%chk=000139049.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139049

0 1
 O    1.324300       3.078800     -0.1392000    
 O  -0.7116000       2.706800      0.8872000    
 C   3.6499999E-02   1.314800     -0.8833000    
 C  -0.6862000      0.2082000     -0.4373000    
 C   0.5706000      6.7900002E-02 -0.4314000    
 C   -2.014700     -0.3368000     -0.2050000    
 C    1.736100     -0.6981000     -0.2074000    
 C   0.1436000       2.426200      5.8200002E-02
 C   -2.161100      -1.647000      0.2507000    
 C    1.664600      -2.035100      0.2546000    
 C   -3.142300      0.4506000     -0.4379000    
 C    3.027800     -0.1633000     -0.4347000    
 C   -3.434900      -2.169900      0.4732000    
 C    2.815400      -2.791600      0.4762000    
 C   -4.416200     -7.2400004E-02 -0.2153000    
 C    4.178500     -0.9198000     -0.2132000    
 C   -4.562400      -1.382700      0.2403000    
 C    4.072200      -2.234100      0.2423000    
 C    1.559900       4.197500      0.7217000    
 H   7.0299998E-02   1.516900      -1.944600    
 H   -1.312000      -2.288000      0.4428000    
 H   0.7111000      -2.509300      0.4497000    
 H   -3.047500       1.473600     -0.7939000    
 H    3.138100      0.8591000     -0.7919000    
 H   -3.549400      -3.190100      0.8280000    
 H    2.733400      -3.814900      0.8308000    
 H   -5.294300      0.5404000     -0.3968000    
 H    5.157300     -0.4861000     -0.3956000    
 H   -5.554200      -1.789800      0.4135000    
 H    4.968200      -2.823000      0.4146000    
 H   0.7876000       4.958400      0.5740000    
 H    2.530900       4.627600      0.4620000    
 H    1.588000       3.872000       1.765900    


%chk=000139049-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139049

0 1
O 0.643157 3.575225 -0.384180
O 0.441549 2.273730 1.544788
C 0.293130 1.242944 -0.696471
C -0.580824 0.023221 -0.322155
C 0.739729 -0.185590 -0.310930
C -1.958677 -0.372296 -0.166879
C 1.922748 -0.988748 -0.125113
C 0.458535 2.357508 0.295188
C -2.305193 -1.698971 0.227778
C 1.828583 -2.361586 0.251984
C -3.000793 0.568002 -0.410704
C 3.211874 -0.415267 -0.321642
C -3.656065 -2.069079 0.371221
C 2.993149 -3.133588 0.425588
C -4.351168 0.192158 -0.265851
C 4.374307 -1.192148 -0.145424
C -4.684822 -1.126663 0.124950
C 4.270428 -2.553458 0.228083
C 0.817881 4.763707 0.484065
H 0.354275 1.572650 -1.742629
H -1.510587 -2.427710 0.422403
H 0.841405 -2.810509 0.407837
H -2.734969 1.588190 -0.709702
H 3.284440 0.639797 -0.608684
H -3.912550 -3.089677 0.676240
H 2.911391 -4.186777 0.716311
H -5.144533 0.923672 -0.454365
H 5.360831 -0.740504 -0.296602
H -5.734856 -1.417791 0.238495
H 5.174580 -3.156656 0.365593
H -0.066879 4.901822 1.128470
H 0.937514 5.606250 -0.211639
H 1.710011 4.644941 1.122176


