P   LATTICE,NONEQUIV.ATOMS   7   62 Pnma    
MODE OF CALC=RELA unit=bohr
 23.545988  7.672288 27.722282 90.000000 90.000000 90.000000
ATOM  -1: X=0.24000000 Y=0.25000000 Z=0.66600000
          MULT= 4          ISPLIT=15
      -1: X=0.76000000 Y=0.75000000 Z=0.33400000
      -1: X=0.74000000 Y=0.25000000 Z=0.83400000
      -1: X=0.26000000 Y=0.75000000 Z=0.16600000
Sr         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  38.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.56100000 Y=0.25000000 Z=0.61100000
          MULT= 4          ISPLIT=15
      -2: X=0.43900000 Y=0.75000000 Z=0.38900000
      -2: X=0.06100000 Y=0.25000000 Z=0.88900000
      -2: X=0.93900000 Y=0.75000000 Z=0.11100000
Lu         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  71.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.08300000 Y=0.25000000 Z=0.40300000
          MULT= 4          ISPLIT=15
      -3: X=0.91700000 Y=0.75000000 Z=0.59700000
      -3: X=0.58300000 Y=0.25000000 Z=0.09700000
      -3: X=0.41700000 Y=0.75000000 Z=0.90300000
Lu         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  71.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.29500000 Y=0.25000000 Z=0.33100000
          MULT= 4          ISPLIT=15
      -4: X=0.70500000 Y=0.75000000 Z=0.66900000
      -4: X=0.79500000 Y=0.25000000 Z=0.16900000
      -4: X=0.20500000 Y=0.75000000 Z=0.83100000
Se         NPT=  781  R0=.000050000 RMT=   2.00000   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  -5: X=0.37100000 Y=0.25000000 Z=0.03100000
          MULT= 4          ISPLIT=15
      -5: X=0.62900000 Y=0.75000000 Z=0.96900000
      -5: X=0.87100000 Y=0.25000000 Z=0.46900000
      -5: X=0.12900000 Y=0.75000000 Z=0.53100000
Se         NPT=  781  R0=.000050000 RMT=   2.00000   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  -6: X=0.47200000 Y=0.25000000 Z=0.78400000
          MULT= 4          ISPLIT=15
      -6: X=0.52800000 Y=0.75000000 Z=0.21600000
      -6: X=0.97200000 Y=0.25000000 Z=0.71600000
      -6: X=0.02800000 Y=0.75000000 Z=0.28400000
Se         NPT=  781  R0=.000050000 RMT=   2.00000   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  -7: X=0.09200000 Y=0.25000000 Z=0.07700000
          MULT= 4          ISPLIT=15
      -7: X=0.90800000 Y=0.75000000 Z=0.92300000
      -7: X=0.59200000 Y=0.25000000 Z=0.42300000
      -7: X=0.40800000 Y=0.75000000 Z=0.57700000
Se         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  34.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000