%chk=000167969.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167969

0 1
 O   -3.976700      0.9091000      -2.094000    
 O   -3.422300     -0.5764000       1.868300    
 O   0.1026000       3.124800      0.2754000    
 O   -3.624400      -2.595600      0.7646000    
 O    1.659900      -2.598700     -0.5405000    
 O    2.568000       2.591800      0.3430000    
 O    4.161100      -3.133700     -0.4920000    
 O    5.103700       2.224500      0.4175000    
 C   -4.131400      0.5036000     -0.7248000    
 C   -3.066900     -0.5853000     -0.4490000    
 C   -3.916800       1.720200      0.1858000    
 C   -1.659900     -3.1800002E-02 -0.3063000    
 C   -2.535700       2.341200     -1.6899999E-02
 C   -1.418500       1.331500     -6.4700000E-02
 C   -5.565500     -2.4400000E-02 -0.5908000    
 C  -0.5697000     -0.9172000     -0.3907000    
 C  -9.6500002E-02   1.786900      7.1999997E-02
 C   -3.404100      -1.392000      0.7760000    
 C   0.7434000     -0.4557000     -0.2435000    
 C   0.9801000      0.8968000     -1.2200000E-02
 C   -5.781300      -1.245200      -1.459800    
 C    1.868200      -1.409100     -0.3368000    
 C    2.360000       1.401800      0.1408000    
 C    3.248600     -0.9063000     -0.1827000    
 C    3.485800      0.4502000      4.7699999E-02
 C    4.323800      -1.798600     -0.2690000    
 C    4.798600      0.9148000      0.1920000    
 C   -3.732000      -1.217700       3.109700    
 C    5.630500      -1.331600     -0.1245000    
 C    5.867300      2.2299999E-02  0.1055000    
 H   -3.033500      -1.279400      -1.300500    
 H   -4.083200       1.495600       1.242000    
 H   -4.655400       2.494300     -6.4300001E-02
 H   -2.369200       3.056800      0.7975000    
 H   -2.524900       2.906800     -0.9573000    
 H   -6.273100      0.7498000     -0.9143000    
 H   -5.812400     -0.2624000      0.4499000    
 H  -0.7626000      -1.972800     -0.5716000    
 H   -3.858200      0.1228000      -2.651500    
 H   -5.626000      -1.032100      -2.521600    
 H   -5.164000      -2.101700      -1.186600    
 H   -6.822700      -1.572900      -1.359900    
 H    1.033100       3.360600      0.1469000    
 H   -3.714200     -0.4596000       3.897000    
 H   -2.982100      -1.980700       3.338900    
 H   -4.732800      -1.658100       3.068200    
 H    6.470400      -2.018300     -0.1902000    
 H    6.893000      0.3654000      0.2149000    
 H    3.222700      -3.358400     -0.5758000    
 H    6.068200       2.328700      0.4855000    


%chk=000167969-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167969

0 1
O -3.850030 0.975643 -2.140251
O -3.220604 -0.689370 2.026223
O 0.090059 3.190606 0.201409
O -3.932955 -2.555538 0.837544
O 1.674823 -2.666390 -0.459867
O 2.546967 2.748660 0.286374
O 4.110857 -3.162097 -0.398237
O 5.170676 2.291489 0.370720
C -4.149873 0.503202 -0.767657
C -3.076957 -0.591014 -0.400859
C -3.958152 1.749646 0.118024
C -1.665187 -0.012915 -0.277898
C -2.569460 2.382084 -0.083060
C -1.446179 1.371553 -0.099097
C -5.605204 -0.026288 -0.692506
C -0.568701 -0.911342 -0.342399
C -0.100612 1.842856 0.028535
C -3.457405 -1.396049 0.848237
C 0.753736 -0.450296 -0.214395
C 1.013234 0.942138 -0.021574
C -5.929508 -1.227695 -1.609289
C 1.880484 -1.390537 -0.281432
C 2.378403 1.469919 0.116002
C 3.250900 -0.877637 -0.143816
C 3.516092 0.527335 0.053392
C 4.327260 -1.823268 -0.211900
C 4.870084 0.945381 0.178175
C -3.540066 -1.410264 3.284441
C 5.670234 -1.370571 -0.083810
C 5.927592 -0.013254 0.107079
H -3.079151 -1.343574 -1.212231
H -4.096662 1.455332 1.173225
H -4.739762 2.487099 -0.139147
H -2.366038 3.146060 0.688781
H -2.549547 2.918985 -1.051434
H -6.266058 0.823239 -0.952083
H -5.835683 -0.296397 0.356830
H -0.729846 -1.984458 -0.492476
H -4.040983 0.244027 -2.781230
H -5.755948 -0.995157 -2.678728
H -5.343527 -2.122893 -1.338191
H -6.997682 -1.493173 -1.517553
H 1.127678 3.329818 0.277114
H -3.271109 -0.706955 4.084380
H -2.945036 -2.336160 3.349537
H -4.612569 -1.665711 3.318068
H 6.476217 -2.106843 -0.139072
H 6.966068 0.329673 0.205212
H 3.069659 -3.283895 -0.468623
H 6.152470 2.419597 0.436813


