CXY LATTICE,NONEQUIV.ATOMS   5   63 Cmcm    
MODE OF CALC=RELA unit=bohr
 13.148714 22.756082 14.371367 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.45700000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -1: X=0.00000000 Y=0.54300000 Z=0.75000000
U          NPT=  781  R0=.000005000 RMT=   2.00000   Z:  92.00000
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=0.15900000 Z=0.00300000
          MULT= 4          ISPLIT=15
      -2: X=0.00000000 Y=0.84100000 Z=0.99700000
      -2: X=0.00000000 Y=0.15900000 Z=0.49700000
      -2: X=0.00000000 Y=0.84100000 Z=0.50300000
Rb         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  37.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.20700000 Y=0.02100000 Z=0.25000000
          MULT= 4          ISPLIT=15
      -3: X=0.79300000 Y=0.97900000 Z=0.75000000
      -3: X=0.79300000 Y=0.02100000 Z=0.25000000
      -3: X=0.20700000 Y=0.97900000 Z=0.75000000
F          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   9.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.20000000 Y=0.30800000 Z=0.25000000
          MULT= 4          ISPLIT=15
      -4: X=0.80000000 Y=0.69200000 Z=0.75000000
      -4: X=0.80000000 Y=0.30800000 Z=0.25000000
      -4: X=0.20000000 Y=0.69200000 Z=0.75000000
F          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   9.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.00000000 Y=0.60800000 Z=0.04100000
          MULT= 4          ISPLIT=15
      -5: X=0.00000000 Y=0.39200000 Z=0.95900000
      -5: X=0.00000000 Y=0.60800000 Z=0.45900000
      -5: X=0.00000000 Y=0.39200000 Z=0.54100000
F          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   9.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000