CXY LATTICE,NONEQUIV.ATOMS   7   64 Cmca                                       
MODE OF CALC=RELA unit=bohr                                                    
 38.699701 12.972970 30.571989 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.42010000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.57990000 Y=0.00000000 Z=0.00000000
      -1: X=0.42010000 Y=0.50000000 Z=0.50000000
      -1: X=0.57990000 Y=0.50000000 Z=0.50000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.25390000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.74610000 Y=0.00000000 Z=0.00000000
      -2: X=0.25390000 Y=0.50000000 Z=0.50000000
      -2: X=0.74610000 Y=0.50000000 Z=0.50000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
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=0.22840000 Z=0.31823000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.77160000 Z=0.68177000
      -3: X=0.00000000 Y=0.72840000 Z=0.18177000
      -3: X=0.00000000 Y=0.27160000 Z=0.81823000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.16680000 Y=0.27640000 Z=0.17554000
          MULT= 8          ISPLIT= 8
      -4: X=0.83320000 Y=0.72360000 Z=0.82446000
      -4: X=0.16680000 Y=0.77640000 Z=0.32446000
      -4: X=0.83320000 Y=0.22360000 Z=0.67554000
      -4: X=0.83320000 Y=0.27640000 Z=0.17554000
      -4: X=0.16680000 Y=0.72360000 Z=0.82446000
      -4: X=0.83320000 Y=0.77640000 Z=0.32446000
      -4: X=0.16680000 Y=0.22360000 Z=0.67554000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.08729000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.91271000 Y=0.00000000 Z=0.00000000
      -5: X=0.08729000 Y=0.50000000 Z=0.50000000
      -5: X=0.91271000 Y=0.50000000 Z=0.50000000
Sn         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  50.00000              
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=0.20030000 Z=0.08310000
          MULT= 4          ISPLIT= 8
      -6: X=0.00000000 Y=0.79970000 Z=0.91690000
      -6: X=0.00000000 Y=0.70030000 Z=0.41690000
      -6: X=0.00000000 Y=0.29970000 Z=0.58310000
P          NPT=  781  R0=.000100000 RMT= 2.09        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -7: X=0.34344000 Y=0.28260000 Z=0.09260000
          MULT= 8          ISPLIT= 8
      -7: X=0.65656000 Y=0.71740000 Z=0.90740000
      -7: X=0.34344000 Y=0.78260000 Z=0.40740000
      -7: X=0.65656000 Y=0.21740000 Z=0.59260000
      -7: X=0.65656000 Y=0.28260000 Z=0.09260000
      -7: X=0.34344000 Y=0.71740000 Z=0.90740000
      -7: X=0.65656000 Y=0.78260000 Z=0.40740000
      -7: X=0.34344000 Y=0.21740000 Z=0.59260000
P          NPT=  781  R0=.000100000 RMT= 2.09        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000