Triclinic periodic calculation 8 atoms 0.0 5.43808 xlo xhi 0.0 5.43472 ylo yhi 0.0 5.50823 zlo zhi -0.036104 0.0778792 -0.054888400000000004 xy xz yz 1 atom types Atoms 1 1 -0.0442028 -0.0162787 0.186746 2 1 1.4662500000000003 1.46109 1.3561599999999998 3 1 0.025673299999999993 2.72542 2.65757 4 1 1.3798500000000002 4.00669 4.1027 5 1 2.7474399999999997 0.013041700000000003 2.6074799999999994 6 1 4.13581 1.33996 3.97093 7 1 2.70334 2.70384 0.07421169999999999 8 1 4.06803 4.03744 1.3310499999999998 Masses 1 28.0855