Triclinic periodic calculation 2 atoms 0.0 3.16496 xlo xhi 0.0 3.09503 ylo yhi 0.0 3.00354 zlo zhi 0.0299441 0.0203801 0.0469382 xy xz yz 1 atom types Atoms 1 1 0.00121946 0.000457086 -0.123238 2 1 1.57118 1.61129 1.57573 Masses 1 28.0855