CXY LATTICE,NONEQUIV.ATOMS   4   36 Cmc21                                      
MODE OF CALC=RELA unit=bohr                                                    
 23.655592 17.075565 12.377706 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.15600000 Y=0.16110000 Z=0.26200000
          MULT= 4          ISPLIT= 8
      -1: X=0.84400000 Y=0.83890000 Z=0.76200000
      -1: X=0.84400000 Y=0.16110000 Z=0.26200000
      -1: X=0.15600000 Y=0.83890000 Z=0.76200000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.57750000 Z=0.25500000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.42250000 Z=0.75500000
Ti         NPT=  781  R0=.000050000 RMT= 2.25        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  -3: X=0.37110000 Y=0.00800000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.62890000 Y=0.99200000 Z=0.50000000
      -3: X=0.62890000 Y=0.00800000 Z=0.00000000
      -3: X=0.37110000 Y=0.99200000 Z=0.50000000
S          NPT=  781  R0=.000100000 RMT= 1.94        Z:  16.00000              
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=0.17550000 Z=0.75800000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.82450000 Z=0.25800000
S          NPT=  781  R0=.000100000 RMT= 1.94        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000