P   LATTICE,NONEQUIV.ATOMS   6   11 P21/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 28.226839 12.889822  7.069465 90.000000 90.000000 95.660000                   
ATOM  -1: X=0.10950000 Y=0.60310000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.89050000 Y=0.39690000 Z=0.75000000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.64730000 Y=0.44980000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.35270000 Y=0.55020000 Z=0.75000000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.85280000 Y=0.88810000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.14720000 Y=0.11190000 Z=0.75000000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.39010000 Y=0.05450000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -4: X=0.60990000 Y=0.94550000 Z=0.75000000
I          NPT=  781  R0=.000010000 RMT= 2.50000     Z:  53.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.00360000 Y=0.18920000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -5: X=0.99640000 Y=0.81080000 Z=0.75000000
Zr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  40.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.49690000 Y=0.68800000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -6: X=0.50310000 Y=0.31200000 Z=0.75000000
Zr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  40.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000