%chk=000021813.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021813

0 1
 O    5.821100      8.5400000E-02  0.9034000    
 O    4.975800     -0.5397000      -1.114700    
 C   -4.150700      0.4145000     -0.3424000    
 C   -2.753000      8.0399998E-02 -0.9042000    
 C   -1.590000      0.2899000      7.1400002E-02
 C  -0.2455000      4.1999999E-03 -0.6056000    
 C   -4.643100     -0.5433000      0.7588000    
 C   0.9210000      0.2482000      0.3544000    
 C   -4.218500       1.859900      0.1619000    
 C    2.293700     -5.3300001E-02 -0.2594000    
 C   -4.711200      -1.998500      0.3182000    
 C    3.488200      0.2559000      0.6430000    
 C    4.812100     -0.1037000      1.5100000E-02
 H   -4.853400      0.3339000      -1.183300    
 H   -2.735900     -0.9477000      -1.283400    
 H   -2.583900      0.7195000      -1.781500    
 H   -1.582200       1.321500      0.4388000    
 H   -1.709000     -0.3672000      0.9402000    
 H  -0.2225000      -1.035300     -0.9540000    
 H  -0.1305000      0.6449000      -1.488200    
 H   -4.003400     -0.4669000       1.645800    
 H   -5.648000     -0.2345000       1.073500    
 H   0.7911000     -0.3695000       1.251600    
 H   0.9020000       1.294100      0.6851000    
 H   -3.836100       2.557000     -0.5909000    
 H   -5.256100       2.140300      0.3746000    
 H   -3.647600       1.999100       1.085400    
 H    2.398700      0.5175000      -1.191200    
 H    2.325500      -1.111900     -0.5485000    
 H   -5.298500      -2.106000     -0.5990000    
 H   -3.714000      -2.413300      0.1456000    
 H   -5.186900      -2.603100       1.097300    
 H    3.502400       1.325500      0.8798000    
 H    3.389000     -0.3110000       1.575700    
 H    6.692400     -0.1590000      0.5246000    


%chk=000021813-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021813

0 1
O 5.858067 -0.051106 1.007385
O 5.085876 -0.323972 -1.164288
C -4.214730 0.427749 -0.379982
C -2.795060 0.151381 -0.957267
C -1.621437 0.295101 0.040233
C -0.246125 0.065310 -0.626998
C -4.594150 -0.498660 0.808880
C 0.938085 0.185577 0.358474
C -4.394994 1.914504 0.015552
C 2.308644 -0.035691 -0.318097
C -4.556829 -2.008054 0.483973
C 3.475151 0.082609 0.680937
C 4.835028 -0.120856 0.043449
H -4.934381 0.212499 -1.200737
H -2.769157 -0.870280 -1.388411
H -2.626025 0.845321 -1.807353
H -1.635165 1.304575 0.498460
H -1.744030 -0.428745 0.871413
H -0.230157 -0.939767 -1.098405
H -0.112823 0.795962 -1.451926
H -3.926964 -0.286662 1.668899
H -5.616370 -0.227123 1.143257
H 0.805161 -0.550159 1.179435
H 0.915835 1.189116 0.833490
H -4.144168 2.586557 -0.826758
H -5.440179 2.120259 0.314018
H -3.746939 2.186568 0.869889
H 2.448217 0.697823 -1.135018
H 2.334768 -1.033558 -0.796769
H -5.196071 -2.241604 -0.388833
H -3.532451 -2.351582 0.250424
H -4.921762 -2.607697 1.338382
H 3.479096 1.077003 1.170534
H 3.372494 -0.651017 1.504460
H 6.736546 -0.183582 0.557201


