P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 24.124244 18.341682 15.943619 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.07600000 Y=0.04400000 Z=0.19100000
          MULT= 8          ISPLIT= 8
      -1: X=0.92400000 Y=0.95600000 Z=0.80900000
      -1: X=0.57600000 Y=0.04400000 Z=0.30900000
      -1: X=0.42400000 Y=0.95600000 Z=0.69100000
      -1: X=0.42400000 Y=0.54400000 Z=0.69100000
      -1: X=0.57600000 Y=0.45600000 Z=0.30900000
      -1: X=0.92400000 Y=0.54400000 Z=0.80900000
      -1: X=0.07600000 Y=0.45600000 Z=0.19100000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.22800000 Y=0.25000000 Z=0.82100000
          MULT= 4          ISPLIT= 8
      -2: X=0.77200000 Y=0.75000000 Z=0.17900000
      -2: X=0.72800000 Y=0.25000000 Z=0.67900000
      -2: X=0.27200000 Y=0.75000000 Z=0.32100000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.00600000 Y=0.25000000 Z=0.53600000
          MULT= 4          ISPLIT= 8
      -3: X=0.99400000 Y=0.75000000 Z=0.46400000
      -3: X=0.50600000 Y=0.25000000 Z=0.96400000
      -3: X=0.49400000 Y=0.75000000 Z=0.03600000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.29100000 Y=0.25000000 Z=0.35000000
          MULT= 4          ISPLIT= 8
      -4: X=0.70900000 Y=0.75000000 Z=0.65000000
      -4: X=0.79100000 Y=0.25000000 Z=0.15000000
      -4: X=0.20900000 Y=0.75000000 Z=0.85000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.48400000 Y=0.25000000 Z=0.56600000
          MULT= 4          ISPLIT= 8
      -5: X=0.51600000 Y=0.75000000 Z=0.43400000
      -5: X=0.98400000 Y=0.25000000 Z=0.93400000
      -5: X=0.01600000 Y=0.75000000 Z=0.06600000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.32900000 Y=0.01400000 Z=0.06600000
          MULT= 8          ISPLIT= 8
      -6: X=0.67100000 Y=0.98600000 Z=0.93400000
      -6: X=0.82900000 Y=0.01400000 Z=0.43400000
      -6: X=0.17100000 Y=0.98600000 Z=0.56600000
      -6: X=0.17100000 Y=0.51400000 Z=0.56600000
      -6: X=0.82900000 Y=0.48600000 Z=0.43400000
      -6: X=0.67100000 Y=0.51400000 Z=0.93400000
      -6: X=0.32900000 Y=0.48600000 Z=0.06600000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000