CXY LATTICE,NONEQUIV.ATOMS 1 63 Cmcm MODE OF CALC=RELA unit=bohr 14.797689 8.878689 8.776077 90.000000 90.000000 90.000000 ATOM -1: X=0.16214000 Y=0.17097000 Z=0.25000000 MULT= 4 ISPLIT= 8 -1: X=0.83786000 Y=0.82903000 Z=0.75000000 -1: X=0.83786000 Y=0.17097000 Z=0.25000000 -1: X=0.16214000 Y=0.82903000 Z=0.75000000 Ga NPT= 781 R0=.000050000 RMT= 2.38 Z: 31.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000