P   LATTICE,NONEQUIV.ATOMS  12   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 23.863462 22.002081  7.150724 90.000000 90.000000105.810000                   
ATOM  -1: X=0.38480000 Y=0.38950000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.61520000 Y=0.61050000 Z=0.75000000
Sn         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  50.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.61770000 Y=0.97830000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.38230000 Y=0.02170000 Z=0.75000000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.12510000 Y=0.01140000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.87490000 Y=0.98860000 Z=0.75000000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.70930000 Y=0.35010000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.29070000 Y=0.64990000 Z=0.75000000
Sn         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  50.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.03040000 Y=0.35370000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.96960000 Y=0.64630000 Z=0.75000000
Sn         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  50.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.93250000 Y=0.86520000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.06750000 Y=0.13480000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 2.13        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=0.81830000 Y=0.11030000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -7: X=0.18170000 Y=0.88970000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 2.13        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  -8: X=0.32690000 Y=0.15120000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -8: X=0.67310000 Y=0.84880000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 2.13        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  -9: X=0.41390000 Y=0.88080000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -9: X=0.58610000 Y=0.11920000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 2.13        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 -10: X=0.74860000 Y=0.59060000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -10: X=0.25140000 Y=0.40940000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 2.13        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 -11: X=0.46980000 Y=0.61850000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -11: X=0.53020000 Y=0.38150000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 2.13        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 -12: X=0.11140000 Y=0.59760000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -12: X=0.88860000 Y=0.40240000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 2.13        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000