P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 20.645825 12.413611  9.249454 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.50000000 Y=0.00000000 Z=0.50000000
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
      -1: X=0.00000000 Y=0.50000000 Z=0.00000000
Na         NPT=  781  R0=.000100000 RMT= 2.06        Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.21990000 Y=0.25000000 Z=0.51200000
          MULT= 4          ISPLIT= 8
      -2: X=0.78010000 Y=0.75000000 Z=0.48800000
      -2: X=0.71990000 Y=0.25000000 Z=0.98800000
      -2: X=0.28010000 Y=0.75000000 Z=0.01200000
Na         NPT=  781  R0=.000100000 RMT= 2.06        Z:  11.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.40360000 Y=0.25000000 Z=0.07460000
          MULT= 4          ISPLIT= 8
      -3: X=0.59640000 Y=0.75000000 Z=0.92540000
      -3: X=0.90360000 Y=0.25000000 Z=0.42540000
      -3: X=0.09640000 Y=0.75000000 Z=0.57460000
Be         NPT=  781  R0=.000100000 RMT= 1.31        Z:   4.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.40660000 Y=0.25000000 Z=0.75850000
          MULT= 4          ISPLIT= 8
      -4: X=0.59340000 Y=0.75000000 Z=0.24150000
      -4: X=0.90660000 Y=0.25000000 Z=0.74150000
      -4: X=0.09340000 Y=0.75000000 Z=0.25850000
F          NPT=  781  R0=.000100000 RMT= 1.60        Z:   9.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.03640000 Y=0.25000000 Z=0.30400000
          MULT= 4          ISPLIT= 8
      -5: X=0.96360000 Y=0.75000000 Z=0.69600000
      -5: X=0.53640000 Y=0.25000000 Z=0.19600000
      -5: X=0.46360000 Y=0.75000000 Z=0.80400000
F          NPT=  781  R0=.000100000 RMT= 1.60        Z:   9.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.33870000 Y=0.05960000 Z=0.19430000
          MULT= 8          ISPLIT= 8
      -6: X=0.66130000 Y=0.94040000 Z=0.80570000
      -6: X=0.83870000 Y=0.05960000 Z=0.30570000
      -6: X=0.16130000 Y=0.94040000 Z=0.69430000
      -6: X=0.16130000 Y=0.55960000 Z=0.69430000
      -6: X=0.83870000 Y=0.44040000 Z=0.30570000
      -6: X=0.66130000 Y=0.55960000 Z=0.80570000
      -6: X=0.33870000 Y=0.44040000 Z=0.19430000
F          NPT=  781  R0=.000100000 RMT= 1.60        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000