P   LATTICE,NONEQUIV.ATOMS   6   31 Pmn21                                      
MODE OF CALC=RELA unit=bohr                                                    
  6.606483 11.871260 26.588447 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.09950000 Z=0.50000000
          MULT= 2          ISPLIT= 8
      -1: X=0.50000000 Y=0.90050000 Z=0.00000000
W          NPT=  781  R0=.000005000 RMT= 2.50000     Z:  74.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.54140000 Z=0.01490000
          MULT= 2          ISPLIT= 8
      -2: X=0.50000000 Y=0.45860000 Z=0.51490000
W          NPT=  781  R0=.000005000 RMT= 2.50000     Z:  74.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.70590000 Z=0.40350000
          MULT= 2          ISPLIT= 8
      -3: X=0.50000000 Y=0.29410000 Z=0.90350000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.80020000 Z=0.86000000
          MULT= 2          ISPLIT= 8
      -4: X=0.50000000 Y=0.19980000 Z=0.36000000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.00000000 Y=0.35590000 Z=0.65510000
          MULT= 2          ISPLIT= 8
      -5: X=0.50000000 Y=0.64410000 Z=0.15510000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -6: X=0.00000000 Y=0.14830000 Z=0.11070000
          MULT= 2          ISPLIT= 8
      -6: X=0.50000000 Y=0.85170000 Z=0.61070000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000