Triclinic periodic calculation 2 atoms 0.0 3.0839 xlo xhi 0.0 3.17138 ylo yhi 0.0 3.06669 zlo zhi 0.0102376 0.127489 0.0401208 xy xz yz 1 atom types Atoms 1 1 -0.0885009 0.0485953 0.104223 2 1 1.64578 1.63652 1.52991 Masses 1 28.0855