B   LATTICE,NONEQUIV.ATOMS   6   87 I4/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.114915 18.114915 38.809306 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT=-2
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
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=0.00000000 Z=0.32760000
          MULT= 2          ISPLIT=-2
      -2: X=0.00000000 Y=0.00000000 Z=0.67240000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.09760000 Y=0.29970000 Z=0.19290000
          MULT= 8          ISPLIT= 8
      -3: X=0.90240000 Y=0.70030000 Z=0.80710000
      -3: X=0.70030000 Y=0.09760000 Z=0.19290000
      -3: X=0.29970000 Y=0.90240000 Z=0.80710000
      -3: X=0.90240000 Y=0.70030000 Z=0.19290000
      -3: X=0.09760000 Y=0.29970000 Z=0.80710000
      -3: X=0.29970000 Y=0.90240000 Z=0.19290000
      -3: X=0.70030000 Y=0.09760000 Z=0.80710000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.28560000 Y=0.14290000 Z=0.11690000
          MULT= 8          ISPLIT= 8
      -4: X=0.71440000 Y=0.85710000 Z=0.88310000
      -4: X=0.85710000 Y=0.28560000 Z=0.11690000
      -4: X=0.14290000 Y=0.71440000 Z=0.88310000
      -4: X=0.71440000 Y=0.85710000 Z=0.11690000
      -4: X=0.28560000 Y=0.14290000 Z=0.88310000
      -4: X=0.14290000 Y=0.71440000 Z=0.11690000
      -4: X=0.85710000 Y=0.28560000 Z=0.88310000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.30400000 Y=0.39690000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.69600000 Y=0.60310000 Z=0.00000000
      -5: X=0.60310000 Y=0.30400000 Z=0.00000000
      -5: X=0.39690000 Y=0.69600000 Z=0.00000000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.00000000 Y=0.50000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -6: X=0.50000000 Y=0.00000000 Z=0.00000000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000