Index: doc/userguide/userguide.xml
===================================================================
--- doc/userguide/userguide.xml	(revision 3213f29e16ba9cf8c7dc57a7343907df2ec3988a)
+++ doc/userguide/userguide.xml	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -720,4 +720,15 @@
                 <programlisting>
                 ... --unselect-atoms-molecules
+                </programlisting>
+              </listitem>
+
+              <listitem>
+                <para>Push/Pop the current selection to/from a stack to store 
+		it momentarily and allow modifications in MakroActions.</para>
+                <programlisting>
+                ... --push-molecule-selection
+                </programlisting>
+                <programlisting>
+                ... --pop-molecule-selection
                 </programlisting>
               </listitem>
Index: src/Actions/GlobalListOfActions.hpp
===================================================================
--- src/Actions/GlobalListOfActions.hpp	(revision 3213f29e16ba9cf8c7dc57a7343907df2ec3988a)
+++ src/Actions/GlobalListOfActions.hpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -129,4 +129,6 @@
   (SelectionPopAtoms) \
   (SelectionPushAtoms) \
+  (SelectionPopMolecules) \
+  (SelectionPushMolecules) \
   (SelectionShapeByName) \
   (ShapeCombineShapes) \
Index: src/Actions/Makefile.am
===================================================================
--- src/Actions/Makefile.am	(revision 3213f29e16ba9cf8c7dc57a7343907df2ec3988a)
+++ src/Actions/Makefile.am	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -467,5 +467,7 @@
   Actions/SelectionAction/Molecules/NotMoleculeByNameAction.cpp \
   Actions/SelectionAction/Molecules/NotMoleculeByOrderAction.cpp \
-  Actions/SelectionAction/Molecules/NotMoleculeOfAtomAction.cpp
+  Actions/SelectionAction/Molecules/NotMoleculeOfAtomAction.cpp \
+  Actions/SelectionAction/Molecules/PopMoleculesAction.cpp \
+  Actions/SelectionAction/Molecules/PushMoleculesAction.cpp
 SELECTIONMOLECULEACTIONHEADER = \
   Actions/SelectionAction/Molecules/AllMoleculesAction.hpp \
@@ -482,5 +484,7 @@
   Actions/SelectionAction/Molecules/NotMoleculeByNameAction.hpp \
   Actions/SelectionAction/Molecules/NotMoleculeByOrderAction.hpp \
-  Actions/SelectionAction/Molecules/NotMoleculeOfAtomAction.hpp
+  Actions/SelectionAction/Molecules/NotMoleculeOfAtomAction.hpp \
+  Actions/SelectionAction/Molecules/PopMoleculesAction.hpp \
+  Actions/SelectionAction/Molecules/PushMoleculesAction.hpp
 SELECTIONMOLECULEACTIONDEFS = \
   Actions/SelectionAction/Molecules/AllMoleculesAction.def \
@@ -497,5 +501,7 @@
   Actions/SelectionAction/Molecules/NotMoleculeByNameAction.def \
   Actions/SelectionAction/Molecules/NotMoleculeByOrderAction.def \
-  Actions/SelectionAction/Molecules/NotMoleculeOfAtomAction.def
+  Actions/SelectionAction/Molecules/NotMoleculeOfAtomAction.def \
+  Actions/SelectionAction/Molecules/PopMoleculesAction.def \
+  Actions/SelectionAction/Molecules/PushMoleculesAction.def
                  
 SELECTIONSHAPEACTIONSOURCE = \
Index: src/Actions/SelectionAction/Molecules/PopMoleculesAction.cpp
===================================================================
--- src/Actions/SelectionAction/Molecules/PopMoleculesAction.cpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ src/Actions/SelectionAction/Molecules/PopMoleculesAction.cpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,88 @@
+/*
+ * Project: MoleCuilder
+ * Description: creates and alters molecular systems
+ * Copyright (C)  2014 Frederik Heber. All rights reserved.
+ * 
+ *
+ *   This file is part of MoleCuilder.
+ *
+ *    MoleCuilder is free software: you can redistribute it and/or modify
+ *    it under the terms of the GNU General Public License as published by
+ *    the Free Software Foundation, either version 2 of the License, or
+ *    (at your option) any later version.
+ *
+ *    MoleCuilder is distributed in the hope that it will be useful,
+ *    but WITHOUT ANY WARRANTY; without even the implied warranty of
+ *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
+ *    GNU General Public License for more details.
+ *
+ *    You should have received a copy of the GNU General Public License
+ *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>.
