P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma    
MODE OF CALC=RELA unit=bohr
 14.899924 17.153044 21.742244 90.000000 90.000000 90.000000
ATOM  -1: X=0.19411000 Y=0.06098000 Z=0.06090000
          MULT= 8          ISPLIT=15
      -1: X=0.80589000 Y=0.93902000 Z=0.93910000
      -1: X=0.69411000 Y=0.06098000 Z=0.43910000
      -1: X=0.30589000 Y=0.93902000 Z=0.56090000
      -1: X=0.30589000 Y=0.56098000 Z=0.56090000
      -1: X=0.69411000 Y=0.43902000 Z=0.43910000
      -1: X=0.80589000 Y=0.56098000 Z=0.93910000
      -1: X=0.19411000 Y=0.43902000 Z=0.06090000
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  -2: X=0.02803000 Y=0.25000000 Z=0.50931000
          MULT= 4          ISPLIT=15
      -2: X=0.97197000 Y=0.75000000 Z=0.49069000
      -2: X=0.52803000 Y=0.25000000 Z=0.99069000
      -2: X=0.47197000 Y=0.75000000 Z=0.00931000
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=0.18579000 Y=0.25000000 Z=0.78086000
          MULT= 4          ISPLIT=15
      -3: X=0.81421000 Y=0.75000000 Z=0.21914000
      -3: X=0.68579000 Y=0.25000000 Z=0.71914000
      -3: X=0.31421000 Y=0.75000000 Z=0.28086000
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=0.35504000 Y=0.25000000 Z=0.28577000
          MULT= 4          ISPLIT=15
      -4: X=0.64496000 Y=0.75000000 Z=0.71423000
      -4: X=0.85504000 Y=0.25000000 Z=0.21423000
      -4: X=0.14496000 Y=0.75000000 Z=0.78577000
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  -5: X=0.06631000 Y=0.00288000 Z=0.32655000
          MULT= 8          ISPLIT=15
      -5: X=0.93369000 Y=0.99712000 Z=0.67345000
      -5: X=0.56631000 Y=0.00288000 Z=0.17345000
      -5: X=0.43369000 Y=0.99712000 Z=0.82655000
      -5: X=0.43369000 Y=0.50288000 Z=0.82655000
      -5: X=0.56631000 Y=0.49712000 Z=0.17345000
      -5: X=0.93369000 Y=0.50288000 Z=0.67345000
      -5: X=0.06631000 Y=0.49712000 Z=0.32655000
Sb         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  51.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.41082000 Y=0.25000000 Z=0.54113000
          MULT= 4          ISPLIT=15
      -6: X=0.58918000 Y=0.75000000 Z=0.45887000
      -6: X=0.91082000 Y=0.25000000 Z=0.95887000
      -6: X=0.08918000 Y=0.75000000 Z=0.04113000
Sb         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  51.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000