CXY LATTICE,NONEQUIV.ATOMS   9   36 Cmc21                                      
MODE OF CALC=RELA unit=bohr                                                    
  8.529657 37.958929 26.631910 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.13056000 Z=0.31590000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.86944000 Z=0.81590000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.11897000 Z=0.68249000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.88103000 Z=0.18249000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.44442000 Z=0.43417000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.55558000 Z=0.93417000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.20918000 Z=0.01834000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.79082000 Z=0.51834000
Y          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  39.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.00000000 Y=0.35694000 Z=0.00121000
          MULT= 2          ISPLIT= 8
      -5: X=0.00000000 Y=0.64306000 Z=0.50121000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -6: X=0.00000000 Y=0.29199000 Z=0.66202000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.70801000 Z=0.16202000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -7: X=0.00000000 Y=0.30996000 Z=0.36523000
          MULT= 2          ISPLIT= 8
      -7: X=0.00000000 Y=0.69004000 Z=0.86523000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -8: X=0.00000000 Y=0.50431000 Z=0.26202000
          MULT= 2          ISPLIT= 8
      -8: X=0.00000000 Y=0.49569000 Z=0.76202000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -9: X=0.00000000 Y=0.04923000 Z=0.05114000
          MULT= 2          ISPLIT= 8
      -9: X=0.00000000 Y=0.95077000 Z=0.55114000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000