75 B_6 Ca & Pm(-3)m & #221 & cP7 & D2_1 Ca .00000000 .00000000 .00000000 B .85801500 2.07250000 2.07250000 B 2.07250000 .85801500 2.07250000 B 2.07250000 2.07250000 .85801500 Ca .00000000 .00000000 4.14500000 B .85801500 2.07250000 6.21750000 B 2.07250000 .85801500 6.21750000 B 2.07250000 2.07250000 5.00301500 B 2.07250000 2.07250000 3.28698500 Ca .00000000 .00000000 8.29000000 B 2.07250000 2.07250000 7.43198500 Ca .00000000 4.14500000 .00000000 B .85801500 6.21750000 2.07250000 B 2.07250000 5.00301500 2.07250000 B 2.07250000 3.28698500 2.07250000 B 2.07250000 6.21750000 .85801500 Ca .00000000 4.14500000 4.14500000 B .85801500 6.21750000 6.21750000 B 2.07250000 5.00301500 6.21750000 B 2.07250000 3.28698500 6.21750000 B 2.07250000 6.21750000 5.00301500 B 2.07250000 6.21750000 3.28698500 Ca .00000000 4.14500000 8.29000000 B 2.07250000 6.21750000 7.43198500 Ca .00000000 8.29000000 .00000000 B 2.07250000 7.43198500 2.07250000 Ca .00000000 8.29000000 4.14500000 B 2.07250000 7.43198500 6.21750000 Ca .00000000 8.29000000 8.29000000 Ca 4.14500000 .00000000 .00000000 B 5.00301500 2.07250000 2.07250000 B 3.28698500 2.07250000 2.07250000 B 6.21750000 .85801500 2.07250000 B 6.21750000 2.07250000 .85801500 Ca 4.14500000 .00000000 4.14500000 B 5.00301500 2.07250000 6.21750000 B 3.28698500 2.07250000 6.21750000 B 6.21750000 .85801500 6.21750000 B 6.21750000 2.07250000 5.00301500 B 6.21750000 2.07250000 3.28698500 Ca 4.14500000 .00000000 8.29000000 B 6.21750000 2.07250000 7.43198500 Ca 4.14500000 4.14500000 .00000000 B 5.00301500 6.21750000 2.07250000 B 3.28698500 6.21750000 2.07250000 B 6.21750000 5.00301500 2.07250000 B 6.21750000 3.28698500 2.07250000 B 6.21750000 6.21750000 .85801500 Ca 4.14500000 4.14500000 4.14500000 B 5.00301500 6.21750000 6.21750000 B 3.28698500 6.21750000 6.21750000 B 6.21750000 5.00301500 6.21750000 B 6.21750000 3.28698500 6.21750000 B 6.21750000 6.21750000 5.00301500 B 6.21750000 6.21750000 3.28698500 Ca 4.14500000 4.14500000 8.29000000 B 6.21750000 6.21750000 7.43198500 Ca 4.14500000 8.29000000 .00000000 B 6.21750000 7.43198500 2.07250000 Ca 4.14500000 8.29000000 4.14500000 B 6.21750000 7.43198500 6.21750000 Ca 4.14500000 8.29000000 8.29000000 Ca 8.29000000 .00000000 .00000000 B 7.43198500 2.07250000 2.07250000 Ca 8.29000000 .00000000 4.14500000 B 7.43198500 2.07250000 6.21750000 Ca 8.29000000 .00000000 8.29000000 Ca 8.29000000 4.14500000 .00000000 B 7.43198500 6.21750000 2.07250000 Ca 8.29000000 4.14500000 4.14500000 B 7.43198500 6.21750000 6.21750000 Ca 8.29000000 4.14500000 8.29000000 Ca 8.29000000 8.29000000 .00000000 Ca 8.29000000 8.29000000 4.14500000 Ca 8.29000000 8.29000000 8.29000000 **************************************** Primitive vectors a(1) = 4.14500000 .00000000 .00000000 a(2) = .00000000 4.14500000 .00000000 a(3) = .00000000 .00000000 4.14500000 Volume = 71.21534862 Reciprocal vectors b(1) = .24125452 .00000000 .00000000 b(2) = .00000000 .24125452 .00000000 b(3) = .00000000 .00000000 .24125452 Basis Vectors: Atom Lattice Coordinates Cartesian Coordinates Ca .00000000 .00000000 .00000000 .00000000 .00000000 .00000000 B .20700000 .50000000 .50000000 .85801500 2.07250000 2.07250000 B -.20700000 .50000000 .50000000 -.85801500 2.07250000 2.07250000 B .50000000 .20700000 .50000000 2.07250000 .85801500 2.07250000 B .50000000 -.20700000 .50000000 2.07250000 -.85801500 2.07250000 B .50000000 .50000000 .20700000 2.07250000 2.07250000 .85801500 B .50000000 .50000000 -.20700000 2.07250000 2.07250000 -.85801500