P   LATTICE,NONEQUIV.ATOMS   3   14 P21/n   
MODE OF CALC=RELA unit=bohr
 10.544672 10.400864  9.089583 90.000000 90.000000119.550000
ATOM  -1: X=0.28700000 Y=0.26100000 Z=0.02100000
          MULT= 4          ISPLIT=15
      -1: X=0.71300000 Y=0.73900000 Z=0.97900000
      -1: X=0.21300000 Y=0.23900000 Z=0.52100000
      -1: X=0.78700000 Y=0.76100000 Z=0.47900000
Re         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  75.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.39700000 Y=0.60600000 Z=0.21200000
          MULT= 4          ISPLIT=15
      -2: X=0.60300000 Y=0.39400000 Z=0.78800000
      -2: X=0.10300000 Y=0.89400000 Z=0.71200000
      -2: X=0.89700000 Y=0.10600000 Z=0.28800000
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  -3: X=0.39800000 Y=0.09900000 Z=0.29700000
          MULT= 4          ISPLIT=15
      -3: X=0.60200000 Y=0.90100000 Z=0.70300000
      -3: X=0.10200000 Y=0.40100000 Z=0.79700000
      -3: X=0.89800000 Y=0.59900000 Z=0.20300000
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