P   LATTICE,NONEQUIV.ATOMS  11   31 Pmn21                                      
MODE OF CALC=RELA unit=bohr                                                    
  7.407915 17.113738 27.989868 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.11258000 Z=0.59780000
          MULT= 2          ISPLIT= 8
      -1: X=0.50000000 Y=0.88742000 Z=0.09780000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
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=0.60636000 Z=0.97365000
          MULT= 2          ISPLIT= 8
      -2: X=0.50000000 Y=0.39364000 Z=0.47365000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
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=0.18659000 Z=0.19832000
          MULT= 2          ISPLIT= 8
      -3: X=0.50000000 Y=0.81341000 Z=0.69832000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
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=0.47837000 Z=0.24408000
          MULT= 2          ISPLIT= 8
      -4: X=0.50000000 Y=0.52163000 Z=0.74408000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
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=0.85879000 Z=0.38840000
          MULT= 2          ISPLIT= 8
      -5: X=0.50000000 Y=0.14121000 Z=0.88840000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
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=0.59732000 Z=0.54312000
          MULT= 2          ISPLIT= 8
      -6: X=0.50000000 Y=0.40268000 Z=0.04312000
Br         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -7: X=0.00000000 Y=0.70159000 Z=0.13926000
          MULT= 2          ISPLIT= 8
      -7: X=0.50000000 Y=0.29841000 Z=0.63926000
S          NPT=  781  R0=.000100000 RMT= 2.14        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -8: X=0.00000000 Y=0.43440000 Z=0.83790000
          MULT= 2          ISPLIT= 8
      -8: X=0.50000000 Y=0.56560000 Z=0.33790000
S          NPT=  781  R0=.000100000 RMT= 2.14        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -9: X=0.00000000 Y=0.22850000 Z=0.43490000
          MULT= 2          ISPLIT= 8
      -9: X=0.50000000 Y=0.77150000 Z=0.93490000
S          NPT=  781  R0=.000100000 RMT= 2.14        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM -10: X=0.00000000 Y=0.06110000 Z=0.04595000
          MULT= 2          ISPLIT= 8
     -10: X=0.50000000 Y=0.93890000 Z=0.54595000
S          NPT=  781  R0=.000100000 RMT= 2.14        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM -11: X=0.00000000 Y=0.97040000 Z=0.74994000
          MULT= 2          ISPLIT= 8
     -11: X=0.50000000 Y=0.02960000 Z=0.24994000
S          NPT=  781  R0=.000100000 RMT= 2.14        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000