Triclinic periodic calculation 8 atoms 0.0 5.44714 xlo xhi 0.0 5.37075 ylo yhi 0.0 5.43207 zlo zhi 0.10305799999999998 0.0454409 0.00880856 xy xz yz 1 atom types Atoms 1 1 -0.092279 -0.15649999999999997 0.14023599999999994 2 1 1.3016899999999998 1.4845299999999997 1.6709399999999996 3 1 -0.06428400000000001 2.4169699999999996 2.4946899999999994 4 1 1.35107 4.20911 4.051479999999999 5 1 2.6753 0.04248729999999999 2.7101799999999994 6 1 4.051459999999999 1.3987999999999998 4.097779999999999 7 1 2.74223 2.6989799999999993 0.4207329999999999 8 1 4.21922 4.151379999999999 1.7820499999999995 Masses 1 28.0855