B   LATTICE,NONEQUIV.ATOMS   4  142 I41/acd                                    
MODE OF CALC=RELA unit=bohr                                                    
 23.035762 23.035762 40.298410 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.09400000 Y=0.12700000 Z=0.31180000
          MULT=16          ISPLIT= 8
      -1: X=0.90600000 Y=0.87300000 Z=0.68820000
      -1: X=0.12300000 Y=0.84400000 Z=0.56180000
      -1: X=0.37700000 Y=0.65600000 Z=0.93820000
      -1: X=0.90600000 Y=0.12700000 Z=0.81180000
      -1: X=0.09400000 Y=0.87300000 Z=0.18820000
      -1: X=0.90600000 Y=0.37300000 Z=0.31180000
      -1: X=0.09400000 Y=0.62700000 Z=0.68820000
      -1: X=0.12300000 Y=0.65600000 Z=0.06180000
      -1: X=0.37700000 Y=0.84400000 Z=0.43820000
      -1: X=0.37700000 Y=0.15600000 Z=0.06180000
      -1: X=0.12300000 Y=0.34400000 Z=0.43820000
      -1: X=0.09400000 Y=0.37300000 Z=0.81180000
      -1: X=0.90600000 Y=0.62700000 Z=0.18820000
      -1: X=0.37700000 Y=0.34400000 Z=0.56180000
      -1: X=0.12300000 Y=0.15600000 Z=0.93820000
Be         NPT=  781  R0=.000100000 RMT= 1.91        Z:   4.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.27020000 Y=0.27767000 Z=0.12571000
          MULT=16          ISPLIT= 8
      -2: X=0.72980000 Y=0.72233000 Z=0.87429000
      -2: X=0.97233000 Y=0.02020000 Z=0.37571000
      -2: X=0.52767000 Y=0.47980000 Z=0.12429000
      -2: X=0.72980000 Y=0.27767000 Z=0.62571000
      -2: X=0.27020000 Y=0.72233000 Z=0.37429000
      -2: X=0.72980000 Y=0.22233000 Z=0.12571000
      -2: X=0.27020000 Y=0.77767000 Z=0.87429000
      -2: X=0.97233000 Y=0.47980000 Z=0.87571000
      -2: X=0.52767000 Y=0.02020000 Z=0.62429000
      -2: X=0.52767000 Y=0.97980000 Z=0.87571000
      -2: X=0.97233000 Y=0.52020000 Z=0.62429000
      -2: X=0.27020000 Y=0.22233000 Z=0.62571000
      -2: X=0.72980000 Y=0.77767000 Z=0.37429000
      -2: X=0.52767000 Y=0.52020000 Z=0.37571000
      -2: X=0.97233000 Y=0.97980000 Z=0.12429000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
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=0.00735000
          MULT= 8          ISPLIT= 8
      -3: X=0.00000000 Y=0.75000000 Z=0.99265000
      -3: X=0.00000000 Y=0.75000000 Z=0.25735000
      -3: X=0.50000000 Y=0.75000000 Z=0.24265000
      -3: X=0.00000000 Y=0.25000000 Z=0.50735000
      -3: X=0.00000000 Y=0.75000000 Z=0.49265000
      -3: X=0.00000000 Y=0.75000000 Z=0.75735000
      -3: X=0.50000000 Y=0.75000000 Z=0.74265000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.20568000 Y=0.00000000 Z=0.25000000
          MULT= 8          ISPLIT= 8
      -4: X=0.79432000 Y=0.00000000 Z=0.75000000
      -4: X=0.25000000 Y=0.95568000 Z=0.50000000
      -4: X=0.25000000 Y=0.54432000 Z=0.00000000
      -4: X=0.79432000 Y=0.50000000 Z=0.25000000
      -4: X=0.20568000 Y=0.50000000 Z=0.75000000
      -4: X=0.25000000 Y=0.04432000 Z=0.00000000
      -4: X=0.25000000 Y=0.45568000 Z=0.50000000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000