CXY LATTICE,NONEQUIV.ATOMS   4   63 Cmcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.021218 14.932616 11.997871 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.00000000 Z=0.50000000
Ti         NPT=  781  R0=.000050000 RMT= 2.05        Z:  22.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.32200000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.67800000 Z=0.75000000
P          NPT=  781  R0=.000100000 RMT= 1.24        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.23500000 Y=0.45900000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.76500000 Y=0.54100000 Z=0.75000000
      -3: X=0.76500000 Y=0.45900000 Z=0.25000000
      -3: X=0.23500000 Y=0.54100000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.26000000 Z=0.04600000
          MULT= 4          ISPLIT= 8
      -4: X=0.00000000 Y=0.74000000 Z=0.95400000
      -4: X=0.00000000 Y=0.26000000 Z=0.45400000
      -4: X=0.00000000 Y=0.74000000 Z=0.54600000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000