CXY LATTICE,NONEQUIV.ATOMS   9   65 Cmmm                                       
MODE OF CALC=RELA unit=bohr                                                    
 22.296879 23.073556 22.860017 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.16033000 Z=0.50000000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.83967000 Z=0.50000000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.33748000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.66252000 Y=0.00000000 Z=0.00000000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.16015000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.00000000 Z=0.83985000
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  -4: X=0.00000000 Y=0.50000000 Z=0.32474000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.50000000 Z=0.67526000
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=0.25000000 Y=0.25000000 Z=0.25577000
          MULT= 4          ISPLIT= 8
      -5: X=0.75000000 Y=0.75000000 Z=0.74423000
      -5: X=0.75000000 Y=0.25000000 Z=0.25577000
      -5: X=0.25000000 Y=0.75000000 Z=0.74423000
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=0.30549000 Y=0.10568000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -6: X=0.69451000 Y=0.89432000 Z=0.50000000
      -6: X=0.69451000 Y=0.10568000 Z=0.50000000
      -6: X=0.30549000 Y=0.89432000 Z=0.50000000
Ge         NPT=  781  R0=.000050000 RMT= 2.42        Z:  32.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.13872000 Y=0.20215000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -7: X=0.86128000 Y=0.79785000 Z=0.00000000
      -7: X=0.86128000 Y=0.20215000 Z=0.00000000
      -7: X=0.13872000 Y=0.79785000 Z=0.00000000
Ge         NPT=  781  R0=.000050000 RMT= 2.42        Z:  32.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.00000000 Y=0.29357000 Z=0.13938000
          MULT= 4          ISPLIT= 8
      -8: X=0.00000000 Y=0.70643000 Z=0.86062000
      -8: X=0.00000000 Y=0.29357000 Z=0.86062000
      -8: X=0.00000000 Y=0.70643000 Z=0.13938000
Ge         NPT=  781  R0=.000050000 RMT= 2.42        Z:  32.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -9: X=0.19770000 Y=0.00000000 Z=0.34901000
          MULT= 4          ISPLIT= 8
      -9: X=0.80230000 Y=0.00000000 Z=0.65099000
      -9: X=0.19770000 Y=0.00000000 Z=0.65099000
      -9: X=0.80230000 Y=0.00000000 Z=0.34901000
Ge         NPT=  781  R0=.000050000 RMT= 2.42        Z:  32.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000