BASE=BASE,<BASE>,</BASE> 

ZMATRIX=mol1,FREEZM,<ZMAT>,</ZMAT> 

PRINT=ANGLE,mol1,4,5,6 
PRINT=XYZ,mol1

STOP 









<BASE>
 molecules mol1 
 jobname metaftortriftormetoxybenzol 
</BASE> 


<mol1> 
 formula C7H4OF4 
 amount  1.0
</mol1> 



<ZMAT>
C 
C 1 Rcc1 
C 2 Rcc2 1 Acc1 
C 3 Rcc3 2 Acc2 1 Fcc1 
C 4 Rcc4 3 Acc3 2 Fcc2 
C 1 Rcc6 5 Rcc5 4 Acc4   2 

O 4 Rco1 3 Aco1 2 Fco1 
C 7 Rco2 4 Aco2 3 Fco2 

F 8 Rcf1 7 Acf1 4 Fcf1 
F 8 Rcf2 7 Acf2 4 Fcf2 
F 8 Rcf3 7 Acf3 4 Fcf3 

H 6 Rch1 5 Ach1 4 Fh1 
H 1 Rch2 6 Ach3 5 Fh1 
H 2 Rch3 1 Ach5 6 Fh1 
H 3 Rch4 2 Ach7 1 Fh1 

F 5 Rcf4 4 Acf4 3 Fcf4 

 
  Variable:        Value:        Group: 
    Rcc1           1.3900          
    Rcc2           1.3895          
    Rcc3           1.3859          
    Rcc4           1.3899           
    Rcc5           1.3834           
    Rcc6           1.3897               
    Rco1           1.3963          
    Rco2           1.3562          
    Rcf1           1.3282          
    Rcf2           1.3411          
    Rcf3           1.3473          
    Rcf4           1.3396          
    Rch1           1.1000 
    Rch2           1.1000 
    Rch3           1.1000 
    Rch4           1.1000 
    
    Acc1           120.07 
    Acc2           119.70 
    Acc3           119.90 
    Acc4           120.76 
    Aco1           120.88           
    Aco2           117.86           
    Acf1           107.64           
    Acf2           112.72           
    Acf3           112.29           
    Acf4           119.39 
    Ach1           120.00 
    Ach3           120.00 
    Ach5           120.00 
    Ach7           120.00 
    
    Fcc1             0.0 
    Fcc2             0.0 
    Fco1           180.0 
    Fco2            86.73 
    Fcf1           180.0    
    Fcf2            60.0    
    Fcf3           300.0    
    Fcf4           180.0 
    Fh1            180.0     
</ZMAT>


