Hi,<br><br>Thanks for both of your reply.<br><br>File 1 is:<br><br> 3 C 1 CUR C19 1 0.200 12.0110 <br> 4 CR1 1 CUR C20 1 -0.060 12.0110 <br> 5 HC 1 CUR H20 1 0.060 1.0080 <br>
<br>File 2 is:<br>ATOM 2 H20 CUR 1 30.338 28.778 -6.812 1.00 0.00 <br>ATOM 4 C20 CUR 1 31.394 28.922 -7.039 1.00 0.00 <br>ATOM 5 C19 CUR 1 31.790 29.357 -8.323 1.00 0.00 <br>
<br>I wish to get:<br><br>ATOM 5 C19 CUR 1 31.790 29.357 -8.323 1.00 0.00 <br>ATOM 4 C20 CUR 1 31.394 28.922 -7.039 1.00 0.00 <br>ATOM 2 H20 CUR 1 30.338 28.778 -6.812 1.00 0.00 <br>
<br>The dictionary is C19 C20 H20 sequence read from file 1 field 5.<br>rearrange the file 2 field 3 following the sequence of C19, C20, H20.<br><br>Thanks.<br>