%chk=000022415.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022415

0 1
 O   4.0000002E-03 -1.2400000E-02   1.579800    
 O    5.918600     -0.4074000     -0.8574000    
 O   -5.923000      0.4224000     -0.8496000    
 C   0.4962000      0.5541000      0.3644000    
 C  -0.5006000     -0.5606000      0.3554000    
 C   4.9300000E-02   1.956500      0.1596000    
 C  -4.4500001E-02  -1.962400      0.1337000    
 C    1.928500      0.3001000      4.1700002E-02
 C   -1.922400     -0.3029000      3.9400000E-02
 C   0.7060000       2.937900       1.135400    
 C  -0.6901000      -2.953000       1.104800    
 C    2.373400      0.3925000      -1.277100    
 C   -2.378000     -0.3714000      -1.283000    
 C    2.824700     -2.9999999E-02   1.058300    
 C   -2.828900      1.2500000E-02   1.059100    
 C    3.714200      0.1546000      -1.579300    
 C   -3.718800     -0.1283000      -1.581000    
 C    4.165500     -0.2677000      0.7562000    
 C   -4.169700      0.2556000      0.7612000    
 C    4.610300     -0.1755000     -0.5626000    
 C   -4.614600      0.1853000     -0.5589000    
 H   -1.031200       2.075900      0.2875000    
 H   0.2563000       2.281700     -0.8673000    
 H    1.037400      -2.077300      0.2513000    
 H  -0.2592000      -2.277800     -0.8947000    
 H   0.5067000       2.654000       2.173800    
 H    1.790800       2.977500      0.9960000    
 H   0.3114000       3.946400      0.9757000    
 H  -0.4823000      -2.679000       2.144200    
 H   -1.776000      -2.993100      0.9749000    
 H  -0.2954000      -3.959400      0.9323000    
 H    1.684700      0.6416000      -2.080200    
 H   -1.690900     -0.6077000      -2.091600    
 H    2.502500     -0.1012000       2.093600    
 H   -2.507400      6.7100003E-02   2.096000    
 H    4.047700      0.2281000      -2.611000    
 H   -4.059100     -0.1832000      -2.611500    
 H    4.859200     -0.5230000       1.552600    
 H   -4.857900      0.4975000       1.566700    
 H    6.049500     -0.3002000      -1.815300    
 H   -6.397500      0.6237000     -2.4700001E-02


%chk=000022415-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000022415

0 1
O 0.006647 -0.009989 1.639317
O 6.083696 -0.409276 -0.698835
O -6.079314 0.357548 -0.767195
C 0.506348 0.573141 0.328315
C -0.508041 -0.579148 0.328169
C 0.043744 2.009526 0.079587
C -0.048505 -2.012698 0.057578
C 1.963814 0.301416 0.039526
C -1.968780 -0.305324 0.060200
C 0.728962 3.016464 1.031149
C -0.724616 -3.031128 1.003394
C 2.499486 0.553528 -1.248232
C -2.521202 -0.537734 -1.227668
C 2.832462 -0.182600 1.051359
C -2.823837 0.157157 1.088905
C 3.863875 0.322118 -1.526503
C -3.886056 -0.308105 -1.487775
C 4.197689 -0.411111 0.790912
C -4.195540 0.384920 0.845459
C 4.713444 -0.159175 -0.500856
C -4.725042 0.151934 -0.446298
H -1.051603 2.064270 0.202053
H 0.262584 2.279419 -0.972948
H 1.047899 -2.069636 0.168947
H -0.278049 -2.269601 -0.995959
H 0.506326 2.762126 2.082743
H 1.826175 3.012109 0.903060
H 0.365263 4.042110 0.839598
H -0.491585 -2.789764 2.055816
H -1.822952 -3.025879 0.885355
H -0.362281 -4.054089 0.795908
H 1.850786 0.927373 -2.048965
H -1.879982 -0.896030 -2.041574
H 2.417360 -0.378537 2.044995
H -2.397637 0.337969 2.080680
H 4.260105 0.516233 -2.532010
H -4.316579 -0.478943 -2.478894
H 4.873587 -0.779848 1.568116
H -4.845230 0.739489 1.656668
H 6.349486 -0.202060 -1.628955
H -6.583508 0.673325 0.023257


