P   LATTICE,NONEQUIV.ATOMS   5   14 P21/n                                      
MODE OF CALC=RELA unit=bohr                                                    
 15.815118 15.939840  8.163617 90.000000 90.000000119.400000                   
ATOM  -1: X=0.25000000 Y=0.25000000 Z=0.17700000
          MULT= 4          ISPLIT= 8
      -1: X=0.75000000 Y=0.75000000 Z=0.82300000
      -1: X=0.25000000 Y=0.25000000 Z=0.67700000
      -1: X=0.75000000 Y=0.75000000 Z=0.32300000
C          NPT=  781  R0=.000100000 RMT= 1.15        Z:   6.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.28600000 Y=0.39200000 Z=0.35300000
          MULT= 4          ISPLIT= 8
      -2: X=0.71400000 Y=0.60800000 Z=0.64700000
      -2: X=0.21400000 Y=0.10800000 Z=0.85300000
      -2: X=0.78600000 Y=0.89200000 Z=0.14700000
F          NPT=  781  R0=.000100000 RMT= 1.34        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.39400000 Y=0.28900000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.60600000 Y=0.71100000 Z=0.00000000
      -3: X=0.10600000 Y=0.21100000 Z=0.50000000
      -3: X=0.89400000 Y=0.78900000 Z=0.50000000
F          NPT=  781  R0=.000100000 RMT= 1.34        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.21400000 Y=0.10800000 Z=0.35300000
          MULT= 4          ISPLIT= 8
      -4: X=0.78600000 Y=0.89200000 Z=0.64700000
      -4: X=0.28600000 Y=0.39200000 Z=0.85300000
      -4: X=0.71400000 Y=0.60800000 Z=0.14700000
F          NPT=  781  R0=.000100000 RMT= 1.34        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.10600000 Y=0.21100000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.89400000 Y=0.78900000 Z=0.00000000
      -5: X=0.39400000 Y=0.28900000 Z=0.50000000
      -5: X=0.60600000 Y=0.71100000 Z=0.50000000
F          NPT=  781  R0=.000100000 RMT= 1.34        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000