CXZ LATTICE,NONEQUIV.ATOMS   7   12 B2/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 35.052530 12.835020 12.632819 90.000000 90.000000 81.660000                   
ATOM  -1: X=0.87080000 Y=0.45410000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.12920000 Y=0.54590000 Z=0.00000000
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=0.51517000 Y=0.20200000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.48483000 Y=0.79800000 Z=0.00000000
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  -3: X=0.64945000 Y=0.19789000 Z=0.23248000
          MULT= 4          ISPLIT= 8
      -3: X=0.35055000 Y=0.80211000 Z=0.76752000
      -3: X=0.35055000 Y=0.80211000 Z=0.23248000
      -3: X=0.64945000 Y=0.19789000 Z=0.76752000
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  -4: 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  -5: X=0.32245000 Y=0.30870000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -5: X=0.67755000 Y=0.69130000 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  -6: X=0.00000000 Y=0.50000000 Z=0.21300000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.50000000 Z=0.78700000
Li         NPT=  781  R0=.000100000 RMT= 2.15        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.79100000 Y=0.13000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -7: X=0.20900000 Y=0.87000000 Z=0.00000000
Li         NPT=  781  R0=.000100000 RMT= 2.15        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000