P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 14.508183 10.967593 19.489124 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.16680000 Y=0.25000000 Z=0.40940000
          MULT= 4          ISPLIT= 8
      -1: X=0.83320000 Y=0.75000000 Z=0.59060000
      -1: X=0.66680000 Y=0.25000000 Z=0.09060000
      -1: X=0.33320000 Y=0.75000000 Z=0.90940000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.48850000 Y=0.25000000 Z=0.69300000
          MULT= 4          ISPLIT= 8
      -2: X=0.51150000 Y=0.75000000 Z=0.30700000
      -2: X=0.98850000 Y=0.25000000 Z=0.80700000
      -2: X=0.01150000 Y=0.75000000 Z=0.19300000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.23850000 Y=0.25000000 Z=0.08040000
          MULT= 4          ISPLIT= 8
      -3: X=0.76150000 Y=0.75000000 Z=0.91960000
      -3: X=0.73850000 Y=0.25000000 Z=0.41960000
      -3: X=0.26150000 Y=0.75000000 Z=0.58040000
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=0.31400000 Y=0.02840000 Z=0.14640000
          MULT= 8          ISPLIT= 8
      -4: X=0.68600000 Y=0.97160000 Z=0.85360000
      -4: X=0.81400000 Y=0.02840000 Z=0.35360000
      -4: X=0.18600000 Y=0.97160000 Z=0.64640000
      -4: X=0.18600000 Y=0.52840000 Z=0.64640000
      -4: X=0.81400000 Y=0.47160000 Z=0.35360000
      -4: X=0.68600000 Y=0.52840000 Z=0.85360000
      -4: X=0.31400000 Y=0.47160000 Z=0.14640000
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
ATOM  -5: X=0.03610000 Y=0.25000000 Z=0.08770000
          MULT= 4          ISPLIT= 8
      -5: X=0.96390000 Y=0.75000000 Z=0.91230000
      -5: X=0.53610000 Y=0.25000000 Z=0.41230000
      -5: X=0.46390000 Y=0.75000000 Z=0.58770000
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=0.79740000 Y=0.25000000 Z=0.56360000
          MULT= 4          ISPLIT= 8
      -6: X=0.20260000 Y=0.75000000 Z=0.43640000
      -6: X=0.29740000 Y=0.25000000 Z=0.93640000
      -6: X=0.70260000 Y=0.75000000 Z=0.06360000
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