P   LATTICE,NONEQUIV.ATOMS   9   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 14.516876 10.569238 20.904150 90.000000 90.000000109.100000                   
ATOM  -1: X=0.85100000 Y=0.34740000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.14900000 Y=0.65260000 Z=0.75000000
As         NPT=  781  R0=.000050000 RMT= 1.64        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.03980000 Y=0.43800000 Z=0.64020000
          MULT= 4          ISPLIT= 8
      -2: X=0.96020000 Y=0.56200000 Z=0.35980000
      -2: X=0.96020000 Y=0.56200000 Z=0.14020000
      -2: X=0.03980000 Y=0.43800000 Z=0.85980000
F          NPT=  781  R0=.000100000 RMT= 1.56        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.74810000 Y=0.13240000 Z=0.13870000
          MULT= 4          ISPLIT= 8
      -3: X=0.25190000 Y=0.86760000 Z=0.86130000
      -3: X=0.25190000 Y=0.86760000 Z=0.63870000
      -3: X=0.74810000 Y=0.13240000 Z=0.36130000
F          NPT=  781  R0=.000100000 RMT= 1.56        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.66890000 Y=0.45790000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.33110000 Y=0.54210000 Z=0.75000000
F          NPT=  781  R0=.000100000 RMT= 1.56        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.14660000 Y=0.15370000 Z=0.12450000
          MULT= 4          ISPLIT= 8
      -5: X=0.85340000 Y=0.84630000 Z=0.87550000
      -5: X=0.85340000 Y=0.84630000 Z=0.62450000
      -5: X=0.14660000 Y=0.15370000 Z=0.37550000
S          NPT=  781  R0=.000100000 RMT= 1.45        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.39660000 Y=0.67690000 Z=0.11750000
          MULT= 4          ISPLIT= 8
      -6: X=0.60340000 Y=0.32310000 Z=0.88250000
      -6: X=0.60340000 Y=0.32310000 Z=0.61750000
      -6: X=0.39660000 Y=0.67690000 Z=0.38250000
S          NPT=  781  R0=.000100000 RMT= 1.45        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.05180000 Y=0.21700000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -7: X=0.94820000 Y=0.78300000 Z=0.75000000
N          NPT=  781  R0=.000100000 RMT= 1.45        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.29880000 Y=0.40210000 Z=0.07710000
          MULT= 4          ISPLIT= 8
      -8: X=0.70120000 Y=0.59790000 Z=0.92290000
      -8: X=0.70120000 Y=0.59790000 Z=0.57710000
      -8: X=0.29880000 Y=0.40210000 Z=0.42290000
N          NPT=  781  R0=.000100000 RMT= 1.45        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.37030000 Y=0.75790000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -9: X=0.62970000 Y=0.24210000 Z=0.75000000
N          NPT=  781  R0=.000100000 RMT= 1.45        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000