P   LATTICE,NONEQUIV.ATOMS  11   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 28.693602 25.233513  8.282670 90.000000 90.000000115.060000                   
ATOM  -1: X=0.42790000 Y=0.81800000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.57210000 Y=0.18200000 Z=0.75000000
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
ATOM  -2: X=0.72250000 Y=0.30330000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.27750000 Y=0.69670000 Z=0.75000000
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
ATOM  -3: X=0.66590000 Y=0.49710000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.33410000 Y=0.50290000 Z=0.75000000
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
ATOM  -4: X=0.18840000 Y=0.38500000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.81160000 Y=0.61500000 Z=0.75000000
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
ATOM  -5: X=0.25100000 Y=0.19510000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.74900000 Y=0.80490000 Z=0.75000000
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
ATOM  -6: X=0.89430000 Y=0.92730000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.10570000 Y=0.07270000 Z=0.75000000
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
ATOM  -7: X=0.83790000 Y=0.12370000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -7: X=0.16210000 Y=0.87630000 Z=0.75000000
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
ATOM  -8: X=0.01890000 Y=0.75950000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -8: X=0.98110000 Y=0.24050000 Z=0.75000000
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
ATOM  -9: X=0.07350000 Y=0.56310000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -9: X=0.92650000 Y=0.43690000 Z=0.75000000
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
ATOM -10: X=0.37190000 Y=0.01670000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -10: X=0.62810000 Y=0.98330000 Z=0.75000000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM -11: X=0.53690000 Y=0.66140000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -11: X=0.46310000 Y=0.33860000 Z=0.75000000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000