P LATTICE,NONEQUIV.ATOMS 8 7 Pb MODE OF CALC=RELA unit=bohr 14.480971 9.972274 9.742294 90.000000 90.000000 91.759000 ATOM -1: X=0.08670000 Y=0.80590000 Z=0.52000000 MULT= 2 ISPLIT= 8 -1: X=0.08670000 Y=0.30590000 Z=0.48000000 W NPT= 781 R0=.000005000 RMT= 1.63 Z: 74.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 ATOM -2: X=0.01100000 Y=0.29600000 Z=0.02100000 MULT= 2 ISPLIT= 8 -2: X=0.01100000 Y=0.79600000 Z=0.97900000 W NPT= 781 R0=.000005000 RMT= 1.63 Z: 74.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 ATOM -3: X=0.28400000 Y=0.30400000 Z=0.07800000 MULT= 2 ISPLIT= 8 -3: X=0.28400000 Y=0.80400000 Z=0.92200000 O NPT= 781 R0=.000100000 RMT= 1.40 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 -4: X=0.57800000 Y=0.58300000 Z=0.21100000 MULT= 2 ISPLIT= 8 -4: X=0.57800000 Y=0.08300000 Z=0.78900000 O NPT= 781 R0=.000100000 RMT= 1.40 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=0.00200000 Y=0.51300000 Z=0.28600000 MULT= 2 ISPLIT= 8 -5: X=0.00200000 Y=0.01300000 Z=0.71400000 O NPT= 781 R0=.000100000 RMT= 1.40 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=0.57900000 Y=0.09100000 Z=0.29300000 MULT= 2 ISPLIT= 8 -6: X=0.57900000 Y=0.59100000 Z=0.70700000 O NPT= 781 R0=.000100000 RMT= 1.40 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=0.00000000 Y=0.00000000 Z=0.21100000 MULT= 2 ISPLIT= 8 -7: X=0.00000000 Y=0.50000000 Z=0.78900000 O NPT= 781 R0=.000100000 RMT= 1.40 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=0.29800000 Y=0.80800000 Z=0.42700000 MULT= 2 ISPLIT= 8 -8: X=0.29800000 Y=0.30800000 Z=0.57300000 O NPT= 781 R0=.000100000 RMT= 1.40 Z: 8.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000