<div dir="ltr">Okay, thanks everyone! I'm convinced it's an issue with Mercury. <div><br></div><div>Thanks again!</div><div><br></div><div>Tim</div></div><div class="gmail_extra"><br><div class="gmail_quote">On Tue, Apr 3, 2018 at 3:33 PM, Andrius Merkys <span dir="ltr"><<a href="mailto:andrius.merkys@gmail.com" target="_blank">andrius.merkys@gmail.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<div text="#000000" bgcolor="#FFFFFF">
<p>Dear Timothy,</p>
<p>the CIF of COD entry 1545320 is syntactically correct according
to the CIF 1.1 syntax. As Mercury is a closed-source program, I
can not investigate the exact cause of the problem with it.
Nevertheless, I have checked the CIF with cif_linguist
(<a class="m_8013655483034241745moz-txt-link-freetext" href="https://github.com/COMCIFS/cif_api" target="_blank">https://github.com/COMCIFS/<wbr>cif_api</a>), CIF developer's
implementation of the CIF parser, to find out that cif_linguist
requires CIF value 'Fc^*^=kFc[1+0.001xFc^2^\l^3^/<wbr>sin(2\q)]^-1/4^'
be quoted (I have submitted a bug report,
<a class="m_8013655483034241745moz-txt-link-freetext" href="https://github.com/COMCIFS/cif_api/issues/22" target="_blank">https://github.com/COMCIFS/<wbr>cif_api/issues/22</a>). The same reason may
be with Mercury. You may try to remove the CIF line with
_refine_ls_extinction_<wbr>expression data item and try again to test
it.</p>
<p>Best wishes,<br>
Andrius<br>
</p><div><div class="h5">
<br>
<div class="m_8013655483034241745moz-cite-prefix">On 04/03/2018 04:07 PM, Timothy D
Siegler wrote:<br>
</div>
</div></div><blockquote type="cite"><div><div class="h5">
<div dir="ltr">To whom it may concern:
<div><br>
</div>
<div>I just downloaded the new version of Mercury. In the new
version, CIF #1545320 will not load.I tried using both my old
copy and a newly downloaded copy of this CIF file, but both
crash my program. <br clear="all">
<div><br>
</div>
<div><span style="color:rgb(34,34,34);font-family:arial,sans-serif;font-size:small;font-style:normal;font-variant-ligatures:normal;font-variant-caps:normal;font-weight:400;letter-spacing:normal;text-align:start;text-indent:0px;text-transform:none;white-space:normal;word-spacing:0px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial;float:none;display:inline">Other
CIF files I have tried from the database load perfectly
well.<span> </span></span>
<br>
</div>
<div><br>
</div>
<div>Thanks!</div>
<div><br>
</div>
<div>Tim</div>
<div><br>
</div>
-- <br>
<div class="m_8013655483034241745gmail_signature" data-smartmail="gmail_signature">
<div dir="ltr"><b style="font-size:12.8px"><span><font color="#666e75">Timothy D
Siegler</font></span><span> </span></b><span>| NDSEG Fellow,
Korgel Group</span><span><br>
</span><span>The University of
Texas at Austin</span><span> </span><span>| McKetta
Department of Chemical Engineering | Cockrell School of
Engineering<br>
<a href="https://maps.google.com/?q=100+E.+24th+St.+Austin,+TX+78712&entry=gmail&source=g">100 E. 24th St. Austin, TX 78712</a> | NHB 6.352 |
<a href="tel:(512)%20471-7043" value="+15124717043" target="_blank">512-471-7043</a> | <a href="mailto:tsiegler@utexas.edu" target="_blank">tsiegler@utexas.edu</a> </span><br>
</div>
</div>
</div>
</div>
<br>
<fieldset class="m_8013655483034241745mimeAttachmentHeader"></fieldset>
<br>
</div></div><pre>______________________________<wbr>_________________
Cod-bugs mailing list
<a class="m_8013655483034241745moz-txt-link-abbreviated" href="mailto:Cod-bugs@lists.crystallography.net" target="_blank">Cod-bugs@lists.<wbr>crystallography.net</a>
<a class="m_8013655483034241745moz-txt-link-freetext" href="http://lists.crystallography.net/cgi-bin/mailman/listinfo/cod-bugs" target="_blank">http://lists.crystallography.<wbr>net/cgi-bin/mailman/listinfo/<wbr>cod-bugs</a><span class="HOEnZb"><font color="#888888">
</font></span></pre><span class="HOEnZb"><font color="#888888">
</font></span></blockquote><span class="HOEnZb"><font color="#888888">
<br>
<pre class="m_8013655483034241745moz-signature" cols="0">--
Andrius Merkys
Vilnius University Institute of Biotechnology, <a href="https://maps.google.com/?q=Saul%C4%97tekio+al.+7,+room+V325&entry=gmail&source=g">Saulėtekio al. 7, room V325</a>
LT-10257 Vilnius, Lithuania</pre>
</font></span></div>
</blockquote></div><br><br clear="all"><div><br></div>-- <br><div class="gmail_signature" data-smartmail="gmail_signature"><div dir="ltr"><b style="font-size:12.8px"><span style="font-size:10pt;font-family:'Open Sans',sans-serif"><font color="#666e75">Timothy D Siegler</font></span><span style="font-size:10pt;font-family:'Open Sans',sans-serif;color:rgb(51,63,72)"> </span></b><span style="font-size:10pt;font-family:'Open Sans',sans-serif;color:rgb(102,110,117)">| NDSEG Fellow, Korgel Group</span><span style="font-size:10pt;font-family:'Open Sans',sans-serif;color:rgb(51,63,72)"><br></span><span style="font-size:10pt;font-family:'Open Sans',sans-serif;color:rgb(191,87,0)">The University of Texas at Austin</span><span style="font-size:10pt;font-family:'Open Sans',sans-serif;color:black"> </span><span style="font-size:10pt;font-family:'Open Sans',sans-serif;color:rgb(102,110,117)">| McKetta Department of Chemical Engineering | Cockrell School of Engineering<br>100 E. 24th St. Austin, TX 78712 | NHB 6.352 | 512-471-7043 | <a href="mailto:tsiegler@utexas.edu" target="_blank">tsiegler@utexas.edu</a> </span><br></div></div>
</div>