CXY LATTICE,NONEQUIV.ATOMS   4   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.950741 13.104495 10.305432 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.08470000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.91530000 Z=0.75000000
Ti         NPT=  781  R0=.000050000 RMT= 1.73        Z:  22.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.33690000 Y=0.14800000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.66310000 Y=0.85200000 Z=0.75000000
      -2: X=0.66310000 Y=0.14800000 Z=0.25000000
      -2: X=0.33690000 Y=0.85200000 Z=0.75000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.12620000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.87380000 Y=0.00000000 Z=0.00000000
      -3: X=0.12620000 Y=0.00000000 Z=0.50000000
      -3: X=0.87380000 Y=0.00000000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.56        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.33740000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.66260000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.56        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000