R   LATTICE,NONEQUIV.ATOMS   8  146 R3                                         
MODE OF CALC=RELA unit=bohr                                                    
 22.631361 22.631361 13.332014 90.000000 90.000000120.000000                   
ATOM  -1: X=0.26000000 Y=0.83300000 Z=0.90700000
          MULT= 3          ISPLIT= 8
      -1: X=0.83300000 Y=0.90700000 Z=0.26000000
      -1: X=0.90700000 Y=0.26000000 Z=0.83300000
Pd         NPT=  781  R0=.000010000 RMT= 2.31        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=0.71200000 Y=0.13699000 Z=0.07300000
          MULT= 3          ISPLIT= 8
      -2: X=0.13699000 Y=0.07300000 Z=0.71200000
      -2: X=0.07300000 Y=0.71200000 Z=0.13699000
Pd         NPT=  781  R0=.000010000 RMT= 2.31        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=0.57900000 Y=0.40201000 Z=0.85200000
          MULT= 3          ISPLIT= 8
      -3: X=0.40201000 Y=0.85200000 Z=0.57900000
      -3: X=0.85200000 Y=0.57900000 Z=0.40201000
Pd         NPT=  781  R0=.000010000 RMT= 2.31        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=0.39200000 Y=0.57000000 Z=0.13000000
          MULT= 3          ISPLIT= 8
      -4: X=0.57000000 Y=0.13000000 Z=0.39200000
      -4: X=0.13000000 Y=0.39200000 Z=0.57000000
Pd         NPT=  781  R0=.000010000 RMT= 2.31        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=0.71100000 Y=0.71100000 Z=0.71100000
          MULT= 1          ISPLIT= 4
Pd         NPT=  781  R0=.000010000 RMT= 2.31        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=0.12600000 Y=0.12600000 Z=0.12600000
          MULT= 1          ISPLIT= 4
Pd         NPT=  781  R0=.000010000 RMT= 2.31        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  -7: X=0.47300000 Y=0.68999000 Z=0.87400000
          MULT= 3          ISPLIT= 8
      -7: X=0.68999000 Y=0.87400000 Z=0.47300000
      -7: X=0.87400000 Y=0.47300000 Z=0.68999000
P          NPT=  781  R0=.000100000 RMT= 1.80        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.44800000 Y=0.24700000 Z=0.08500000
          MULT= 3          ISPLIT= 8
      -8: X=0.24700000 Y=0.08500000 Z=0.44800000
      -8: X=0.08500000 Y=0.44800000 Z=0.24700000
P          NPT=  781  R0=.000100000 RMT= 1.80        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000