P   LATTICE,NONEQUIV.ATOMS   7   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 21.042101 15.068298  7.760538 90.000000 90.000000104.170000                   
ATOM  -1: X=0.43262000 Y=0.18924000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.56738000 Y=0.81076000 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=0.84340000 Y=0.53023000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.15660000 Y=0.46977000 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=0.91366000 Y=0.04709000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.08634000 Y=0.95291000 Z=0.75000000
Ag         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  47.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.39980000 Y=0.59550000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.60020000 Y=0.40450000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.16381000 Y=0.20156000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.83619000 Y=0.79844000 Z=0.75000000
Se         NPT=  781  R0=.000050000 RMT= 2.41        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.08700000 Y=0.69322000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.91300000 Y=0.30678000 Z=0.75000000
Se         NPT=  781  R0=.000050000 RMT= 2.41        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.65220000 Y=0.04734000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -7: X=0.34780000 Y=0.95266000 Z=0.75000000
Se         NPT=  781  R0=.000050000 RMT= 2.41        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000