Triclinic periodic calculation 8 atoms 0.0 5.42333 xlo xhi 0.0 5.40512 ylo yhi 0.0 5.50089 zlo zhi 0.0707092 -0.00203562 -0.0726392 xy xz yz 1 atom types Atoms 1 1 -0.00542909 0.0277818 -0.0388963 2 1 1.35422 1.36306 1.38504 3 1 0.0297601 2.72434 2.72311 4 1 1.36125 4.06894 4.03995 5 1 2.72846 0.00923744 2.71344 6 1 4.08711 1.36473 3.96445 7 1 2.72619 2.69674 -0.100972 8 1 4.11061 4.07011 1.39355 Masses 1 28.0855