LAMMPS data file created from Tinker water_dimer.xyz and amoeba_water.prm files 6 atoms 4 bonds 2 angles 2 atom types 1 bond types 1 angle types -1.463996 0.933234 xlo xhi -0.756549 0.75612 ylo yhi -0.009705 2.935934 zlo zhi Masses 1 15.995 2 1.008 Atoms 1 1 1 0 -0.024616 -0.001154 -0.003748 2 1 2 0 -0.244211 -0.000666 0.933978 3 1 2 0 0.932234 -0.000406 -0.008705 4 2 1 0 -0.892721 0.000120 2.773674 5 2 2 0 -1.462996 0.755120 2.933870 6 2 2 0 -1.461809 -0.755549 2.934934 Bonds 1 1 1 2 2 1 1 3 3 1 4 5 4 1 4 6 Angles 1 1 2 1 3 2 1 5 4 6 Bond Coeffs 1 0.9572 556.85 -1419.9675 2112.20165625 Angle Coeffs 1 0 1 108.5 48.7 -39.064262472 8.95286947775 -6.41202044508 11.5462823034 BondAngle Coeffs 1 0.0 0.0 0.0 0.0 UreyBradley Coeffs 1 -7.6 1.5537 Tinker Types 1 1 2 2 3 2 4 1 5 2 6 2