P   LATTICE,NONEQUIV.ATOMS   1   14 P21/n                                      
MODE OF CALC=RELA unit=bohr                                                    
 21.259419 15.798110  7.936850 90.000000 90.000000 96.300000                   
ATOM  -1: X=0.12500000 Y=0.37500000 Z=0.67600000
          MULT= 4          ISPLIT= 8
      -1: X=0.87500000 Y=0.62500000 Z=0.32400000
      -1: X=0.37500000 Y=0.12500000 Z=0.17600000
      -1: X=0.62500000 Y=0.87500000 Z=0.82400000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000