B   LATTICE,NONEQUIV.ATOMS   3   88 I41/a                                      
MODE OF CALC=RELA unit=bohr                                                    
 12.290779 12.290779 27.155365 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.62500000
          MULT= 2          ISPLIT=-2
      -1: X=0.00000000 Y=0.75000000 Z=0.37500000
Sr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  38.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.25913000 Y=0.09368000 Z=0.04332000
          MULT= 8          ISPLIT= 8
      -2: X=0.74087000 Y=0.90632000 Z=0.95668000
      -2: X=0.15632000 Y=0.00913000 Z=0.79332000
      -2: X=0.34368000 Y=0.49087000 Z=0.70668000
      -2: X=0.74087000 Y=0.40632000 Z=0.04332000
      -2: X=0.25913000 Y=0.59368000 Z=0.95668000
      -2: X=0.34368000 Y=0.99087000 Z=0.29332000
      -2: X=0.15632000 Y=0.50913000 Z=0.20668000
Cl         NPT=  781  R0=.000100000 RMT= 1.99        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  -3: X=0.00000000 Y=0.25000000 Z=0.12500000
          MULT= 2          ISPLIT=-2
      -3: X=0.00000000 Y=0.75000000 Z=0.87500000
Zn         NPT=  781  R0=.000050000 RMT= 2.31        Z:  30.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000