P   LATTICE,NONEQUIV.ATOMS   7   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.501699  5.585275 20.321548 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.24363000 Y=0.25000000 Z=0.65317000
          MULT= 4          ISPLIT= 8
      -1: X=0.75637000 Y=0.75000000 Z=0.34683000
      -1: X=0.74363000 Y=0.25000000 Z=0.84683000
      -1: X=0.25637000 Y=0.75000000 Z=0.15317000
Na         NPT=  781  R0=.000100000 RMT= 2.23        Z:  11.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.56624000 Y=0.25000000 Z=0.60964000
          MULT= 4          ISPLIT= 8
      -2: X=0.43376000 Y=0.75000000 Z=0.39036000
      -2: X=0.06624000 Y=0.25000000 Z=0.89036000
      -2: X=0.93376000 Y=0.75000000 Z=0.10964000
Ti         NPT=  781  R0=.000050000 RMT= 1.91        Z:  22.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.08209000 Y=0.25000000 Z=0.39545000
          MULT= 4          ISPLIT= 8
      -3: X=0.91791000 Y=0.75000000 Z=0.60455000
      -3: X=0.58209000 Y=0.25000000 Z=0.10455000
      -3: X=0.41791000 Y=0.75000000 Z=0.89545000
Ti         NPT=  781  R0=.000050000 RMT= 1.91        Z:  22.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.28840000 Y=0.25000000 Z=0.34880000
          MULT= 4          ISPLIT= 8
      -4: X=0.71160000 Y=0.75000000 Z=0.65120000
      -4: X=0.78840000 Y=0.25000000 Z=0.15120000
      -4: X=0.21160000 Y=0.75000000 Z=0.84880000
O          NPT=  781  R0=.000100000 RMT= 1.72        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.38750000 Y=0.25000000 Z=0.01970000
          MULT= 4          ISPLIT= 8
      -5: X=0.61250000 Y=0.75000000 Z=0.98030000
      -5: X=0.88750000 Y=0.25000000 Z=0.48030000
      -5: X=0.11250000 Y=0.75000000 Z=0.51970000
O          NPT=  781  R0=.000100000 RMT= 1.72        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.47950000 Y=0.25000000 Z=0.78230000
          MULT= 4          ISPLIT= 8
      -6: X=0.52050000 Y=0.75000000 Z=0.21770000
      -6: X=0.97950000 Y=0.25000000 Z=0.71770000
      -6: X=0.02050000 Y=0.75000000 Z=0.28230000
O          NPT=  781  R0=.000100000 RMT= 1.72        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -7: X=0.08010000 Y=0.25000000 Z=0.06960000
          MULT= 4          ISPLIT= 8
      -7: X=0.91990000 Y=0.75000000 Z=0.93040000
      -7: X=0.58010000 Y=0.25000000 Z=0.43040000
      -7: X=0.41990000 Y=0.75000000 Z=0.56960000
O          NPT=  781  R0=.000100000 RMT= 1.72        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000