%chk=000073631.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073631

0 1
 O  -0.1430000       2.817000     -0.8064000    
 O   -1.321700     -0.8807000      0.3563000    
 O   -2.454100      0.8518000     -0.7616000    
 O    1.611900     -0.2550000      0.1113000    
 O    3.186100       1.294200     -0.8177000    
 O  -0.9643000       3.447100       1.320200    
 C  -0.6720000      0.3670000      0.6282000    
 C   0.5114000      0.5450000     -0.3234000    
 C   -1.763700       1.389900      0.3731000    
 C   0.9335000       2.009200     -0.3454000    
 C   -1.265500       2.804800      8.3600000E-02
 C    2.141600       2.160200      -1.260900    
 C   -2.317300     -0.5725000     -0.6336000    
 C    2.742600     -6.7900002E-02 -0.7522000    
 C   -3.651500      -1.192800     -0.2993000    
 C    3.879100     -0.9045000     -0.2186000    
 C  -0.4946000       4.770800       1.114700    
 C   -4.527600      -1.563400      -1.321800    
 C   -4.014500      -1.398700       1.033400    
 C    4.801800      -1.475300      -1.097800    
 C    4.012200      -1.110300       1.156300    
 C   -5.761000      -2.137000      -1.013000    
 C   -5.247900      -1.972500       1.342100    
 C    5.852700      -2.248500     -0.6045000    
 C    5.063300      -1.883500       1.649400    
 C   -6.121000      -2.341600      0.3188000    
 C    5.983400      -2.452600      0.7690000    
 H  -0.3343000      0.3706000       1.670200    
 H   0.2249000      0.2117000      -1.330200    
 H   -2.475100       1.399500       1.208800    
 H    1.245000       2.319200      0.6616000    
 H   -2.066700       3.364900     -0.4138000    
 H    1.891100       1.938200      -2.305600    
 H    2.511300       3.190800      -1.238600    
 H   -1.957900     -0.9661000      -1.591700    
 H    2.476800     -0.4175000      -1.759300    
 H  -0.3862000       5.247100       2.093300    
 H   -1.211600       5.353400      0.5277000    
 H   0.4854000       4.775500      0.6288000    
 H   -4.259300      -1.407500      -2.363300    
 H   -3.355700      -1.112400       1.848600    
 H    4.712300      -1.322000      -2.170000    
 H    3.317800     -0.6669000       1.864900    
 H   -6.441200      -2.423800      -1.809600    
 H   -5.529500      -2.130100       2.379100    
 H    6.569800      -2.691000      -1.289800    
 H    5.167400      -2.039900       2.719100    
 H   -7.081600      -2.787700      0.5592000    
 H    6.802300      -3.053800       1.153200    


%chk=000073631-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000073631

0 1
O -0.048777 2.704743 -1.241257
O -1.264142 -1.102586 -0.181107
O -2.426037 0.624387 -1.298936
O 1.724447 -0.318128 0.077132
O 3.366581 1.313675 -0.654220
O -1.245227 3.388894 0.742050
C -0.659068 0.197226 0.218663
C 0.633775 0.445408 -0.558157
C -1.765165 1.237033 -0.119208
C 1.005176 1.944402 -0.541175
C -1.315650 2.655996 -0.510805
C 2.326944 2.147267 -1.293413
C -2.488392 -0.805355 -0.964968
C 2.973906 -0.099456 -0.666397
C -3.746138 -1.166715 -0.178070
C 4.071379 -0.928922 -0.035191
C -1.029821 4.833595 0.557613
C -4.983356 -0.571291 -0.529309
C -3.699901 -2.128927 0.858901
C 5.412580 -0.477368 -0.059538
C 3.761093 -2.185887 0.538388
C -6.163795 -0.931232 0.158003
C -4.882957 -2.489074 1.543637
C 6.438199 -1.280485 0.487328
C 4.789625 -2.986010 1.083325
C -6.116906 -1.893204 1.194441
C 6.130831 -2.537517 1.057508
H -0.441424 0.150078 1.298956
H 0.502684 0.123597 -1.614234
H -2.486254 1.314411 0.715788
H 1.104674 2.292222 0.505551
H -2.043435 3.109750 -1.211834
H 2.202040 1.863410 -2.360426
H 2.687300 3.184716 -1.226715
H -2.422426 -1.345729 -1.925846
H 2.781504 -0.387480 -1.730570
H -0.999040 5.260717 1.571009
H -1.866521 5.282941 -0.014640
H -0.078687 5.031183 0.030409
H -5.010171 0.180250 -1.326106
H -2.736648 -2.574290 1.126573
H 5.638324 0.502330 -0.490469
H 2.718587 -2.517073 0.568459
H -7.116874 -0.463053 -0.112779
H -4.841178 -3.231436 2.348625
H 7.474526 -0.924667 0.470120
H 4.544416 -3.956314 1.529598
H -7.033349 -2.173480 1.726023
H 6.927649 -3.160148 1.480075


