P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.292798 12.044925 20.975582 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.16870000 Y=0.25000000 Z=0.41980000
          MULT= 4          ISPLIT= 8
      -1: X=0.83130000 Y=0.75000000 Z=0.58020000
      -1: X=0.66870000 Y=0.25000000 Z=0.08020000
      -1: X=0.33130000 Y=0.75000000 Z=0.91980000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.49870000 Y=0.25000000 Z=0.71040000
          MULT= 4          ISPLIT= 8
      -2: X=0.50130000 Y=0.75000000 Z=0.28960000
      -2: X=0.99870000 Y=0.25000000 Z=0.78960000
      -2: X=0.00130000 Y=0.75000000 Z=0.21040000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.21850000 Y=0.25000000 Z=0.07900000
          MULT= 4          ISPLIT= 8
      -3: X=0.78150000 Y=0.75000000 Z=0.92100000
      -3: X=0.71850000 Y=0.25000000 Z=0.42100000
      -3: X=0.28150000 Y=0.75000000 Z=0.57900000
Mo         NPT=  781  R0=.000010000 RMT= 1.70        Z:  42.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.00580000 Y=0.25000000 Z=0.07030000
          MULT= 4          ISPLIT= 8
      -4: X=0.99420000 Y=0.75000000 Z=0.92970000
      -4: X=0.50580000 Y=0.25000000 Z=0.42970000
      -4: X=0.49420000 Y=0.75000000 Z=0.57030000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.81300000 Y=0.25000000 Z=0.56130000
          MULT= 4          ISPLIT= 8
      -5: X=0.18700000 Y=0.75000000 Z=0.43870000
      -5: X=0.31300000 Y=0.25000000 Z=0.93870000
      -5: X=0.68700000 Y=0.75000000 Z=0.06130000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.28300000 Y=0.02060000 Z=0.15580000
          MULT= 8          ISPLIT= 8
      -6: X=0.71700000 Y=0.97940000 Z=0.84420000
      -6: X=0.78300000 Y=0.02060000 Z=0.34420000
      -6: X=0.21700000 Y=0.97940000 Z=0.65580000
      -6: X=0.21700000 Y=0.52060000 Z=0.65580000
      -6: X=0.78300000 Y=0.47940000 Z=0.34420000
      -6: X=0.71700000 Y=0.52060000 Z=0.84420000
      -6: X=0.28300000 Y=0.47940000 Z=0.15580000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000