CXY LATTICE,NONEQUIV.ATOMS   6   36 Cmc21                                      
MODE OF CALC=RELA unit=bohr                                                    
  6.338141 32.964383 13.056118 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.03560000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.96440000 Z=0.50000000
Pd         NPT=  781  R0=.000010000 RMT= 2.35        Z:  46.00000              
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=0.17300000 Z=0.39300000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.82700000 Z=0.89300000
Pd         NPT=  781  R0=.000010000 RMT= 2.35        Z:  46.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.32760000 Z=0.54200000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.67240000 Z=0.04200000
Pd         NPT=  781  R0=.000010000 RMT= 2.35        Z:  46.00000              
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=0.41080000 Z=0.16470000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.58920000 Z=0.66470000
Pd         NPT=  781  R0=.000010000 RMT= 2.35        Z:  46.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.00000000 Y=0.55670000 Z=0.31160000
          MULT= 2          ISPLIT= 8
      -5: X=0.00000000 Y=0.44330000 Z=0.81160000
Sb         NPT=  781  R0=.000010000 RMT= 2.35        Z:  51.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -6: X=0.00000000 Y=0.20730000 Z=0.77440000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.79270000 Z=0.27440000
Sb         NPT=  781  R0=.000010000 RMT= 2.35        Z:  51.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000