CXZ LATTICE,NONEQUIV.ATOMS  12   12 B2/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 29.048114 26.818993  6.659773 90.000000 90.000000 75.260000                   
ATOM  -1: X=0.00000000 Y=0.50000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
Nb         NPT=  781  R0=.000010000 RMT= 2.36        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.50000000
          MULT= 1          ISPLIT= 8
Nb         NPT=  781  R0=.000010000 RMT= 2.36        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.56900000 Y=0.32700000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.43100000 Y=0.67300000 Z=0.00000000
Nb         NPT=  781  R0=.000010000 RMT= 2.36        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.19500000 Y=0.18800000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -4: X=0.80500000 Y=0.81200000 Z=0.00000000
Nb         NPT=  781  R0=.000010000 RMT= 2.36        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.79000000 Y=0.30000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -5: X=0.21000000 Y=0.70000000 Z=0.00000000
Nb         NPT=  781  R0=.000010000 RMT= 2.36        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.66200000 Y=0.52800000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -6: X=0.33800000 Y=0.47200000 Z=0.00000000
Nb         NPT=  781  R0=.000010000 RMT= 2.36        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.99700000 Y=0.16500000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -7: X=0.00300000 Y=0.83500000 Z=0.00000000
Nb         NPT=  781  R0=.000010000 RMT= 2.36        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.82500000 Y=0.04000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -8: X=0.17500000 Y=0.96000000 Z=0.00000000
Nb         NPT=  781  R0=.000010000 RMT= 2.36        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.82600000 Y=0.61200000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -9: X=0.17400000 Y=0.38800000 Z=0.00000000
As         NPT=  781  R0=.000050000 RMT= 2.36        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 -10: X=0.62600000 Y=0.10200000 Z=0.00000000
          MULT= 2          ISPLIT= 8
     -10: X=0.37400000 Y=0.89800000 Z=0.00000000
As         NPT=  781  R0=.000050000 RMT= 2.36        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 -11: X=0.37000000 Y=0.16400000 Z=0.00000000
          MULT= 2          ISPLIT= 8
     -11: X=0.63000000 Y=0.83600000 Z=0.00000000
As         NPT=  781  R0=.000050000 RMT= 2.36        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 -12: X=0.93600000 Y=0.34900000 Z=0.00000000
          MULT= 2          ISPLIT= 8
     -12: X=0.06400000 Y=0.65100000 Z=0.00000000
As         NPT=  781  R0=.000050000 RMT= 2.36        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000