R   LATTICE,NONEQUIV.ATOMS   5  148 R-3                                        
MODE OF CALC=RELA unit=bohr                                                    
 13.429718 13.429718 32.289184 90.000000 90.000000120.000000                   
ATOM  -1: X=0.17902000 Y=0.34728000 Z=0.86388000
          MULT= 6          ISPLIT= 8
      -1: X=0.82098000 Y=0.65272000 Z=0.13612000
      -1: X=0.34728000 Y=0.86388000 Z=0.17902000
      -1: X=0.65272000 Y=0.13612000 Z=0.82098000
      -1: X=0.86388000 Y=0.17902000 Z=0.34728000
      -1: X=0.13612000 Y=0.82098000 Z=0.65272000
Pd         NPT=  781  R0=.000010000 RMT= 2.37        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  -2: X=0.55344000 Y=0.05724000 Z=0.27543000
          MULT= 6          ISPLIT= 8
      -2: X=0.44656000 Y=0.94276000 Z=0.72457000
      -2: X=0.05724000 Y=0.27543000 Z=0.55344000
      -2: X=0.94276000 Y=0.72457000 Z=0.44656000
      -2: X=0.27543000 Y=0.55344000 Z=0.05724000
      -2: X=0.72457000 Y=0.44656000 Z=0.94276000
Pd         NPT=  781  R0=.000010000 RMT= 2.37        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  -3: X=0.42059000 Y=0.42059000 Z=0.42059000
          MULT= 2          ISPLIT= 4
      -3: X=0.57941000 Y=0.57941000 Z=0.57941000
Pd         NPT=  781  R0=.000010000 RMT= 2.37        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  -4: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 4
Pd         NPT=  781  R0=.000010000 RMT= 2.37        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=0.21448000 Y=0.21448000 Z=0.21448000
          MULT= 2          ISPLIT= 4
      -5: X=0.78552000 Y=0.78552000 Z=0.78552000
P          NPT=  781  R0=.000100000 RMT= 1.84        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000