%chk=000171197.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171197

0 1
 O   -5.422700      0.9729000      0.8770000    
 O   -2.609900      -2.869600       1.073100    
 O  -0.6996000       2.751300      0.5051000    
 O  -0.2459000      -2.724300     -1.6000001E-02
 O   -4.568900     -0.7167000      -1.805600    
 O    2.248200      -2.407700     -0.2172000    
 O    1.808700       2.890500      0.3144000    
 O    4.798200      -2.262000     -0.4307000    
 C   -4.259200      0.4019000      0.2838000    
 C   -4.072300     -0.9993000      0.8510000    
 C   -3.047400       1.285900      0.5870000    
 C   -2.821500      -1.687300      0.3008000    
 C   -1.713300      0.6022000      0.4054000    
 C   -1.598300     -0.7954000      0.3004000    
 C  -0.5546000       1.396900      0.3808000    
 C  -0.3253000      -1.365100      0.1206000    
 C   -4.574800      0.3452000      -1.184900    
 C   0.7084000      0.8165000      0.2219000    
 C   0.8227000     -0.5644000      8.6900003E-02
 C    2.147500      -1.193300     -9.3500003E-02
 C    1.909800       1.675800      0.1939000    
 C   -4.900700       1.651000      -1.858000    
 C    3.350200     -0.3360000     -0.1214000    
 C    3.235400       1.048700      1.7700000E-02
 C    4.612100     -0.9188000     -0.2885000    
 C    4.382500       1.850800     -1.0300000E-02
 C    5.752700     -0.1157000     -0.3164000    
 C    5.638100       1.266100     -0.1774000    
 H   -4.951300      -1.632300      0.6660000    
 H   -4.015900     -0.9409000       1.948100    
 H   -3.106200       1.617700       1.633300    
 H   -3.116600       2.194800     -1.6100001E-02
 H   -2.989100      -2.025800     -0.7257000    
 H   -6.158400      0.3444000      0.7780000    
 H   -2.246400      -2.605300       1.935800    
 H   -5.536900       2.278200      -1.230100    
 H   -3.979100       2.180600      -2.109500    
 H   -5.448100       1.446200      -2.783300    
 H   -1.412600       3.054100     -7.9300001E-02
 H   -1.119300      -3.125300     -0.1396000    
 H    4.319700       2.930500      9.5799997E-02
 H    6.735900     -0.5604000     -0.4460000    
 H    6.527500       1.889200     -0.1992000    
 H    3.951800      -2.732100     -0.3964000    


%chk=000171197-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171197

0 1
O -5.515249 1.051472 0.755418
O -2.624124 -2.962803 1.200129
O -0.723319 2.782678 0.726946
O -0.251950 -2.773505 0.106289
O -4.635598 -0.784255 -1.897600
O 2.290954 -2.449045 -0.383662
O 1.796923 3.019204 0.168744
O 4.776133 -2.245787 -0.615448
C -4.304722 0.364162 0.241122
C -4.170607 -1.045710 0.840586
C -3.137140 1.248080 0.714120
C -2.870028 -1.726314 0.386368
C -1.776284 0.584613 0.543844
C -1.648187 -0.810298 0.410475
C -0.607910 1.406732 0.508467
C -0.355393 -1.400299 0.205565
C -4.456693 0.318854 -1.315870
C 0.677016 0.856191 0.234522
C 0.804565 -0.574713 0.076930
C 2.136719 -1.175073 -0.189161
C 1.879023 1.751461 0.121125
C -4.449013 1.637648 -2.065129
C 3.320715 -0.307801 -0.225647
C 3.213727 1.103539 -0.068897
C 4.618777 -0.895262 -0.439189
C 4.365362 1.915617 -0.111053
C 5.771393 -0.065704 -0.470762
C 5.638236 1.324445 -0.306273
H -5.020705 -1.681659 0.536883
H -4.181359 -0.940653 1.944145
H -3.339623 1.479339 1.780562
H -3.185588 2.208785 0.166250
H -3.005709 -2.139720 -0.628070
H -6.310234 0.481853 0.585044
H -2.583565 -2.723119 2.162069
H -4.959201 2.429241 -1.490223
H -3.403712 1.962464 -2.237072
H -4.928472 1.509520 -3.047973
H -1.629885 3.013396 1.056126
H -1.098966 -3.191559 0.480018
H 4.244734 2.996103 0.006015
H 6.744881 -0.538464 -0.629067
H 6.532403 1.956423 -0.333940
H 3.816777 -2.656375 -0.571027


