P   LATTICE,NONEQUIV.ATOMS   7   62 Pnma    
MODE OF CALC=RELA unit=bohr
 22.962629  7.859371 24.984447 90.000000 90.000000 90.000000
ATOM  -1: X=0.09647000 Y=0.25000000 Z=0.12402000
          MULT= 4          ISPLIT=15
      -1: X=0.90353000 Y=0.75000000 Z=0.87598000
      -1: X=0.59647000 Y=0.25000000 Z=0.37598000
      -1: X=0.40353000 Y=0.75000000 Z=0.62402000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.23154000 Y=0.25000000 Z=0.36970000
          MULT= 4          ISPLIT=15
      -2: X=0.76846000 Y=0.75000000 Z=0.63030000
      -2: X=0.73154000 Y=0.25000000 Z=0.13030000
      -2: X=0.26846000 Y=0.75000000 Z=0.86970000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.03425000 Y=0.25000000 Z=0.65165000
          MULT= 4          ISPLIT=15
      -3: X=0.96575000 Y=0.75000000 Z=0.34835000
      -3: X=0.53425000 Y=0.25000000 Z=0.84835000
      -3: X=0.46575000 Y=0.75000000 Z=0.15165000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.05450000 Y=0.25000000 Z=0.29810000
          MULT= 4          ISPLIT=15
      -4: X=0.94550000 Y=0.75000000 Z=0.70190000
      -4: X=0.55450000 Y=0.25000000 Z=0.20190000
      -4: X=0.44550000 Y=0.75000000 Z=0.79810000
N          NPT=  781  R0=.000100000 RMT=   2.00000   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=0.35320000 Y=0.25000000 Z=0.00341000
          MULT= 4          ISPLIT=15
      -5: X=0.64680000 Y=0.75000000 Z=0.99659000
      -5: X=0.85320000 Y=0.25000000 Z=0.49659000
      -5: X=0.14680000 Y=0.75000000 Z=0.50341000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.57243000 Y=0.25000000 Z=0.60723000
          MULT= 4          ISPLIT=15
      -6: X=0.42757000 Y=0.75000000 Z=0.39277000
      -6: X=0.07243000 Y=0.25000000 Z=0.89277000
      -6: X=0.92757000 Y=0.75000000 Z=0.10723000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.26553000 Y=0.25000000 Z=0.70546000
          MULT= 4          ISPLIT=15
      -7: X=0.73447000 Y=0.75000000 Z=0.29454000
      -7: X=0.76553000 Y=0.25000000 Z=0.79454000
      -7: X=0.23447000 Y=0.75000000 Z=0.20546000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000