Triclinic periodic calculation 2 atoms 0.0 3.0677 xlo xhi 0.0 3.0997 ylo yhi 0.0 2.99374 zlo zhi -0.08759840000000002 0.0413411 -0.104145 xy xz yz 1 atom types Atoms 1 1 -0.062140199999999986 0.0658218 0.0139646 2 1 1.5825099999999999 1.62049 1.4998199999999997 Masses 1 28.0855