%chk=000001470.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001470

0 1
 O   -3.058200     -0.9746000       1.575300    
 O    1.484200      0.6457000       1.716400    
 O   -1.177900       1.096900      -1.433000    
 O    4.125100      -2.040400      -1.239200    
 O   -7.299500      0.6184000      0.1773000    
 C  -0.9535000     -0.2755000      0.5511000    
 C   0.4128000     -0.7346000      8.7300003E-02
 C   -1.816700      -1.440700       1.035800    
 C   -1.717700      0.4746000     -0.5253000    
 C   -3.189800      0.4810000     -0.3777000    
 C    1.573200     -0.2519000      0.6931000    
 C    2.823200     -0.6867000      0.2520000    
 C   -3.774800     -0.2276000      0.6764000    
 C   0.5030000      -1.652300     -0.9595000    
 C    4.067600     -0.1697000      0.9002000    
 C    2.912800      -1.604400     -0.7947000    
 C    1.752700      -2.087100      -1.400400    
 C   -3.986100       1.220000      -1.256900    
 C   -5.155500     -0.1681000      0.8711000    
 C   -5.368200       1.259200      -1.068900    
 C   -5.951200      0.5709000     -4.6999999E-03
 C    4.595500       1.078600      0.2398000    
 C    5.876300       1.479200      0.1259000    
 C    6.333900       2.741400     -0.5484000    
 C    6.988900      0.6477000      0.7069000    
 H  -0.8597000      0.4428000       1.376200    
 H   -2.031900      -2.173900      0.2472000    
 H   -1.302800      -1.981500       1.839300    
 H  -0.3871000      -2.035000      -1.451300    
 H    3.887900      4.3400001E-02   1.961400    
 H    4.816400     -0.9684000      0.9315000    
 H    1.815900      -2.800600      -2.217600    
 H   -3.551100       1.776500      -2.082200    
 H   -5.614300     -0.7049000       1.697900    
 H   -5.980300       1.837600      -1.756000    
 H    3.839000       1.742500     -0.1788000    
 H    2.275500       1.206100       1.745500    
 H    4.818600      -1.396400      -1.025900    
 H    5.492100       3.301300     -0.9689000    
 H    6.846000       3.393700      0.1661000    
 H    7.022400       2.507900      -1.366800    
 H    6.659600     -9.2500001E-02   1.439500    
 H    7.525900      0.1283000     -9.3400002E-02
 H    7.703100       1.293000       1.231300    
 H   -7.692300       1.172800     -0.5187000    


%chk=000001470-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001470

0 1
O -2.892917 -0.639841 1.707239
O 1.043823 0.987893 1.618618
O -1.926458 0.789497 -2.151203
O 4.251603 -1.012680 -1.575303
O -7.567200 -0.105658 0.908072
C -1.124119 0.199131 0.111564
C 0.285826 -0.091358 -0.378040
C -1.570195 -0.916839 1.086904
C -2.197491 0.399283 -0.976184
C -3.592839 0.187822 -0.517502
C 1.387412 0.314767 0.420830
C 2.737462 0.045575 0.067055
C -3.890354 -0.266841 0.806987
C 0.563130 -0.813924 -1.561654
C 3.920855 0.435446 0.954809
C 2.958418 -0.673430 -1.144517
C 1.883983 -1.106738 -1.948677
C -4.680232 0.525159 -1.369147
C -5.218925 -0.351421 1.269569
C -6.008121 0.436579 -0.933458
C -6.267345 0.002322 0.399123
C 5.052776 1.123051 0.196796
C 6.399103 0.912808 0.331149
C 7.391962 1.734374 -0.474720
C 7.026432 -0.110027 1.261757
H -1.102138 1.142564 0.697253
H -1.635713 -1.890690 0.560569
H -0.875365 -0.993286 1.935687
H -0.264540 -1.119132 -2.207230
H 3.598308 1.136429 1.755728
H 4.297154 -0.459879 1.486890
H 2.104428 -1.652636 -2.869651
H -4.437171 0.875867 -2.377602
H -5.431866 -0.700877 2.282122
H -6.835445 0.705911 -1.601459
H 4.719844 1.912591 -0.493227
H 1.850106 1.312887 2.089188
H 4.929218 -0.449566 -1.099522
H 6.888087 2.447928 -1.148289
H 8.060807 2.307387 0.197222
H 8.044234 1.081287 -1.086728
H 6.291351 -0.748130 1.777706
H 7.721775 -0.768164 0.705637
H 7.630906 0.401103 2.036724
H -8.237569 0.146157 0.225114


