%chk=000022534.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022534

0 1
 O   -4.327300      0.7996000     -7.7200003E-02
 O    6.494700      0.3900000      0.8049000    
 O   -5.787400     -0.4939000       1.160600    
 C   -1.052700     -0.7988000      7.8400001E-02
 C   -1.891400      0.4535000     -0.2500000    
 C   0.3709000     -0.7178000     -0.4818000    
 C    1.085900      0.5246000      0.1349000    
 C   -1.225500       1.659800      0.4226000    
 C   -3.233300      2.5900001E-02  0.3758000    
 C   0.2401000       1.817600     -1.8300001E-02
 C   -1.956300      -1.951400     -0.3525000    
 C    1.196900      -2.012200     -0.2821000    
 C    2.525500      0.6991000     -0.4434000    
 C   -3.376200      -1.455500     -2.3900000E-02
 C    2.579300      -1.826800     -0.9245000    
 C   -2.071200      0.7402000      -1.762600    
 C    3.306400     -0.6072000     -0.4123000    
 C    3.268400       1.828100      0.3016000    
 C    1.329200      -2.471800       1.175400    
 C    4.758900       1.839900      1.0800000E-02
 C    4.581500     -0.7102000     -4.6999999E-03
 C    5.362100      0.4996000      0.3411000    
 C   -5.561000      0.4323000      0.3939000    
 C   -6.617700       1.335500     -0.1665000    
 H  -0.9653000     -0.8676000       1.174800    
 H   0.3076000     -0.5643000      -1.567300    
 H    1.177500      0.3512000       1.216800    
 H   -1.247900       1.541400       1.513700    
 H   -1.778500       2.580700      0.2018000    
 H   -3.173200      0.1077000       1.470300    
 H   0.2784000       2.159800      -1.059000    
 H   0.6780000       2.622000      0.5837000    
 H   -1.725600      -2.878900      0.1808000    
 H   -1.862100      -2.154800      -1.425000    
 H   0.6959000      -2.823700     -0.8267000    
 H    2.439300      0.9893000      -1.500200    
 H   -4.039400      -1.599200     -0.8844000    
 H   -3.789200      -2.039900      0.8059000    
 H    2.455400      -1.713700      -2.010100    
 H    3.175100      -2.737400     -0.7823000    
 H   -1.122200      0.9065000      -2.278800    
 H   -2.578800     -7.6499999E-02  -2.285500    
 H   -2.675200       1.642600      -1.914100    
 H    3.121100       1.715600       1.384300    
 H    2.852300       2.802600      2.2399999E-02
 H    1.926900      -3.388500       1.231200    
 H    1.815900      -1.724900       1.808800    
 H   0.3527000      -2.700900       1.611800    
 H    5.244300       2.605800      0.6253000    
 H    4.958400       2.064100      -1.042500    
 H    5.105800      -1.659200      1.9500000E-02
 H   -6.628600       1.259600      -1.256600    
 H   -6.427800       2.365300      0.1463000    
 H   -7.596200       1.029500      0.2144000    


%chk=000022534-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022534

0 1
O -4.403528 0.718288 -0.197814
O 6.630068 0.506205 0.776461
O -5.688735 0.000564 1.614773
C -1.054586 -0.886657 0.009482
C -1.926580 0.367656 -0.328280
C 0.389305 -0.765323 -0.511923
C 1.058518 0.492167 0.129734
C -1.290044 1.597274 0.358741
C -3.265061 -0.116879 0.283098
C 0.194009 1.772867 -0.062052
C -1.933985 -2.089444 -0.429185
C 1.241908 -2.049139 -0.284808
C 2.519111 0.717795 -0.398433
C -3.399635 -1.611884 -0.139192
C 2.645145 -1.821323 -0.912086
C -2.097231 0.613484 -1.850976
C 3.335024 -0.575966 -0.387828
C 3.232459 1.851009 0.387430
C 1.360161 -2.495774 1.192218
C 4.747072 1.925281 0.101718
C 4.644019 -0.617393 0.021418
C 5.434193 0.584132 0.357638
C -5.570234 0.687745 0.574778
C -6.625842 1.589771 -0.029248
H -0.993031 -0.920345 1.121241
H 0.351598 -0.609939 -1.613785
H 1.130331 0.302718 1.223454
H -1.343050 1.465471 1.460079
H -1.855119 2.518719 0.117462
H -3.242338 -0.031924 1.386824
H 0.247138 2.086548 -1.125012
H 0.626288 2.603080 0.526870
H -1.682798 -3.011956 0.123479
H -1.793539 -2.307647 -1.504771
H 0.756379 -2.873158 -0.847429
H 2.425144 1.030649 -1.466353
H -4.032219 -1.682807 -1.042603
H -3.890608 -2.200068 0.653261
H 2.513424 -1.703835 -2.010463
H 3.290359 -2.706552 -0.759648
H -1.142205 0.879253 -2.334349
H -2.501265 -0.271850 -2.372722
H -2.805329 1.444068 -2.013727
H 3.078302 1.676197 1.471998
H 2.769066 2.825322 0.149882
H 1.929916 -3.441277 1.258316
H 1.893601 -1.750281 1.809278
H 0.369441 -2.672305 1.647829
H 5.241743 2.701437 0.711681
H 4.918514 2.191447 -0.962642
H 5.186663 -1.571180 0.057211
H -6.859004 1.265280 -1.058213
H -6.251961 2.626584 -0.089079
H -7.536577 1.558193 0.585769


