%chk=000099723.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099723

0 1
 O   -6.736400      -1.656900      0.7619000    
 O   -5.698200      -1.400200      -1.236000    
 C   0.7249000      0.7004000     -0.1517000    
 C  -0.5822000      5.5799998E-02  0.3150000    
 C    1.935400     -0.1352000      0.2713000    
 C   -1.832300      0.8123000     -0.1433000    
 C    3.245800      0.5220000     -0.1657000    
 C   -3.139800      0.1801000      0.3442000    
 C    4.454200     -0.3306000      0.2286000    
 C   -4.354400      0.9714000     -0.1605000    
 C    5.765400      0.3443000     -0.1804000    
 C   -5.724100      0.4689000      0.3375000    
 C    7.008400     -0.4784000      0.1707000    
 C    8.314200      0.1605000     -0.3036000    
 C   -6.869000       1.412800     -1.6799999E-02
 C   -6.029500     -0.9401000     -0.1518000    
 C    9.517600     -0.6871000      8.0600001E-02
 H   0.7139000      0.8036000      -1.243400    
 H   0.8043000       1.710100      0.2686000    
 H  -0.5820000     -7.7999998E-03   1.410200    
 H  -0.6336000     -0.9735000     -6.1600000E-02
 H    1.934100     -0.2602000       1.361000    
 H    1.861200      -1.136800     -0.1693000    
 H   -1.775100       1.847000      0.2168000    
 H   -1.839400      0.8584000      -1.239500    
 H    3.239900      0.6685000      -1.252600    
 H    3.328900       1.514200      0.2942000    
 H   -3.196100     -0.8571000     -4.8000002E-03
 H   -3.148000      0.1553000       1.440300    
 H    4.382600      -1.314500     -0.2502000    
 H    4.452600     -0.4967000       1.312600    
 H   -4.237800       2.018000      0.1499000    
 H   -4.346400      0.9719000      -1.258400    
 H    5.752800      0.5262000      -1.262300    
 H    5.837000       1.325700      0.3046000    
 H   -5.660500      0.4180000       1.433300    
 H    6.914800      -1.476200     -0.2759000    
 H    7.046100     -0.6211000       1.257800    
 H    8.292400      0.2859000      -1.392200    
 H    8.419700       1.158700      0.1367000    
 H   -7.820800       1.039100      0.3757000    
 H   -6.697100       2.410300      0.4001000    
 H   -6.975300       1.508700      -1.102900    
 H    9.584400     -0.8042000       1.166900    
 H    9.455900      -1.682900     -0.3698000    
 H    10.44090     -0.2134000     -0.2675000    
 H   -6.934100      -2.562700      0.4414000    


%chk=000099723-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099723

0 1
O -6.809406 -1.736395 0.630430
O -5.729788 -1.299351 -1.374878
C 0.697067 0.677165 -0.165548
C -0.631842 0.062003 0.327466
C 1.944250 -0.114864 0.287452
C -1.878837 0.852131 -0.129033
C 3.273431 0.497604 -0.208326
C -3.206501 0.232197 0.360872
C 4.520143 -0.297849 0.240112
C -4.445932 1.029635 -0.102718
C 5.849396 0.310837 -0.260528
C -5.789891 0.447152 0.395521
C 7.095839 -0.487482 0.183780
C 8.425012 0.118904 -0.321240
C -6.986927 1.384530 0.060558
C -6.062390 -0.913755 -0.232025
C 9.664221 -0.686813 0.125391
H 0.683566 0.735812 -1.274106
H 0.775162 1.722986 0.199362
H -0.619539 0.003762 1.436182
H -0.708945 -0.983584 -0.037397
H 1.958821 -0.173076 1.396132
H 1.864954 -1.160775 -0.076618
H -1.803171 1.898374 0.235618
H -1.891168 0.908619 -1.237333
H 3.257198 0.558004 -1.316848
H 3.354824 1.542759 0.157671
H -3.278757 -0.808851 -0.013702
H -3.196533 0.172591 1.469569
H 4.436645 -1.343644 -0.123500
H 4.538630 -0.356093 1.348728
H -4.368272 2.074486 0.259889
H -4.465107 1.070167 -1.209420
H 5.829473 0.370880 -1.369062
H 5.934806 1.355948 0.104783
H -5.757011 0.303265 1.491960
H 7.010491 -1.533269 -0.179575
H 7.119259 -0.545856 1.292346
H 8.400087 0.178106 -1.428669
H 8.510402 1.163195 0.043170
H -7.942071 0.961576 0.417763
H -6.837729 2.364443 0.547689
H -7.059590 1.547968 -1.029757
H 9.729878 -0.732853 1.229021
H 9.616594 -1.726640 -0.250035
H 10.600600 -0.234349 -0.250125
H -7.006040 -2.597101 0.168677


