pan class="stringliteral">&#39;MW1&#39;</span>,  <span class="comment"># manganese ion, 1 water coordinated</span></div><div class="line"><a name="l00045"></a><span class="lineno">   45</span>&#160;                                              <span class="stringliteral">&#39;IOD&#39;</span>,  <span class="comment"># iodide ion</span></div><div class="line"><a name="l00046"></a><span class="lineno">   46</span>&#160;                                              <span class="stringliteral">&#39;C2O&#39;</spa