P   LATTICE,NONEQUIV.ATOMS   6    4 P21                                        
MODE OF CALC=RELA unit=bohr                                                    
 10.583222 10.442627  9.151944 90.000000 90.000000119.447000                   
ATOM  -1: X=0.03500000 Y=0.26700000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.96500000 Y=0.73300000 Z=0.50000000
Mo         NPT=  781  R0=.000010000 RMT= 1.88        Z:  42.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.46500000 Y=0.23300000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.53500000 Y=0.76700000 Z=0.50000000
Mo         NPT=  781  R0=.000010000 RMT= 1.88        Z:  42.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.16000000 Y=0.55000000 Z=0.68000000
          MULT= 2          ISPLIT= 8
      -3: X=0.84000000 Y=0.45000000 Z=0.18000000
O          NPT=  781  R0=.000100000 RMT= 1.70        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  -4: X=0.12000000 Y=0.01000000 Z=0.78000000
          MULT= 2          ISPLIT= 8
      -4: X=0.88000000 Y=0.99000000 Z=0.28000000
O          NPT=  781  R0=.000100000 RMT= 1.70        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=0.66000000 Y=0.05000000 Z=0.78000000
          MULT= 2          ISPLIT= 8
      -5: X=0.34000000 Y=0.95000000 Z=0.28000000
O          NPT=  781  R0=.000100000 RMT= 1.70        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=0.38000000 Y=0.49000000 Z=0.20000000
          MULT= 2          ISPLIT= 8
      -6: X=0.62000000 Y=0.51000000 Z=0.70000000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000