B   LATTICE,NONEQUIV.ATOMS   4  142 I41/acd                                    
MODE OF CALC=RELA unit=bohr                                                    
 21.646813 21.646813 39.064419 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.12500000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.75000000 Z=0.87500000
      -1: X=0.00000000 Y=0.75000000 Z=0.37500000
      -1: X=0.50000000 Y=0.75000000 Z=0.12500000
Sr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  38.00000              
LOCAL ROT MATRIX:    0.7071068 0.7071068 0.0000000
                    -0.7071068 0.7071068 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.03750000 Y=0.00000000 Z=0.25000000
          MULT= 8          ISPLIT= 8
      -2: X=0.96250000 Y=0.00000000 Z=0.75000000
      -2: X=0.25000000 Y=0.78750000 Z=0.50000000
      -2: X=0.25000000 Y=0.71250000 Z=0.00000000
      -2: X=0.96250000 Y=0.50000000 Z=0.25000000
      -2: X=0.03750000 Y=0.50000000 Z=0.75000000
      -2: X=0.25000000 Y=0.21250000 Z=0.00000000
      -2: X=0.25000000 Y=0.28750000 Z=0.50000000
Al         NPT=  781  R0=.000100000 RMT= 1.98        Z:  13.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.25060000 Y=0.31610000 Z=0.08410000
          MULT=16          ISPLIT= 8
      -3: X=0.74940000 Y=0.68390000 Z=0.91590000
      -3: X=0.93390000 Y=0.00060000 Z=0.33410000
      -3: X=0.56610000 Y=0.49940000 Z=0.16590000
      -3: X=0.74940000 Y=0.31610000 Z=0.58410000
      -3: X=0.25060000 Y=0.68390000 Z=0.41590000
      -3: X=0.74940000 Y=0.18390000 Z=0.08410000
      -3: X=0.25060000 Y=0.81610000 Z=0.91590000
      -3: X=0.93390000 Y=0.49940000 Z=0.83410000
      -3: X=0.56610000 Y=0.00060000 Z=0.66590000
      -3: X=0.56610000 Y=0.99940000 Z=0.83410000
      -3: X=0.93390000 Y=0.50060000 Z=0.66590000
      -3: X=0.25060000 Y=0.18390000 Z=0.58410000
      -3: X=0.74940000 Y=0.81610000 Z=0.41590000
      -3: X=0.56610000 Y=0.50060000 Z=0.33410000
      -3: X=0.93390000 Y=0.99940000 Z=0.16590000
Cl         NPT=  781  R0=.000100000 RMT= 1.98        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.09630000 Y=0.11170000 Z=0.01180000
          MULT=16          ISPLIT= 8
      -4: X=0.90370000 Y=0.88830000 Z=0.98820000
      -4: X=0.13830000 Y=0.84630000 Z=0.26180000
      -4: X=0.36170000 Y=0.65370000 Z=0.23820000
      -4: X=0.90370000 Y=0.11170000 Z=0.51180000
      -4: X=0.09630000 Y=0.88830000 Z=0.48820000
      -4: X=0.90370000 Y=0.38830000 Z=0.01180000
      -4: X=0.09630000 Y=0.61170000 Z=0.98820000
      -4: X=0.13830000 Y=0.65370000 Z=0.76180000
      -4: X=0.36170000 Y=0.84630000 Z=0.73820000
      -4: X=0.36170000 Y=0.15370000 Z=0.76180000
      -4: X=0.13830000 Y=0.34630000 Z=0.73820000
      -4: X=0.09630000 Y=0.38830000 Z=0.51180000
      -4: X=0.90370000 Y=0.61170000 Z=0.48820000
      -4: X=0.36170000 Y=0.34630000 Z=0.26180000
      -4: X=0.13830000 Y=0.15370000 Z=0.23820000
Cl         NPT=  781  R0=.000100000 RMT= 1.98        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000