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		<title><![CDATA[Multiwfn forum / AdNDP on Orca output]]></title>
		<link>http://sobereva.com/wfnbbs/viewtopic.php?id=1873</link>
		<description><![CDATA[The most recent posts in AdNDP on Orca output.]]></description>
		<lastBuildDate>Sun, 30 Aug 2026 03:58:10 +0000</lastBuildDate>
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			<title><![CDATA[Re: AdNDP on Orca output]]></title>
			<link>http://sobereva.com/wfnbbs/viewtopic.php?pid=5813#p5813</link>
			<description><![CDATA[<p>Hello,</p><p>Currently output file of ORCA+NBO is not officially supported by the AdNDP function in Multiwfn.</p>]]></description>
			<author><![CDATA[dummy@example.com (sobereva)]]></author>
			<pubDate>Sun, 30 Aug 2026 03:58:10 +0000</pubDate>
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			<title><![CDATA[AdNDP on Orca output]]></title>
			<link>http://sobereva.com/wfnbbs/viewtopic.php?pid=5812#p5812</link>
			<description><![CDATA[<p>Hello,</p><p>I am trying to do AdNDP on a DFT calculation I performed in Orca 6.1. When I try to load the Orca .out file or a .47 file, I get the following error: &quot;Error: Cannot found natural population analysis information in the input file!&quot;</p><p>The natural population analysis is explicitly requested in my Orca input using !NBO and:<br />%nbo<br />&#160; NBOKeyList = &quot;$NBO NPA AONBO=C DMNAO ARCHIVE $END&quot;<br /> end</p><p>Can I run AdNDP on an Orca output using different keywords or by changing the file type, or is Gaussian the only option, as shown in the manual?</p><p>Thank you!</p>]]></description>
			<author><![CDATA[dummy@example.com (chance)]]></author>
			<pubDate>Sat, 29 Aug 2026 23:48:15 +0000</pubDate>
			<guid>http://sobereva.com/wfnbbs/viewtopic.php?pid=5812#p5812</guid>
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