P   LATTICE,NONEQUIV.ATOMS   5  136 P42/mnm                                    
MODE OF CALC=RELA unit=bohr                                                    
 19.263868 19.263868 10.040115 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
Ta         NPT=  781  R0=.000005000 RMT= 2.30        Z:  73.00000              
LOCAL ROT MATRIX:    0.7071068 0.7071068 0.0000000
                    -0.7071068 0.7071068 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.39700000 Y=0.60300000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.60300000 Y=0.39700000 Z=0.00000000
      -2: X=0.89700000 Y=0.89700000 Z=0.50000000
      -2: X=0.10300000 Y=0.10300000 Z=0.50000000
Ta         NPT=  781  R0=.000005000 RMT= 2.30        Z:  73.00000              
LOCAL ROT MATRIX:    0.0000000 0.7071068-0.7071068
                     0.0000000 0.7071068 0.7071068
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.31800000 Y=0.31800000 Z=0.23000000
          MULT= 8          ISPLIT= 8
      -3: X=0.68200000 Y=0.68200000 Z=0.77000000
      -3: X=0.18200000 Y=0.81800000 Z=0.73000000
      -3: X=0.81800000 Y=0.18200000 Z=0.27000000
      -3: X=0.68200000 Y=0.68200000 Z=0.23000000
      -3: X=0.31800000 Y=0.31800000 Z=0.77000000
      -3: X=0.81800000 Y=0.18200000 Z=0.73000000
      -3: X=0.18200000 Y=0.81800000 Z=0.27000000
Ta         NPT=  781  R0=.000005000 RMT= 2.30        Z:  73.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.06100000 Y=0.26500000 Z=0.00000000
          MULT= 8          ISPLIT= 8
      -4: X=0.93900000 Y=0.73500000 Z=0.00000000
      -4: X=0.23500000 Y=0.56100000 Z=0.50000000
      -4: X=0.76500000 Y=0.43900000 Z=0.50000000
      -4: X=0.43900000 Y=0.76500000 Z=0.50000000
      -4: X=0.56100000 Y=0.23500000 Z=0.50000000
      -4: X=0.73500000 Y=0.93900000 Z=0.00000000
      -4: X=0.26500000 Y=0.06100000 Z=0.00000000
Ta         NPT=  781  R0=.000005000 RMT= 2.30        Z:  73.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.12900000 Y=0.53400000 Z=0.00000000
          MULT= 8          ISPLIT= 8
      -5: X=0.87100000 Y=0.46600000 Z=0.00000000
      -5: X=0.96600000 Y=0.62900000 Z=0.50000000
      -5: X=0.03400000 Y=0.37100000 Z=0.50000000
      -5: X=0.37100000 Y=0.03400000 Z=0.50000000
      -5: X=0.62900000 Y=0.96600000 Z=0.50000000
      -5: X=0.46600000 Y=0.87100000 Z=0.00000000
      -5: X=0.53400000 Y=0.12900000 Z=0.00000000
Ta         NPT=  781  R0=.000005000 RMT= 2.30        Z:  73.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000