%chk=000006874.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006874

0 1
 O   0.7113000     -0.2822000      3.6100000E-02
 O  -6.8099998E-02   1.728900     -0.7684000    
 O   -2.531700       2.190500      0.2808000    
 C    4.479300     -0.5773000      0.2709000    
 C    2.989600     -0.9476000      0.3546000    
 C    2.054200      0.1649000     -0.1035000    
 C    4.843100     -0.2084000      -1.169200    
 C    4.846800      0.5742000       1.207700    
 C  -0.2546000      0.6028000     -0.3340000    
 C   -1.605700      1.8400000E-02 -0.1396000    
 C   -2.674200      0.8406000      0.1575000    
 C   -1.746400      -1.350000     -0.2638000    
 C   -3.935100      0.2717000      0.3375000    
 C   -3.007300      -1.918700     -8.3499998E-02
 C   -4.101500      -1.107800      0.2171000    
 H    5.061800      -1.459800      0.5635000    
 H    2.736800      -1.231000       1.384400    
 H    2.797300      -1.845600     -0.2470000    
 H    2.190300       1.063000      0.5078000    
 H    2.226500      0.4127000      -1.155700    
 H    5.930500     -0.1163000      -1.268900    
 H    4.411200      0.7486000      -1.478500    
 H    4.513700     -0.9823000      -1.870600    
 H    4.379700       1.517600      0.9088000    
 H    5.931000      0.7317000       1.209000    
 H    4.541900      0.3509000       2.235400    
 H  -0.9158000      -2.004200     -0.5117000    
 H   -4.796700      0.8911000      0.5721000    
 H   -3.138000      -2.992500     -0.1806000    
 H   -5.083300      -1.550700      0.3566000    
 H   -3.396200       2.583400      0.4910000    


%chk=000006874-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000006874

0 1
O 0.708041 -0.266716 0.055952
O -0.032618 1.925628 -0.196351
O -2.769461 2.233016 -0.251802
C 4.541880 -0.622258 0.082684
C 3.023422 -0.961746 0.130730
C 2.102990 0.252325 -0.020157
C 4.970816 -0.021457 -1.279147
C 4.981351 0.288972 1.255720
C -0.304889 0.711489 -0.048371
C -1.655562 0.084552 0.043891
C -2.855905 0.853669 -0.056938
C -1.777182 -1.320350 0.239469
C -4.120912 0.216620 0.038587
C -3.031076 -1.951490 0.334226
C -4.209775 -1.174481 0.232856
H 5.072283 -1.590772 0.199129
H 2.791945 -1.460753 1.092129
H 2.785894 -1.684544 -0.674204
H 2.240374 0.997354 0.783916
H 2.228860 0.767404 -0.989320
H 6.070814 0.077628 -1.333194
H 4.541446 0.986421 -1.432831
H 4.645414 -0.661145 -2.121033
H 4.548079 1.302905 1.167411
H 6.081298 0.400843 1.272461
H 4.667405 -0.130897 2.229886
H -0.855009 -1.901306 0.314666
H -5.035191 0.819922 -0.040534
H -3.092461 -3.033659 0.484893
H -5.194517 -1.649066 0.304641
H -3.677355 2.628490 -0.303564


