%chk=000075565.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075565

0 1
 O   0.2982000      -2.368200     -0.8771000    
 O  -0.2958000       2.368400     -0.8774000    
 O    4.525600      -1.229900       1.026000    
 O   -4.523400       1.230900       1.025800    
 C   0.1489000      -1.178100      -1.569400    
 C  -0.1492000       1.198700      -1.557500    
 C    1.158900      -2.383300      0.1771000    
 C   -1.171600       2.384000      0.1953000    
 C   1.2000001E-03   0.000000     -0.8599000    
 C    3.276900      -1.817300       1.142300    
 C   -3.296000       1.808100       1.140100    
 C    2.416700      -1.791400      5.9599999E-02
 C   -2.414200       1.792100      5.9400000E-02
 C   0.1514000      -1.198600      -2.952400    
 C  -0.1491000       1.198500      -2.952400    
 C   1.0000000E-03 -1.9999999E-04  -3.649800    
 C   0.7832000      -2.990800       1.375300    
 C  -0.7807000       2.991500       1.374800    
 C    2.922500      -2.414600       2.338500    
 C   -2.920100       2.415800       2.338100    
 C    1.665000      -3.006300       2.455900    
 C   -1.662500       3.007400       2.455400    
 C    4.595400     -2.0999999E-03  0.4430000    
 C   -4.594300     -1.8500000E-02  0.4330000    
 C    3.682200      0.9912000      0.7969000    
 C    5.580100      0.2629000     -0.5088000    
 C   -3.679900     -0.9902000      0.7973000    
 C   -5.577700     -0.2622000     -0.5087000    
 C    3.753500       2.249300      0.1987000    
 C    5.651300       1.521100      -1.106800    
 C   -3.751000      -2.248400      0.1995000    
 C   -5.648900      -1.520500      -1.106400    
 C    4.738000       2.514200     -0.7530000    
 C   -4.735500      -2.513600     -0.7523000    
 H   7.9999998E-04 -3.5999999E-03  0.2265000    
 H    2.730800      -1.360500     -0.8872000    
 H   -2.722000       1.362700     -0.8902000    
 H   0.2686000      -2.131000      -3.496400    
 H  -0.2660000       2.129000      -3.501200    
 H  -0.1958000      -3.452100       1.472900    
 H   0.1986000       3.451200       1.467600    
 H   8.9999998E-04 -3.0000001E-04  -4.735800    
 H    3.607700      -2.426900       3.180600    
 H   -3.602400       2.430800       3.183500    
 H    1.372100      -3.478700       3.389000    
 H   -1.369400       3.479900       3.388300    
 H    2.918000      0.8208000       1.550600    
 H    6.293900     -0.5070000     -0.7889000    
 H   -2.917700     -0.8161000       1.551300    
 H   -6.288800      0.5102000     -0.7857000    
 H    3.044200       3.023500      0.4765000    
 H    6.417700       1.727400      -1.848100    
 H   -3.041700      -3.022600      0.4775000    
 H   -6.415400      -1.726900      -1.847700    
 H    4.793600       3.494000      -1.218300    
 H   -4.791200      -3.493400      -1.217300    


%chk=000075565-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075565

0 1
O 0.410924 -2.447605 -1.965812
O -0.411504 2.450901 -1.962294
O 3.730106 -1.312486 1.533344
O -3.727668 1.310450 1.538006
C 0.244981 -1.185751 -2.588599
C -0.245243 1.189958 -2.586812
C 0.998209 -2.587900 -0.684663
C -0.997635 2.589237 -0.680367
C -0.000134 0.001558 -1.861851
C 2.626462 -2.037092 1.026853
C -2.624497 2.035837 1.031627
C 2.044685 -1.753970 -0.230541
C -2.043758 1.754625 -0.226664
C 0.243088 -1.201071 -4.000495
C -0.243262 1.207370 -3.998699
C -0.000059 0.003680 -4.694476
C 0.550654 -3.692854 0.073679
C -0.549453 3.693039 0.079235
C 2.199872 -3.134283 1.808194
C -2.197276 3.131897 1.814245
C 1.167234 -3.960814 1.315515
C -1.165054 3.959166 1.321968
C 3.910351 0.063709 1.226012
C -3.908279 -0.065219 1.228600
C 2.837051 0.984056 1.200179
C 5.244111 0.491090 1.051866
C -2.835114 -0.985652 1.200554
C -5.242206 -0.492175 1.054671
C 3.112904 2.351276 0.977707
C 5.505261 1.862503 0.837579
C -3.111271 -2.352475 0.976014
C -5.503663 -1.863202 0.838315
C 4.443041 2.796206 0.794366
C -4.441578 -2.796955 0.792836
H -0.000147 0.000732 -0.769407
H 2.418792 -0.931917 -0.846710
H -2.418348 0.933534 -0.843822
H 0.426405 -2.143240 -4.523522
H -0.426592 2.150314 -4.520326
H -0.245150 -4.326513 -0.327660
H 0.246023 4.327300 -0.321796
H -0.000024 0.004512 -5.789330
H 2.682594 -3.323194 2.770576
H -2.679227 3.319361 2.777298
H 0.833908 -4.818513 1.909115
H -0.831266 4.815991 1.916569
H 1.809593 0.645534 1.367505
H 6.048886 -0.249089 1.089179
H -1.807501 -0.647556 1.367789
H -6.046867 0.248038 1.093739
H 2.281673 3.064193 0.957402
H 6.538779 2.199073 0.701137
H -2.280129 -3.065446 0.953967
H -6.537313 -2.199427 0.702029
H 4.649856 3.857891 0.623459
H -4.648625 -3.858333 0.620310


