From 52cea818bf68f8a2d3c48d55d00c2f8b7da25e4c Mon Sep 17 00:00:00 2001
From: Daniel Hogan <daniel.hogan@usask.ca>
Date: Tue, 28 Mar 2017 22:21:18 -0600
Subject: [PATCH] Remove delete statement.

When from_scratch is true, coordinates is not allocated. A separate if
statement was added to handle the case when from_scratch is true that
does not try to free coordinates.
---
 src/formats/nwchemformat.cpp | 9 ++++++---
 1 file changed, 6 insertions(+), 3 deletions(-)

diff --git a/src/formats/nwchemformat.cpp b/src/formats/nwchemformat.cpp
index 6f625ad5b..79298555f 100644
--- a/src/formats/nwchemformat.cpp
+++ b/src/formats/nwchemformat.cpp
@@ -232,11 +232,14 @@ static const char* OPTIMIZATION_END_PATTERN = "  Optimization converged";
           break;
         tokenize(vs,buffer);
     }
-    if ((from_scratch)||(i != natoms))
-      {
+    if (from_scratch) 
+    {
+        return;
+    }
+    if (i != natoms) {
         delete[] coordinates;
         return;
-      }
+    }
     molecule->AddConformer(coordinates);
   }
 
ry</a><a href='/guix/refs/?id=abbe5a2a47860703477ef019e3f33f368e090027'>refs</a><a class='active' href='/guix/log/tests/lzlib.scm'>log</a><a href='/guix/tree/tests/lzlib.scm?id=abbe5a2a47860703477ef019e3f33f368e090027'>tree</a><a href='/guix/commit/tests/lzlib.scm?id=abbe5a2a47860703477ef019e3f33f368e090027'>commit</a><a href='/guix/diff/tests/lzlib.scm?id=abbe5a2a47860703477ef019e3f33f368e090027'>diff</a></td><td class='form'><form class='right' method='get' action='/guix/log/tests/lzlib.scm'>
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<div class='path'>path: <a href='/guix/log/?id=abbe5a2a47860703477ef019e3f33f368e090027'>root</a>/<a href='/guix/log/tests?id=abbe5a2a47860703477ef019e3f33f368e090027'>tests</a>/<a href='/guix/log/tests/lzlib.scm?id=abbe5a2a47860703477ef019e3f33f368e090027'>lzlib.scm</a></div><div class='content'><table class='list nowrap'><tr class='nohover'><th class='left'>Age</th><th class='left'>Commit message (<a href='/guix/log/tests/lzlib.scm?id=abbe5a2a47860703477ef019e3f33f368e090027&amp;showmsg=1'>Expand</a>)</th><th class='left'>Author</th></tr>
<tr><td><span title='2019-05-27 22:47:24 +0200'>2019-05-27</span></td><td><a href='/guix/commit/tests/lzlib.scm?id=2a991f3ae4823730395c7970d83159e93d5f5fe2'>lzlib: Add 'make-lzip-input-port/compressed'.</a><span class='msg-avail'>...<span class='msg-tooltip'>* guix/lzlib.scm (lzwrite!, make-lzip-input-port/compressed): New
procedures.
* tests/lzlib.scm ("make-lzip-input-port/compressed"): New test.
* guix/tests.scm (%seed): Export.
</span></span></td><td>Ludovic Courtès</td></tr>
<tr><td><span title='2019-05-06 23:21:33 +0200'>2019-05-06</span></td><td><a href='/guix/commit/tests/lzlib.scm?id=fea338c6ca1922097fa233be85f424c152a4f507'>Add (guix lzlib).</a><span class='msg-avail'>...<span class='msg-tooltip'>* guix/lzlib.scm, tests/lzlib.scm: New files.
* Makefile.am (MODULES): Add guix/lzlib.scm.
(SCM_TESTS): Add tests/lzlib.scm.
* m4/guix.m4 (GUIX_LIBLZ_LIBDIR): New macro.
* configure.ac (LIBLZ_LIBDIR): Use it.  Define and substitute
'LIBLZ'.
* guix/config.scm.in (%liblz): New variable.
* guix/self.scm (make-config.scm): Add TODO comment.

Co-authored-by: Ludovic Courtès &lt;ludo@gnu.org&gt;
</span></span></td><td>Pierre Neidhardt</td></tr>