%chk=000136553.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000136553

0 1
 O    2.560500      0.7925000     -2.6000000E-03
 O    2.451600      -1.515000      7.9999998E-04
 C   0.4362000     -0.1927000     -7.4999998E-03
 C   -1.821700      -1.321500       0.000000    
 C   -1.498300      0.8409000      -1.257200    
 C   -1.485500      0.8347000       1.265400    
 C  -0.2998000      -1.547500     -7.3000002E-03
 C   2.2500001E-02  0.6064000      -1.259400    
 C   3.5200000E-02  0.5996000       1.252200    
 C   -2.219400     -0.5180000      -1.250300    
 C   -2.207600     -0.5240000       1.258100    
 C   -1.885800       1.626200      8.1000002E-03
 C    1.921900     -0.4121000     -2.7999999E-03
 C    3.990300      0.7305000      2.3000001E-03
 H   -2.339700      -2.286900      1.9999999E-04
 H   -1.787000       1.408700      -2.148600    
 H   -1.765700       1.397800       2.162600    
 H  -1.2400000E-02  -2.143200      0.8693000    
 H  -1.9400001E-02  -2.138700     -0.8892000    
 H   0.3169000      6.7000002E-02  -2.169400    
 H   0.5357000       1.575800      -1.299000    
 H   0.5477000       1.569400       1.292500    
 H   0.3372000      5.5900000E-02   2.157200    
 H   -1.963300      -1.082400      -2.155300    
 H   -3.305600     -0.3653000      -1.266900    
 H   -3.293400     -0.3709000       1.285500    
 H   -1.943300      -1.093100       2.157800    
 H   -1.390000       2.604600      8.1000002E-03
 H   -2.966100       1.816600      1.4000000E-02
 H    4.374800       1.753900      1.9000000E-03
 H    4.350000      0.2196000     -0.8958000    
 H    4.343900      0.2226000      0.9046000    


%chk=000136553-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000136553

0 1
O 2.638504 0.815651 -0.006667
O 2.536555 -1.504678 0.000846
C 0.429653 -0.179821 -0.000776
C -1.837116 -1.329530 -0.000315
C -1.532844 0.847684 -1.262604
C -1.528720 0.840315 1.273626
C -0.302044 -1.551930 -0.003360
C 0.004322 0.634264 -1.268707
C 0.008493 0.627048 1.273353
C -2.250799 -0.529662 -1.265239
C -2.246617 -0.537064 1.270551
C -1.940776 1.640881 0.008468
C 1.940318 -0.401770 -0.002836
C 4.116209 0.705199 -0.007302
H -2.343329 -2.314916 -0.002288
H -1.818339 1.420543 -2.167130
H -1.811214 1.407939 2.182390
H 0.006017 -2.140294 0.881718
H 0.003122 -2.135407 -0.892700
H 0.306926 0.083794 -2.181875
H 0.531548 1.606109 -1.276075
H 0.535498 1.599040 1.284182
H 0.314234 0.071430 2.182327
H -1.981014 -1.097705 -2.178226
H -3.349526 -0.384367 -1.281686
H -3.345277 -0.391852 1.291510
H -1.973830 -1.110354 2.179360
H -1.450526 2.635006 0.010542
H -3.035413 1.814360 0.010779
H 4.475450 1.743854 -0.010899
H 4.459807 0.160956 -0.903245
H 4.461127 0.166677 0.891580


