P   LATTICE,NONEQUIV.ATOMS  10   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 12.948403 10.202631 23.014975 90.000000 90.000000106.370000                   
ATOM  -1: X=0.01992000 Y=0.76082000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.98008000 Y=0.23918000 Z=0.75000000
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=0.68431000 Y=0.15801000 Z=0.09886000
          MULT= 4          ISPLIT= 8
      -2: X=0.31569000 Y=0.84199000 Z=0.90114000
      -2: X=0.31569000 Y=0.84199000 Z=0.59886000
      -2: X=0.68431000 Y=0.15801000 Z=0.40114000
Y          NPT=  781  R0=.000010000 RMT= 2.16        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=0.48917000 Y=0.58242000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.51083000 Y=0.41758000 Z=0.75000000
Si         NPT=  781  R0=.000100000 RMT= 1.39        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.21344000 Y=0.30379000 Z=0.06205000
          MULT= 4          ISPLIT= 8
      -4: X=0.78656000 Y=0.69621000 Z=0.93795000
      -4: X=0.78656000 Y=0.69621000 Z=0.56205000
      -4: X=0.21344000 Y=0.30379000 Z=0.43795000
Si         NPT=  781  R0=.000100000 RMT= 1.39        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.61580000 Y=0.37230000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.38420000 Y=0.62770000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.63440000 Y=0.87660000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.36560000 Y=0.12340000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.33970000 Y=0.54830000 Z=0.14287000
          MULT= 4          ISPLIT= 8
      -7: X=0.66030000 Y=0.45170000 Z=0.85713000
      -7: X=0.66030000 Y=0.45170000 Z=0.64287000
      -7: X=0.33970000 Y=0.54830000 Z=0.35713000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.19070000 Y=0.43080000 Z=0.55455000
          MULT= 4          ISPLIT= 8
      -8: X=0.80930000 Y=0.56920000 Z=0.44545000
      -8: X=0.80930000 Y=0.56920000 Z=0.05455000
      -8: X=0.19070000 Y=0.43080000 Z=0.94545000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.00300000 Y=0.16520000 Z=0.12347000
          MULT= 4          ISPLIT= 8
      -9: X=0.99700000 Y=0.83480000 Z=0.87653000
      -9: X=0.99700000 Y=0.83480000 Z=0.62347000
      -9: X=0.00300000 Y=0.16520000 Z=0.37653000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM -10: X=0.35110000 Y=0.10020000 Z=0.05192000
          MULT= 4          ISPLIT= 8
     -10: X=0.64890000 Y=0.89980000 Z=0.94808000
     -10: X=0.64890000 Y=0.89980000 Z=0.55192000
     -10: X=0.35110000 Y=0.10020000 Z=0.44808000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000