%chk=000075506.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075506

0 1
 O  -0.4821000     -0.3261000     -0.7133000    
 O    1.088800       1.958500     -0.9073000    
 O    5.735000      0.4193000      0.4393000    
 C   -1.332700      -1.236000     -1.8300001E-02
 C   0.8469000     -0.3729000     -0.4184000    
 C   -2.701700     -0.6334000      0.1006000    
 C    1.635400      0.7735000     -0.5164000    
 C    1.418300      -1.580100     -1.6600000E-02
 C    2.995500      0.7125000     -0.2125000    
 C    3.567100     -0.4948000      0.1890000    
 C    2.778500      -1.641300      0.2870000    
 C   -3.015500      0.1508000       1.205100    
 C   -3.644700     -0.8646000     -0.8950000    
 C   -4.288200      0.7108000       1.315400    
 C   -4.917300     -0.3044000     -0.7846000    
 C   -5.239100      0.4834000      0.3205000    
 C    4.984900     -0.5584000      0.5067000    
 C   0.5709000       2.803200      0.1188000    
 H  -0.9686000      -1.453700      0.9953000    
 H   -1.384400      -2.182100     -0.5716000    
 H   0.8494000      -2.503000      4.5000002E-02
 H    3.597100       1.614700     -0.2942000    
 H    3.211000      -2.590600      0.5926000    
 H   -2.281700      0.3375000       1.984300    
 H   -3.404100      -1.474800      -1.761200    
 H   -4.538600       1.325000       2.175500    
 H   -5.657500     -0.4809000      -1.559500    
 H   -6.229900      0.9199000      0.4063000    
 H    5.378700      -1.540500      0.8190000    
 H    1.367200       3.100800      0.8082000    
 H  -0.2310000       2.297800      0.6663000    
 H   0.1610000       3.701300     -0.3512000    


%chk=000075506-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000075506

0 1
O -0.417914 0.079374 0.173127
O 1.268983 1.917096 -1.135577
O 6.018736 -0.140183 -0.778931
C -1.335108 -0.959842 0.701661
C 0.948549 -0.206523 0.138600
C -2.755232 -0.484442 0.484279
C 1.780384 0.769598 -0.511788
C 1.529899 -1.380092 0.681988
C 3.157290 0.527830 -0.626755
C 3.738865 -0.656894 -0.098456
C 2.915407 -1.602595 0.561846
C -3.714126 -0.616513 1.517407
C -3.149943 0.057407 -0.765202
C -5.056023 -0.225320 1.303747
C -4.487275 0.457286 -0.975405
C -5.445524 0.312672 0.056418
C 5.190541 -0.911246 -0.220361
C 0.451990 2.843611 -0.319091
H -1.131953 -1.125935 1.777977
H -1.136719 -1.903727 0.152148
H 0.907938 -2.122834 1.189332
H 3.789634 1.261108 -1.137337
H 3.360361 -2.514131 0.979046
H -3.415154 -1.022168 2.491992
H -2.403637 0.178987 -1.557771
H -5.790605 -0.332868 2.109425
H -4.783464 0.879555 -1.942012
H -6.483820 0.620503 -0.109595
H 5.530194 -1.877180 0.236255
H 1.033830 3.199355 0.552753
H -0.480740 2.361933 0.015418
H 0.233238 3.687579 -0.990336


