P   LATTICE,NONEQUIV.ATOMS   6   14 P21/n                                      
MODE OF CALC=RELA unit=bohr                                                    
 11.262768  7.337807 25.800431 90.000000 90.000000 90.400000                   
ATOM  -1: X=0.28230000 Y=0.05460000 Z=0.06590000
          MULT= 4          ISPLIT= 8
      -1: X=0.71770000 Y=0.94540000 Z=0.93410000
      -1: X=0.21770000 Y=0.44540000 Z=0.56590000
      -1: X=0.78230000 Y=0.55460000 Z=0.43410000
W          NPT=  781  R0=.000005000 RMT= 1.81        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=0.32500000 Y=0.51500000 Z=0.32860000
          MULT= 4          ISPLIT= 8
      -2: X=0.67500000 Y=0.48500000 Z=0.67140000
      -2: X=0.17500000 Y=0.98500000 Z=0.82860000
      -2: X=0.82500000 Y=0.01500000 Z=0.17140000
K          NPT=  781  R0=.000050000 RMT= 2.00        Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.50000000 Y=0.50000000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.55        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=0.27100000 Y=0.51000000 Z=0.04700000
          MULT= 4          ISPLIT= 8
      -4: X=0.72900000 Y=0.49000000 Z=0.95300000
      -4: X=0.22900000 Y=0.99000000 Z=0.54700000
      -4: X=0.77100000 Y=0.01000000 Z=0.45300000
O          NPT=  781  R0=.000100000 RMT= 1.55        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=0.09400000 Y=0.00000000 Z=0.42100000
          MULT= 4          ISPLIT= 8
      -5: X=0.90600000 Y=0.00000000 Z=0.57900000
      -5: X=0.40600000 Y=0.50000000 Z=0.92100000
      -5: X=0.59400000 Y=0.50000000 Z=0.07900000
O          NPT=  781  R0=.000100000 RMT= 1.55        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=0.31600000 Y=0.00800000 Z=0.68500000
          MULT= 4          ISPLIT= 8
      -6: X=0.68400000 Y=0.99200000 Z=0.31500000
      -6: X=0.18400000 Y=0.49200000 Z=0.18500000
      -6: X=0.81600000 Y=0.50800000 Z=0.81500000
O          NPT=  781  R0=.000100000 RMT= 1.55        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000