40 beta O_2 & R(-3)m-D_{3d}^5 #166 & hR2 & Meier and Helmholdt, PRB 29, 1387 (1984) O -3.28900000 0.00000000 0.61255830 O -3.28900000 0.00000000 -0.61255830 O -1.64450000 2.84835755 0.61255830 O -1.64450000 2.84835755 -0.61255830 O -1.64450000 -2.84835755 0.61255830 O -1.64450000 -2.84835755 -0.61255830 O 0.00000000 0.00000000 0.61255830 O 0.00000000 0.00000000 -0.61255830 O -1.64450000 -0.94945252 4.37289163 O -1.64450000 -0.94945252 3.14777503 O 1.64450000 2.84835755 0.61255830 O 1.64450000 2.84835755 -0.61255830 O 0.00000000 1.89890504 4.37289163 O 0.00000000 1.89890504 3.14777503 O -1.64450000 0.94945252 8.13322497 O -1.64450000 0.94945252 6.90810837 O -3.28900000 0.00000000 11.89355830 O -3.28900000 0.00000000 10.66844170 O -1.64450000 2.84835755 11.89355830 O -1.64450000 2.84835755 10.66844170 O 1.64450000 -2.84835755 0.61255830 O 1.64450000 -2.84835755 -0.61255830 O 3.28900000 0.00000000 0.61255830 O 3.28900000 0.00000000 -0.61255830 O 1.64450000 -0.94945252 4.37289163 O 1.64450000 -0.94945252 3.14777503 O 0.00000000 -1.89890504 8.13322497 O 0.00000000 -1.89890504 6.90810837 O -1.64450000 -2.84835755 11.89355830 O -1.64450000 -2.84835755 10.66844170 O 1.64450000 0.94945252 8.13322497 O 1.64450000 0.94945252 6.90810837 O 0.00000000 0.00000000 11.89355830 O 0.00000000 0.00000000 10.66844170 O 1.64450000 2.84835755 11.89355830 O 1.64450000 2.84835755 10.66844170 O 1.64450000 -2.84835755 11.89355830 O 1.64450000 -2.84835755 10.66844170 O 3.28900000 0.00000000 11.89355830 O 3.28900000 0.00000000 10.66844170 **************************************** Primitive vectors a(1) = 1.64450000 -0.94945252 3.76033333 a(2) = 0.00000000 1.89890504 3.76033333 a(3) = -1.64450000 -0.94945252 3.76033333 Volume = 35.22773520 Reciprocal vectors b(1) = 0.30404378 -0.17553976 0.08864462 b(2) = 0.00000000 0.35107952 0.08864462 b(3) = -0.30404378 -0.17553976 0.08864462 Basis Vectors: Atom Lattice Coordinates Cartesian Coordinates O 0.05430000 0.05430000 0.05430000 0.00000000 0.00000000 0.61255830 O -0.05430000 -0.05430000 -0.05430000 0.00000000 0.00000000 -0.61255830