Triclinic periodic calculation 8 atoms 0.0 5.52526 xlo xhi 0.0 5.51064 ylo yhi 0.0 5.47616 zlo zhi 0.163004 0.0929221 -0.0543858 xy xz yz 1 atom types Atoms 1 1 0.0515746 -0.0381365 -0.00729456 2 1 1.44408 1.32704 1.45073 3 1 0.0791767 2.70101 2.71983 4 1 1.48556 4.06547 4.00394 5 1 2.80111 0.011527 2.65388 6 1 4.15958 1.27318 3.97985 7 1 2.73428 2.80936 0.100172 8 1 4.13679 4.02299 1.21489 Masses 1 28.0855