P   LATTICE,NONEQUIV.ATOMS   8    2 P-1                                        
MODE OF CALC=RELA unit=bohr                                                    
  9.907834 14.175403 14.198268113.815000 98.414000109.172000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
Ta         NPT=  781  R0=.000005000 RMT= 2.46        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  -2: X=0.50000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
Ta         NPT=  781  R0=.000005000 RMT= 2.46        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  -3: X=0.00280000 Y=0.37190000 Z=0.29670000
          MULT= 2          ISPLIT= 8
      -3: X=0.99720000 Y=0.62810000 Z=0.70330000
Ta         NPT=  781  R0=.000005000 RMT= 2.46        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  -4: X=0.22870000 Y=0.06480000 Z=0.69210000
          MULT= 2          ISPLIT= 8
      -4: X=0.77130000 Y=0.93520000 Z=0.30790000
Ta         NPT=  781  R0=.000005000 RMT= 2.46        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=0.44270000 Y=0.22380000 Z=0.41080000
          MULT= 2          ISPLIT= 8
      -5: X=0.55730000 Y=0.77620000 Z=0.58920000
Ta         NPT=  781  R0=.000005000 RMT= 2.46        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  -6: X=0.14910000 Y=0.72050000 Z=0.14870000
          MULT= 2          ISPLIT= 8
      -6: X=0.85090000 Y=0.27950000 Z=0.85130000
Ta         NPT=  781  R0=.000005000 RMT= 2.46        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  -7: X=0.47270000 Y=0.42540000 Z=0.13800000
          MULT= 2          ISPLIT= 8
      -7: X=0.52730000 Y=0.57460000 Z=0.86200000
Ta         NPT=  781  R0=.000005000 RMT= 2.46        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  -8: X=0.07400000 Y=0.29600000 Z=0.58200000
          MULT= 2          ISPLIT= 8
      -8: X=0.92600000 Y=0.70400000 Z=0.41800000
S          NPT=  781  R0=.000100000 RMT= 2.04        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000