P   LATTICE,NONEQUIV.ATOMS  10   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 16.074010 11.627485 12.840689 90.000000 90.000000 90.390000                   
ATOM  -1: X=0.18220000 Y=0.21611000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.81780000 Y=0.78389000 Z=0.75000000
W          NPT=  781  R0=.000005000 RMT= 1.92        Z:  74.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.84508000 Y=0.21984000 Z=0.00284000
          MULT= 4          ISPLIT= 8
      -2: X=0.15492000 Y=0.78016000 Z=0.99716000
      -2: X=0.15492000 Y=0.78016000 Z=0.50284000
      -2: X=0.84508000 Y=0.21984000 Z=0.49716000
Ca         NPT=  781  R0=.000050000 RMT= 2.17        Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.82849000 Y=0.68188000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.17151000 Y=0.31812000 Z=0.75000000
Ca         NPT=  781  R0=.000050000 RMT= 2.17        Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.50000000 Y=0.50000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -4: X=0.50000000 Y=0.50000000 Z=0.50000000
Ca         NPT=  781  R0=.000050000 RMT= 2.17        Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.52761000 Y=0.02196000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.47239000 Y=0.97804000 Z=0.75000000
Ca         NPT=  781  R0=.000050000 RMT= 2.17        Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.02450000 Y=0.00420000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.97550000 Y=0.99580000 Z=0.75000000
N          NPT=  781  R0=.000100000 RMT= 1.57        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.31040000 Y=0.16100000 Z=0.02620000
          MULT= 4          ISPLIT= 8
      -7: X=0.68960000 Y=0.83900000 Z=0.97380000
      -7: X=0.68960000 Y=0.83900000 Z=0.52620000
      -7: X=0.31040000 Y=0.16100000 Z=0.47380000
N          NPT=  781  R0=.000100000 RMT= 1.57        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.07470000 Y=0.47740000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -8: X=0.92530000 Y=0.52260000 Z=0.75000000
N          NPT=  781  R0=.000100000 RMT= 1.57        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.67270000 Y=0.35060000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -9: X=0.32730000 Y=0.64940000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 2.17        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 -10: X=0.37950000 Y=0.70560000 Z=0.25000000
          MULT= 2          ISPLIT= 8
     -10: X=0.62050000 Y=0.29440000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 2.17        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000