 O Sc Cu
   1.0
     3.2020352900000000    0.0000000000000000    0.0000000000000000
    -1.6010176500000000    2.7730438999999998    0.0000000000000000
     0.0000000000000000    0.0000000000000000   11.3060659900000005
 O Sc Cu
   4   2   2
Direct
   0.3333333300000000  0.6666666700000000  0.4103743600000000
   0.6666666700000000  0.3333333300000000  0.9103743600000000
   0.3333333300000000  0.6666666700000000  0.0896256400000000
   0.6666666700000000  0.3333333300000000  0.5896256400000000
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.0000000000000000  0.0000000000000000  0.5000000000000000
   0.6666666700000000  0.3333333300000000  0.7500000000000000
   0.3333333300000000  0.6666666700000000  0.2500000000000000