CXZ LATTICE,NONEQUIV.ATOMS   5   12 B2/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 31.966607 13.653649  8.498476 90.000000 90.000000 66.853000                   
ATOM  -1: X=0.85630000 Y=0.58144000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.14370000 Y=0.41856000 Z=0.00000000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
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=0.00000000
          MULT= 1          ISPLIT= 8
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.67162000 Y=0.03659000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.32838000 Y=0.96341000 Z=0.00000000
Zn         NPT=  781  R0=.000050000 RMT= 2.49        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=0.79362000 Y=0.16733000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -4: X=0.20638000 Y=0.83267000 Z=0.00000000
As         NPT=  781  R0=.000050000 RMT= 2.32        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  -5: X=0.51105000 Y=0.32028000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -5: X=0.48895000 Y=0.67972000 Z=0.00000000
As         NPT=  781  R0=.000050000 RMT= 2.32        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000