P   LATTICE,NONEQUIV.ATOMS   7   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 28.215501 15.536761 12.470114 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.09211000 Y=0.25000000 Z=0.64252000
          MULT= 4          ISPLIT= 8
      -1: X=0.90789000 Y=0.75000000 Z=0.35748000
      -1: X=0.59211000 Y=0.25000000 Z=0.85748000
      -1: X=0.40789000 Y=0.75000000 Z=0.14252000
Sn         NPT=  781  R0=.000010000 RMT= 2.41        Z:  50.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.43197000 Y=0.25000000 Z=0.72830000
          MULT= 4          ISPLIT= 8
      -2: X=0.56803000 Y=0.75000000 Z=0.27170000
      -2: X=0.93197000 Y=0.25000000 Z=0.77170000
      -2: X=0.06803000 Y=0.75000000 Z=0.22830000
Se         NPT=  781  R0=.000050000 RMT= 2.29        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.33872000 Y=0.00248000 Z=0.28428000
          MULT= 8          ISPLIT= 8
      -3: X=0.66128000 Y=0.99752000 Z=0.71572000
      -3: X=0.83872000 Y=0.00248000 Z=0.21572000
      -3: X=0.16128000 Y=0.99752000 Z=0.78428000
      -3: X=0.16128000 Y=0.50248000 Z=0.78428000
      -3: X=0.83872000 Y=0.49752000 Z=0.21572000
      -3: X=0.66128000 Y=0.50248000 Z=0.71572000
      -3: X=0.33872000 Y=0.49752000 Z=0.28428000
Se         NPT=  781  R0=.000050000 RMT= 2.29        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.08222000 Y=0.25000000 Z=0.26367000
          MULT= 4          ISPLIT= 8
      -4: X=0.91778000 Y=0.75000000 Z=0.73633000
      -4: X=0.58222000 Y=0.25000000 Z=0.23633000
      -4: X=0.41778000 Y=0.75000000 Z=0.76367000
Se         NPT=  781  R0=.000050000 RMT= 2.29        Z:  34.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.50000000 Y=0.00000000 Z=0.50000000
      -5: X=0.50000000 Y=0.50000000 Z=0.50000000
      -5: X=0.00000000 Y=0.50000000 Z=0.00000000
Li         NPT=  781  R0=.000100000 RMT= 1.99        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.17800000 Y=0.00500000 Z=0.18000000
          MULT= 8          ISPLIT= 8
      -6: X=0.82200000 Y=0.99500000 Z=0.82000000
      -6: X=0.67800000 Y=0.00500000 Z=0.32000000
      -6: X=0.32200000 Y=0.99500000 Z=0.68000000
      -6: X=0.32200000 Y=0.50500000 Z=0.68000000
      -6: X=0.67800000 Y=0.49500000 Z=0.32000000
      -6: X=0.82200000 Y=0.50500000 Z=0.82000000
      -6: X=0.17800000 Y=0.49500000 Z=0.18000000
Li         NPT=  781  R0=.000100000 RMT= 1.99        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.41200000 Y=0.25000000 Z=0.10600000
          MULT= 4          ISPLIT= 8
      -7: X=0.58800000 Y=0.75000000 Z=0.89400000
      -7: X=0.91200000 Y=0.25000000 Z=0.39400000
      -7: X=0.08800000 Y=0.75000000 Z=0.60600000
Li         NPT=  781  R0=.000100000 RMT= 1.99        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000