CXZ LATTICE,NONEQUIV.ATOMS   7   12 B2/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 24.112905 21.807440  7.180959 90.000000 90.000000 75.200000                   
ATOM  -1: X=0.00000000 Y=0.50000000 Z=0.50000000
          MULT= 1          ISPLIT= 8
Y          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  39.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.61300000 Y=0.07700000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.38700000 Y=0.92300000 Z=0.00000000
Y          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  39.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.80200000 Y=0.31000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.19800000 Y=0.69000000 Z=0.00000000
Y          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  39.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
S          NPT=  781  R0=.000100000 RMT= 2.30        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=0.84100000 Y=0.55100000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -5: X=0.15900000 Y=0.44900000 Z=0.00000000
S          NPT=  781  R0=.000100000 RMT= 2.30        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=0.46000000 Y=0.28500000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -6: X=0.54000000 Y=0.71500000 Z=0.00000000
S          NPT=  781  R0=.000100000 RMT= 2.30        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=0.24100000 Y=0.13300000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -7: X=0.75900000 Y=0.86700000 Z=0.00000000
S          NPT=  781  R0=.000100000 RMT= 2.30        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000