P   LATTICE,NONEQUIV.ATOMS   6  129 P4/nmm  
MODE OF CALC=RELA unit=bohr
  7.127669  7.127669 22.833372 90.000000 90.000000 90.000000
ATOM  -1: X=0.75000000 Y=0.25000000 Z=0.00000000
          MULT= 2          ISPLIT=15
      -1: X=0.25000000 Y=0.75000000 Z=0.00000000
Li         NPT=  781  R0=.000100000 RMT=   2.00000   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  -2: X=0.25000000 Y=0.25000000 Z=0.61980000
          MULT= 2          ISPLIT=15
      -2: X=0.75000000 Y=0.75000000 Z=0.38020000
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=0.25000000 Y=0.25000000 Z=0.20500000
          MULT= 2          ISPLIT=15
      -3: X=0.75000000 Y=0.75000000 Z=0.79500000
Ti         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  22.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.75000000 Y=0.25000000 Z=0.24300000
          MULT= 4          ISPLIT=15
      -4: X=0.25000000 Y=0.75000000 Z=0.75700000
      -4: X=0.25000000 Y=0.75000000 Z=0.24300000
      -4: X=0.75000000 Y=0.25000000 Z=0.75700000
O          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   8.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.25000000 Y=0.25000000 Z=0.41800000
          MULT= 2          ISPLIT=15
      -5: X=0.75000000 Y=0.75000000 Z=0.58200000
O          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   8.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.25000000 Y=0.25000000 Z=0.05900000
          MULT= 2          ISPLIT=15
      -6: X=0.75000000 Y=0.75000000 Z=0.94100000
O          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   8.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000