data.C2H6fc.ang
d0bbf3fb9785runner

data.C2H6fc.ang
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			Created using cfg2lammps (c) AJB-2009

			22 atoms
			3 atom types

			-529.177249 529.177249 xlo xhi
			-529.177249 529.177249 ylo yhi
			-529.177249 529.177249 zlo zhi

			Masses

			1 12.011789324618736
			2 1.007940
			3 0.0005446623093682

			Atoms

			1 1 6 2 0.173923 -0.000000 -0.000000 0.750495
			2 1 6 2 0.173923 0.000000 0.000000 -0.750495
			3 2 1 0 0.000000 -1.096376 0.000000 1.167561
			4 2 1 0 0.000000 0.548185 0.949487 1.167561
			5 2 1 0 0.000000 0.548185 -0.949487 1.167561
			6 2 1 0 0.000000 1.096376 -0.000000 -1.167561
			7 2 1 0 0.000000 -0.548185 -0.949487 -1.167561
			8 2 1 0 0.000000 -0.548185 0.949487 -1.167561
			9 3 0 1 0.672944 0.000000 0.000000 -0.000000
			10 3 0 -1 0.672944 -0.000000 -0.000000 0.000000
			11 3 0 1 0.804498 -0.871444 -0.000000 1.075706
			12 3 0 -1 0.804498 -0.871444 0.000000 1.075706
			13 3 0 1 0.804498 0.435722 0.754691 1.075706
			14 3 0 -1 0.804498 0.435722 0.754691 1.075706
			15 3 0 1 0.804498 0.435722 -0.754691 1.075706
			16 3 0 -1 0.804498 0.435722 -0.754691 1.075706
			17 3 0 1 0.804498 0.871444 0.000000 -1.075706
			18 3 0 -1 0.804498 0.871444 -0.000000 -1.075706
			19 3 0 1 0.804498 -0.435722 -0.754691 -1.075706
			20 3 0 -1 0.804498 -0.435722 -0.754691 -1.075706
			21 3 0 1 0.804498 -0.435722 0.754691 -1.075706
			22 3 0 -1 0.804498 -0.435722 0.754691 -1.075706