CXZ LATTICE,NONEQUIV.ATOMS   7   15 B2/b                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.312657 23.709449 21.216144 90.000000 90.000000 87.413000                   
ATOM  -1: X=0.76700000 Y=0.33990000 Z=0.00230000
          MULT= 4          ISPLIT= 8
      -1: X=0.23300000 Y=0.66010000 Z=0.99770000
      -1: X=0.23300000 Y=0.16010000 Z=0.00230000
      -1: X=0.76700000 Y=0.83990000 Z=0.99770000
Nb         NPT=  781  R0=.000010000 RMT= 1.88        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.72740000 Y=0.07710000 Z=0.11420000
          MULT= 4          ISPLIT= 8
      -2: X=0.27260000 Y=0.92290000 Z=0.88580000
      -2: X=0.27260000 Y=0.42290000 Z=0.11420000
      -2: X=0.72740000 Y=0.57710000 Z=0.88580000
Sr         NPT=  781  R0=.000010000 RMT= 2.49        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  -3: X=0.75800000 Y=0.35200000 Z=0.29860000
          MULT= 4          ISPLIT= 8
      -3: X=0.24200000 Y=0.64800000 Z=0.70140000
      -3: X=0.24200000 Y=0.14800000 Z=0.29860000
      -3: X=0.75800000 Y=0.85200000 Z=0.70140000
Sr         NPT=  781  R0=.000010000 RMT= 2.49        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  -4: X=0.72800000 Y=0.46400000 Z=0.09400000
          MULT= 4          ISPLIT= 8
      -4: X=0.27200000 Y=0.53600000 Z=0.90600000
      -4: X=0.27200000 Y=0.03600000 Z=0.09400000
      -4: X=0.72800000 Y=0.96400000 Z=0.90600000
N          NPT=  781  R0=.000100000 RMT= 1.62        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.66600000 Y=0.14600000 Z=0.34100000
          MULT= 4          ISPLIT= 8
      -5: X=0.33400000 Y=0.85400000 Z=0.65900000
      -5: X=0.33400000 Y=0.35400000 Z=0.34100000
      -5: X=0.66600000 Y=0.64600000 Z=0.65900000
N          NPT=  781  R0=.000100000 RMT= 1.62        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.00000000 Y=0.25000000 Z=0.06200000
          MULT= 2          ISPLIT= 8
      -6: X=0.00000000 Y=0.75000000 Z=0.93800000
N          NPT=  781  R0=.000100000 RMT= 1.62        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.00000000 Y=0.25000000 Z=0.49100000
          MULT= 2          ISPLIT= 8
      -7: X=0.00000000 Y=0.75000000 Z=0.50900000
N          NPT=  781  R0=.000100000 RMT= 1.62        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000