CXZ LATTICE,NONEQUIV.ATOMS   6   12 B2/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 22.194833 15.696065 15.707404 90.000000 90.000000 45.010000                   
ATOM  -1: X=0.25100000 Y=0.24300000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.74900000 Y=0.75700000 Z=0.00000000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.78200000 Y=0.20200000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.21800000 Y=0.79800000 Z=0.00000000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.97300000 Y=0.31000000 Z=0.28300000
          MULT= 4          ISPLIT= 8
      -3: X=0.02700000 Y=0.69000000 Z=0.71700000
      -3: X=0.02700000 Y=0.69000000 Z=0.28300000
      -3: X=0.97300000 Y=0.31000000 Z=0.71700000
S          NPT=  781  R0=.000100000 RMT= 1.97        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=0.75000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.25000000 Y=0.00000000 Z=0.25000000
Pd         NPT=  781  R0=.000010000 RMT= 2.41        Z:  46.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.98200000 Y=0.29000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -5: X=0.01800000 Y=0.71000000 Z=0.00000000
Pd         NPT=  781  R0=.000010000 RMT= 2.41        Z:  46.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.00000000 Y=0.00000000 Z=0.27400000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.00000000 Z=0.72600000
Pd         NPT=  781  R0=.000010000 RMT= 2.41        Z:  46.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000