P   LATTICE,NONEQUIV.ATOMS  12   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 14.836240 13.917644 12.642268 90.000000 90.000000117.213000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.00000000 Z=0.50000000
Zn         NPT=  781  R0=.000050000 RMT= 1.88        Z:  30.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.74630000 Y=0.62180000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.25370000 Y=0.37820000 Z=0.75000000
Zn         NPT=  781  R0=.000050000 RMT= 1.88        Z:  30.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.22630000 Y=0.83520000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.77370000 Y=0.16480000 Z=0.75000000
Zn         NPT=  781  R0=.000050000 RMT= 1.88        Z:  30.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.28510000 Y=0.44140000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.71490000 Y=0.55860000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 1.31        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  -5: X=0.69590000 Y=0.14990000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.30410000 Y=0.85010000 Z=0.75000000
S          NPT=  781  R0=.000100000 RMT= 1.31        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=0.99320000 Y=0.87050000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.00680000 Y=0.12950000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.24160000 Y=0.31130000 Z=0.07300000
          MULT= 4          ISPLIT= 8
      -7: X=0.75840000 Y=0.68870000 Z=0.92700000
      -7: X=0.75840000 Y=0.68870000 Z=0.57300000
      -7: X=0.24160000 Y=0.31130000 Z=0.42700000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.78830000 Y=0.11310000 Z=0.07030000
          MULT= 4          ISPLIT= 8
      -8: X=0.21170000 Y=0.88690000 Z=0.92970000
      -8: X=0.21170000 Y=0.88690000 Z=0.57030000
      -8: X=0.78830000 Y=0.11310000 Z=0.42970000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.17180000 Y=0.55080000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -9: X=0.82820000 Y=0.44920000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM -10: X=0.48740000 Y=0.59360000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -10: X=0.51260000 Y=0.40640000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM -11: X=0.49330000 Y=0.02700000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -11: X=0.50670000 Y=0.97300000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM -12: X=0.74000000 Y=0.36570000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -12: X=0.26000000 Y=0.63430000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000