P   LATTICE,NONEQUIV.ATOMS   8   33 Pna21                                      
MODE OF CALC=RELA unit=bohr                                                    
 13.882306 11.080409 18.838680 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.01723000 Y=0.27124000 Z=0.33557000
          MULT= 4          ISPLIT= 8
      -1: X=0.98277000 Y=0.72876000 Z=0.83557000
      -1: X=0.48277000 Y=0.77124000 Z=0.83557000
      -1: X=0.51723000 Y=0.22876000 Z=0.33557000
Hg         NPT=  781  R0=.000005000 RMT= 2.14        Z:  80.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.23553000 Y=0.27230000 Z=0.67245000
          MULT= 4          ISPLIT= 8
      -2: X=0.76447000 Y=0.72770000 Z=0.17245000
      -2: X=0.26447000 Y=0.77230000 Z=0.17245000
      -2: X=0.73553000 Y=0.22770000 Z=0.67245000
Hg         NPT=  781  R0=.000005000 RMT= 2.14        Z:  80.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.36717000 Y=0.25835000 Z=0.00003000
          MULT= 4          ISPLIT= 8
      -3: X=0.63283000 Y=0.74165000 Z=0.50003000
      -3: X=0.13283000 Y=0.75835000 Z=0.50003000
      -3: X=0.86717000 Y=0.24165000 Z=0.00003000
Te         NPT=  781  R0=.000010000 RMT= 1.91        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=0.05360000 Y=0.45800000 Z=0.55770000
          MULT= 4          ISPLIT= 8
      -4: X=0.94640000 Y=0.54200000 Z=0.05770000
      -4: X=0.44640000 Y=0.95800000 Z=0.05770000
      -4: X=0.55360000 Y=0.04200000 Z=0.55770000
O          NPT=  781  R0=.000100000 RMT= 1.64        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.08740000 Y=0.65460000 Z=0.32030000
          MULT= 4          ISPLIT= 8
      -5: X=0.91260000 Y=0.34540000 Z=0.82030000
      -5: X=0.41260000 Y=0.15460000 Z=0.82030000
      -5: X=0.58740000 Y=0.84540000 Z=0.32030000
O          NPT=  781  R0=.000100000 RMT= 1.64        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.11780000 Y=0.12350000 Z=0.00240000
          MULT= 4          ISPLIT= 8
      -6: X=0.88220000 Y=0.87650000 Z=0.50240000
      -6: X=0.38220000 Y=0.62350000 Z=0.50240000
      -6: X=0.61780000 Y=0.37650000 Z=0.00240000
O          NPT=  781  R0=.000100000 RMT= 1.64        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.21340000 Y=0.04580000 Z=0.43770000
          MULT= 4          ISPLIT= 8
      -7: X=0.78660000 Y=0.95420000 Z=0.93770000
      -7: X=0.28660000 Y=0.54580000 Z=0.93770000
      -7: X=0.71340000 Y=0.45420000 Z=0.43770000
O          NPT=  781  R0=.000100000 RMT= 1.64        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.33660000 Y=0.35150000 Z=0.18500000
          MULT= 4          ISPLIT= 8
      -8: X=0.66340000 Y=0.64850000 Z=0.68500000
      -8: X=0.16340000 Y=0.85150000 Z=0.68500000
      -8: X=0.83660000 Y=0.14850000 Z=0.18500000
O          NPT=  781  R0=.000100000 RMT= 1.64        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000