B   LATTICE,NONEQUIV.ATOMS   4   82 I-4                                        
MODE OF CALC=RELA unit=bohr                                                    
 18.848128 18.848128  9.112259 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.07700000 Y=0.11200000 Z=0.26100000
          MULT= 4          ISPLIT= 8
      -1: X=0.11200000 Y=0.92300000 Z=0.73900000
      -1: X=0.92300000 Y=0.88800000 Z=0.26100000
      -1: X=0.88800000 Y=0.07700000 Z=0.73900000
Pd         NPT=  781  R0=.000010000 RMT= 2.35        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=0.13500000 Y=0.46800000 Z=0.02300000
          MULT= 4          ISPLIT= 8
      -2: X=0.46800000 Y=0.86500000 Z=0.97700000
      -2: X=0.86500000 Y=0.53200000 Z=0.02300000
      -2: X=0.53200000 Y=0.13500000 Z=0.97700000
Pd         NPT=  781  R0=.000010000 RMT= 2.35        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=0.33100000 Y=0.28000000 Z=0.24800000
          MULT= 4          ISPLIT= 8
      -3: X=0.28000000 Y=0.66900000 Z=0.75200000
      -3: X=0.66900000 Y=0.72000000 Z=0.24800000
      -3: X=0.72000000 Y=0.33100000 Z=0.75200000
Pd         NPT=  781  R0=.000010000 RMT= 2.35        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=0.28600000 Y=0.04900000 Z=0.01900000
          MULT= 4          ISPLIT= 8
      -4: X=0.04900000 Y=0.71400000 Z=0.98100000
      -4: X=0.71400000 Y=0.95100000 Z=0.01900000
      -4: X=0.95100000 Y=0.28600000 Z=0.98100000
As         NPT=  781  R0=.000050000 RMT= 2.24        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000