%chk=000065018.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065018

0 1
 O   -1.714700       1.735000     -0.5305000    
 O    1.705600       1.733300      0.5301000    
 O    1.168100       3.621700      -1.686900    
 O   -1.048300       3.705400       1.722300    
 O   -1.053400       4.069800      -1.781500    
 O    1.190400       4.076800       1.715100    
 O   -1.275700     -0.5266000     -0.7044000    
 O    1.259700     -0.5213000      0.7657000    
 O   -7.782200      -3.873000      0.7368000    
 O    7.733900      -3.917200     -0.7046000    
 O   -9.599600      -1.826000      0.2590000    
 O    9.563500      -1.863900     -0.3063000    
 C  -0.3377000       2.034400     -0.6808000    
 C   0.3268000       2.040700      0.6968000    
 C  -0.1325000       3.344300      -1.425400    
 C   0.2326000       3.375700       1.415700    
 C   -2.046200      0.4094000     -0.5613000    
 C    2.029600      0.4092000      0.5874000    
 C   -5.529800      -1.156900     -0.2190000    
 C    5.503700      -1.173600      0.2240000    
 C   -3.512700      0.2969000     -0.3920000    
 C    3.492800      0.2889000      0.3961000    
 C   -4.086300     -0.9148000     -0.3892000    
 C    4.063800     -0.9240000      0.4126000    
 C   -5.983800      -2.413000      0.1833000    
 C    5.948100      -2.440000     -0.1559000    
 C   -6.442300     -0.1299000     -0.4602000    
 C    6.422300     -0.1434000      0.4253000    
 C   -7.350300      -2.642000      0.3448000    
 C    7.311300      -2.676200     -0.3349000    
 C   -7.808800     -0.3591000     -0.2991000    
 C    7.785300     -0.3797000      0.2467000    
 C   -8.262900      -1.615000      0.1035000    
 C    8.229900      -1.646000     -0.1335000    
 H   0.1261000       1.283300      -1.335400    
 H  -0.1397000       1.314700       1.376300    
 H   -4.064500       1.219500     -0.2548000    
 H    4.044500       1.206400      0.2276000    
 H   -3.477200      -1.808400     -0.5055000    
 H    3.454900      -1.813000      0.5604000    
 H   -5.275200      -3.216400      0.3735000    
 H    5.234800      -3.245900     -0.3149000    
 H   -6.136600      0.8572000     -0.7941000    
 H    6.124300      0.8521000      0.7408000    
 H   -8.509600      0.4484000     -0.4944000    
 H    8.491000      0.4304000      0.4108000    
 H    1.271500       4.464300      -2.178400    
 H   -1.101900       4.562700       2.196100    
 H   -7.012900      -4.455900      0.8565000    
 H    6.961500      -4.501000     -0.7972000    
 H   -10.07640      -1.004600      4.9300000E-02
 H    10.04540      -1.038800     -0.1244000    


%chk=000065018-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065018

0 1
O -1.800784 1.501021 -0.096922
O 1.808695 1.489588 0.084334
O 0.548077 3.913627 -1.479075
O -0.523747 3.928456 1.448276
O -1.737080 3.672197 -1.854472
O 1.759987 3.675033 1.824539
O -1.988134 0.091647 -1.967828
O 1.988956 0.096638 1.968207
O -8.752468 -3.318484 -1.630553
O 8.732598 -3.357143 1.657558
O -9.898040 -2.291356 0.585217
O 9.881433 -2.359338 -0.569660
C -0.491526 1.934479 -0.599309
C 0.502496 1.935763 0.583496
C -0.678874 3.255864 -1.354227
C 0.698834 3.261757 1.328033
C -2.495977 0.568507 -0.922835
C 2.498777 0.560510 0.918346
C -5.997381 -0.995861 -0.499620
C 5.989969 -1.029605 0.506576
C -3.810250 0.285515 -0.339664
C 3.810681 0.263797 0.336664
C -4.659296 -0.606342 -0.943212
C 4.654813 -0.627540 0.947813
C -6.718264 -1.955611 -1.270263
C 6.706013 -1.985881 1.286023
C -6.620600 -0.466198 0.664936
C 6.614879 -0.515446 -0.664007
C -8.009071 -2.380585 -0.905636
C 7.993824 -2.422186 0.924179
C -7.909839 -0.885465 1.035639
C 7.901137 -0.946128 -1.032001
C -8.617242 -1.839677 0.264581
C 8.603766 -1.896724 -0.252165
H -0.129427 1.190040 -1.339807
H 0.135562 1.199651 1.329913
H -4.058058 0.826480 0.577633
H 4.060904 0.794481 -0.585947
H -4.289165 -1.079417 -1.865127
H 4.282787 -1.089464 1.874605
H -6.250402 -2.372225 -2.172952
H 6.236707 -2.390464 2.193418
H -6.101541 0.273803 1.280987
H 6.099444 0.221373 -1.286868
H -8.382054 -0.470357 1.935525
H 8.374666 -0.542999 -1.936617
H 0.431120 4.744307 -2.013882
H -0.401156 4.762448 1.976625
H -8.245024 -3.627783 -2.422136
H 8.224406 -3.655581 2.452826
H -10.226696 -1.852885 1.409992
H 10.211765 -1.931339 -1.399257


