CXY LATTICE,NONEQUIV.ATOMS 2 63 Cmcm MODE OF CALC=RELA unit=bohr 6.273891 18.585457 7.762995 90.000000 90.000000 90.000000 ATOM -1: X=0.00000000 Y=0.10200000 Z=0.25000000 MULT= 2 ISPLIT= 8 -1: X=0.00000000 Y=0.89800000 Z=0.75000000 Ag NPT= 781 R0=.000010000 RMT= 2.50000 Z: 47.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -2: X=0.00000000 Y=0.35900000 Z=0.25000000 MULT= 2 ISPLIT= 8 -2: X=0.00000000 Y=0.64100000 Z=0.75000000 Cl NPT= 781 R0=.000100000 RMT= 2.20 Z: 17.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000