1483000      -3.595500      -1.072500    
 C   -1.944000      -1.181300       1.398800    
 C    1.431300      -1.833800      -1.311300    
 C   -2.242700      1.5000000E-02  0.7428000    
 C    2.154500     -0.8137000     -0.6982000    
 C   -2.165400       1.231000       1.424000    
 C    2.511500      0.3243000      -1.423600    
 C   -1.566700      -1.152900       2.742100    
 C    1.063000      -1.719900      -2.649000    
 C   -2.643900      1.5500000E-02 -0.6752000    
 C    2.554900     -0.9132000      0.7165000    
 C   -1.787900       1.255900       2.766700    
 C    2.143700      0.4413000      -2.764000    
 C   -1.488700      6.2399998E-02   3.424500    
 C    1.419100     -0.5823000      -3.375400    
 C   -2.937700       1.335300      -1.269100    
 C    3.319300      0.2279000       1.259400    
 C   -2.822300       2.420300     -0.4971000    
 C    3.591500       1.254800      0.4485000    
 C   -3.125200       3.765000      -1.116700    
 C    4.373700       2.416500       1.016000    
 H  -0.1159000      -5.137900      0.4433000    
 H   -1.620400      -3.964700       2.040100    
 H  -0.1758000      -2.990400       1.635200    
 H   8.1299998E-02  -4.314400      -1.869300    
 H  -0.8787000      -2.882000      -1.473500    
 H   -1.357500      -2.052000       3.313900    
 H   0.5319000      -2.499300      -3.186600    
 H   -1.726100       2.197100       3.305900    
 H    2.418100       1.322400      -3.337400    
 H   -1.202200      7.8800000E-02   4.472100    
 H    1.138700     -0.4968000      -4.421400    
 H   -2.381600      -5.433400      0.3923000    
 H   -3.233100       1.344400      -2.311300    
 H    3.617300      0.1628000       2.298900    


%chk=000002881-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000002881

-2 1
O -1.667069 -0.593036 0.515217
O 1.512027 -1.818627 -0.629346
O -1.983747 -2.999870 -0.779789
O -5.949139 1.636662 1.180118
O 6.242548 -0.634794 -0.877996
O -3.767188 -0.993267 -1.234997
O 3.049209 -1.665255 1.633308
O -8.380456 2.588717 0.394027
O 8.783095 -0.381169 0.080214
O -8.111522 1.604193 -1.728232
O 8.073457 -1.017017 2.231970
C -0.699801 -2.645285 -0.208548
C -0.836016 -1.721188 1.014151
C 0.204303 -2.013237 -1.287027
C -2.567730 0.034278 1.364065
C 2.593357 -1.353133 -1.365435
C -3.847226 0.379114 0.809680
C 3.835235 -1.192341 -0.652688
C -4.700221 1.183688 1.623463
C 4.963497 -0.787796 -1.427251
C -2.225113 0.382472 2.688338
C 2.502713 -1.066210 -2.747971
C -4.356495 -0.104893 -0.507046
C 4.008514 -1.402491 0.823298
C -4.358705 1.567025 2.941971
C 4.888520 -0.507675 -2.813811
C -3.128639 1.142393 3.471404
C 3.651098 -0.640615 -3.459327
C -5.629597 0.473695 -0.912538
C 5.390517 -1.265621 1.288952
C -6.391733 1.299728 -0.109501
C 6.450953 -0.901375 0.488799
C -7.771596 1.898840 -0.510445
C 7.922083 -0.746032 0.970949
H -0.223805 -3.585697 0.126712
H -1.375592 -2.234217 1.832220
H 0.155634 -1.366303 1.349742
H 0.291722 -2.707780 -2.144852
H -0.206953 -1.042387 -1.626625
H -1.244020 0.100639 3.083611
H 1.548283 -1.169934 -3.270822
H -5.066346 2.178098 3.508423
H 5.798591 -0.195389 -3.332550
H -2.850531 1.422840 4.493604
H 3.567148 -0.418757 -4.529545
H -2.565176 -2.170228 -0.907877
H -6.048549 0.228001 -1.890096
H 5.616762 -1.444163 2.342178


