diff --git a/arc/plotter.py b/arc/plotter.py index 5621025420..526688be52 100644 --- a/arc/plotter.py +++ b/arc/plotter.py @@ -751,7 +751,7 @@ def save_irc_traj_animation(irc_f_path, irc_r_path, out_path): f.write(' Number Number Type X Y Z\n') f.write(' ---------------------------------------------------------------------\n') for i, symbol in enumerate(xyz['symbols']): - el_num, x, y, z = NUMBER_BY_SYMBOL(symbol), xs[i], ys[i], zs[i] + el_num, x, y, z = NUMBER_BY_SYMBOL[symbol], xs[i], ys[i], zs[i] f.write(f' {i + 1:>5} {el_num} 0 {x} {y} {z}\n') f.write(' ---------------------------------------------------------------------\n') f.write(' GradGradGradGradGradGradGradGradGradGradGradGradGradGradGradGradGradGrad\n')