Cu1CONBO.out 0 0 3 timestep 1 3 0 0 0.000100 `$M -2.1993610 1.1569950 -0.9201510 C -1.5284320 -0.0182760 0.4965040 O -0.8138140 -0.9498490 0.6421480 timestep 21 3 0 0 0.000100 `$M -2.1993610 1.1569950 -0.9201510 C -1.5284320 -0.0182760 0.4965040 O -0.8138140 -0.9498490 0.6421480