P   LATTICE,NONEQUIV.ATOMS  10   31 Pmn21                                      
MODE OF CALC=RELA unit=bohr                                                    
  7.252769 21.382251 21.227294 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.72002000 Z=0.67383000
          MULT= 2          ISPLIT= 8
      -1: X=0.50000000 Y=0.27998000 Z=0.17383000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
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=0.40031000 Z=0.46429000
          MULT= 2          ISPLIT= 8
      -2: X=0.50000000 Y=0.59969000 Z=0.96429000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
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=0.37750000 Z=0.06030000
          MULT= 2          ISPLIT= 8
      -3: X=0.50000000 Y=0.62250000 Z=0.56030000
S          NPT=  781  R0=.000100000 RMT= 2.08        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  -4: X=0.00000000 Y=0.54080000 Z=0.80600000
          MULT= 2          ISPLIT= 8
      -4: X=0.50000000 Y=0.45920000 Z=0.30600000
S          NPT=  781  R0=.000100000 RMT= 2.08        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  -5: X=0.00000000 Y=0.20200000 Z=0.37550000
          MULT= 2          ISPLIT= 8
      -5: X=0.50000000 Y=0.79800000 Z=0.87550000
S          NPT=  781  R0=.000100000 RMT= 2.08        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  -6: X=0.00000000 Y=0.22134000 Z=0.82601000
          MULT= 2          ISPLIT= 8
      -6: X=0.50000000 Y=0.77866000 Z=0.32601000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
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=0.89863000 Z=0.03651000
          MULT= 2          ISPLIT= 8
      -7: X=0.50000000 Y=0.10137000 Z=0.53651000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
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=0.87240000 Z=0.43780000
          MULT= 2          ISPLIT= 8
      -8: X=0.50000000 Y=0.12760000 Z=0.93780000
S          NPT=  781  R0=.000100000 RMT= 2.08        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=0.04340000 Z=0.68890000
          MULT= 2          ISPLIT= 8
      -9: X=0.50000000 Y=0.95660000 Z=0.18890000
S          NPT=  781  R0=.000100000 RMT= 2.08        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=0.59890000 Z=0.12190000
          MULT= 2          ISPLIT= 8
     -10: X=0.50000000 Y=0.40110000 Z=0.62190000
S          NPT=  781  R0=.000100000 RMT= 2.08        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000