59 Fe_4 C & P(-4)3m (#215) & cP5 C -3.87800000 -3.87800000 -3.87800000 Fe -2.85033000 -2.85033000 -2.85033000 C -3.87800000 -3.87800000 .00000000 Fe -2.85033000 -2.85033000 1.02767000 C -3.87800000 -3.87800000 3.87800000 C -3.87800000 .00000000 -3.87800000 Fe -2.85033000 1.02767000 -2.85033000 C -3.87800000 .00000000 .00000000 Fe -2.85033000 1.02767000 1.02767000 Fe -2.85033000 -1.02767000 -1.02767000 C -3.87800000 .00000000 3.87800000 Fe -2.85033000 -1.02767000 2.85033000 C -3.87800000 3.87800000 -3.87800000 C -3.87800000 3.87800000 .00000000 Fe -2.85033000 2.85033000 -1.02767000 C -3.87800000 3.87800000 3.87800000 Fe -2.85033000 2.85033000 2.85033000 C .00000000 -3.87800000 -3.87800000 Fe 1.02767000 -2.85033000 -2.85033000 C .00000000 -3.87800000 .00000000 Fe 1.02767000 -2.85033000 1.02767000 Fe -1.02767000 -2.85033000 -1.02767000 C .00000000 -3.87800000 3.87800000 Fe -1.02767000 -2.85033000 2.85033000 C .00000000 .00000000 -3.87800000 Fe 1.02767000 1.02767000 -2.85033000 Fe -1.02767000 -1.02767000 -2.85033000 C .00000000 .00000000 .00000000 Fe 1.02767000 1.02767000 1.02767000 Fe 1.02767000 -1.02767000 -1.02767000 Fe -1.02767000 1.02767000 -1.02767000 Fe -1.02767000 -1.02767000 1.02767000 C .00000000 .00000000 3.87800000 Fe 1.02767000 -1.02767000 2.85033000 Fe -1.02767000 1.02767000 2.85033000 C .00000000 3.87800000 -3.87800000 Fe -1.02767000 2.85033000 -2.85033000 C .00000000 3.87800000 .00000000 Fe 1.02767000 2.85033000 -1.02767000 Fe -1.02767000 2.85033000 1.02767000 C .00000000 3.87800000 3.87800000 Fe 1.02767000 2.85033000 2.85033000 C 3.87800000 -3.87800000 -3.87800000 C 3.87800000 -3.87800000 .00000000 Fe 2.85033000 -2.85033000 -1.02767000 C 3.87800000 -3.87800000 3.87800000 Fe 2.85033000 -2.85033000 2.85033000 C 3.87800000 .00000000 -3.87800000 Fe 2.85033000 -1.02767000 -2.85033000 C 3.87800000 .00000000 .00000000 Fe 2.85033000 1.02767000 -1.02767000 Fe 2.85033000 -1.02767000 1.02767000 C 3.87800000 .00000000 3.87800000 Fe 2.85033000 1.02767000 2.85033000 C 3.87800000 3.87800000 -3.87800000 Fe 2.85033000 2.85033000 -2.85033000 C 3.87800000 3.87800000 .00000000 Fe 2.85033000 2.85033000 1.02767000 C 3.87800000 3.87800000 3.87800000 **************************************** Primitive vectors a(1) = 3.87800000 .00000000 .00000000 a(2) = .00000000 3.87800000 .00000000 a(3) = .00000000 .00000000 3.87800000 Volume = 58.32079215 Reciprocal vectors b(1) = .25786488 .00000000 .00000000 b(2) = .00000000 .25786488 .00000000 b(3) = .00000000 .00000000 .25786488 Basis Vectors: Atom Lattice Coordinates Cartesian Coordinates C .00000000 .00000000 .00000000 .00000000 .00000000 .00000000 Fe .26500000 .26500000 .26500000 1.02767000 1.02767000 1.02767000 Fe .26500000 -.26500000 -.26500000 1.02767000 -1.02767000 -1.02767000 Fe -.26500000 .26500000 -.26500000 -1.02767000 1.02767000 -1.02767000 Fe -.26500000 -.26500000 .26500000 -1.02767000 -1.02767000 1.02767000