lattce(1,2)='b1' delta(1,2)=0.4575 alpha(1,2)=4.915 re(1,2)=2.821 rho0(1)=1.0 rho0(2)=0.6 rc=5.0 Cmin(1,1,2) = 0.00 Cmin(2,2,1) = 2.00 Cmin(1,2,1) = 2.00 Cmin(1,2,2) = 2.00 ialloy=1 nn2(1,1)=1 nn2(2,2)=1