P   LATTICE,NONEQUIV.ATOMS   4  113 P-421m                                     
MODE OF CALC=RELA unit=bohr                                                    
 17.498864 17.498864 10.733644 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT=-2
      -1: X=0.50000000 Y=0.50000000 Z=0.00000000
P          NPT=  781  R0=.000100000 RMT= 1.76        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.50000000 Z=0.33900000
          MULT= 2          ISPLIT= 8
      -2: X=0.50000000 Y=0.00000000 Z=0.66100000
I          NPT=  781  R0=.000010000 RMT= 2.38        Z:  53.00000              
LOCAL ROT MATRIX:    0.7071068 0.7071068 0.0000000
                    -0.7071068 0.7071068 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.18000000 Y=0.68000000 Z=0.33900000
          MULT= 4          ISPLIT= 8
      -3: X=0.68000000 Y=0.82000000 Z=0.66100000
      -3: X=0.82000000 Y=0.32000000 Z=0.33900000
      -3: X=0.32000000 Y=0.18000000 Z=0.66100000
Cl         NPT=  781  R0=.000100000 RMT= 1.95        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.15500000 Y=0.07900000 Z=0.20200000
          MULT= 8          ISPLIT= 8
      -4: X=0.07900000 Y=0.84500000 Z=0.79800000
      -4: X=0.65500000 Y=0.42100000 Z=0.79800000
      -4: X=0.84500000 Y=0.92100000 Z=0.20200000
      -4: X=0.42100000 Y=0.34500000 Z=0.20200000
      -4: X=0.92100000 Y=0.15500000 Z=0.79800000
      -4: X=0.34500000 Y=0.57900000 Z=0.79800000
      -4: X=0.57900000 Y=0.65500000 Z=0.20200000
Cl         NPT=  781  R0=.000100000 RMT= 1.95        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000