+ */
+
+/*
+ * PopMoleculesAction.cpp
+ *
+ *  Created on: Dec 19, 2014
+ *      Author: heber
+ */
+
+// include config.h
+#ifdef HAVE_CONFIG_H
+#include <config.h>
+#endif
+
+#include "CodePatterns/MemDebug.hpp"
+
+#include <boost/bind.hpp>
+#include "CodePatterns/Log.hpp"
+#include "molecule.hpp"
+#include "World.hpp"
+
+#include "PopMoleculesAction.hpp"
+
+using namespace MoleCuilder;
+
+// and construct the stuff
+#include "PopMoleculesAction.def"
+#include "Action_impl_pre.hpp"
+/** =========== define the function ====================== */
+ActionState::ptr SelectionPopMoleculesAction::performCall() {
+  // create undo state
+  const std::vector<molecule *> selected_mols = World::getInstance().getSelectedMolecules();
+  std::vector<moleculeId_t> selected_molids(selected_mols.size(), (moleculeId_t)-1);
+  std::transform(
+      selected_mols.begin(), selected_mols.end(),
+      selected_molids.begin(),
+      boost::bind(&molecule::getId, _1));
+  LOG(1, "Popping molecule selection.");
+  World::getInstance().popMoleculeSelection();
+  return ActionState::ptr(new SelectionPopMoleculesState(selected_molids, params));
+}
+
+ActionState::ptr SelectionPopMoleculesAction::performUndo(ActionState::ptr _state) {
+  SelectionPopMoleculesState *state = static_cast<SelectionPopMoleculesState *>(_state.get());
+  LOG(1, "Pushing molecule selection.");
+  World::getInstance().pushMoleculeSelection();
+  // re-create old selection
+  for(std::vector<moleculeId_t>::const_iterator iter = state->selected_molids.begin();
+      iter != state->selected_molids.end(); ++iter)
+    World::getInstance().selectMolecule(*iter);
+
+  return ActionState::ptr(_state);
+}
+
+ActionState::ptr SelectionPopMoleculesAction::performRedo(ActionState::ptr _state){
+  LOG(1, "Popping molecule selection.");
+  World::getInstance().popMoleculeSelection();
+  return ActionState::ptr(_state);
+}
+
+bool SelectionPopMoleculesAction::canUndo() {
+  return true;
+}
+
+bool SelectionPopMoleculesAction::shouldUndo() {
+  return true;
+}
+/** =========== end of function ====================== */
Index: src/Actions/SelectionAction/Molecules/PopMoleculesAction.def
===================================================================
--- src/Actions/SelectionAction/Molecules/PopMoleculesAction.def	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ src/Actions/SelectionAction/Molecules/PopMoleculesAction.def	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,35 @@
+/*
+ * PopMoleculesAction.def
+ *
+ *  Created on: Dec 19, 2014
+ *      Author: heber
+ */
+
+// all includes and forward declarations necessary for non-integral types below
+#include <vector>
+#include "types.hpp"
+
+// i.e. there is an integer with variable name Z that can be found in
+// ValueStorage by the token "Z" -> first column: int, Z, "Z"
+// "undefine" if no parameters are required, use (NOPARAM_DEFAULT) for each (undefined) default value
+#undef paramtypes
+#undef paramtokens
+#undef paramdescriptions
+#undef paramdefaults
+#undef paramreferences
+#undef paramvalids
+
+#define statetypes (std::vector<moleculeId_t>)
+#define statereferences (selected_molids)
+
+// some defines for all the names, you may use ACTION, STATE and PARAMS
+#define CATEGORY Selection
+#define MENUNAME "selection"
+#define MENUPOSITION 1
+#define ACTIONNAME PopMolecules
+#define TOKEN "pop-molecule-selection"
+
+
+// finally the information stored in the ActionTrait specialization
+#define DESCRIPTION "push the molecule selection to a stack"
+#undef SHORTFORM
Index: src/Actions/SelectionAction/Molecules/PopMoleculesAction.hpp
===================================================================
--- src/Actions/SelectionAction/Molecules/PopMoleculesAction.hpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ src/Actions/SelectionAction/Molecules/PopMoleculesAction.hpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,22 @@
+/*
+ * PopMoleculesAction.hpp
+ *
+ *  Created on: Dec 19, 2014
+ *      Author: heber
+ */
+
+#ifndef POPMOLECULESACTION_HPP_
+#define POPMOLECULESACTION_HPP_
+
+// include config.h
+#ifdef HAVE_CONFIG_H
+#include <config.h>
+#endif
+
+
+#include "Actions/Action.hpp"
+
+#include "PopMoleculesAction.def"
+#include "Action_impl_header.hpp"
+
+#endif /* POPMOLECULESACTION_HPP_ */
Index: src/Actions/SelectionAction/Molecules/PushMoleculesAction.cpp
===================================================================
--- src/Actions/SelectionAction/Molecules/PushMoleculesAction.cpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ src/Actions/SelectionAction/Molecules/PushMoleculesAction.cpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,73 @@
+/*
+ * Project: MoleCuilder
+ * Description: creates and alters molecular systems
+ * Copyright (C)  2014 Frederik Heber. All rights reserved.
+ * 
+ *
+ *   This file is part of MoleCuilder.
+ *
+ *    MoleCuilder is free software: you can redistribute it and/or modify
+ *    it under the terms of the GNU General Public License as published by
+ *    the Free Software Foundation, either version 2 of the License, or
+ *    (at your option) any later version.
+ *
+ *    MoleCuilder is distributed in the hope that it will be useful,
+ *    but WITHOUT ANY WARRANTY; without even the implied warranty of
+ *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
+ *    GNU General Public License for more details.
+ *
+ *    You should have received a copy of the GNU General Public License
+ *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>.
+ */
+
+/*
+ * PushMoleculesAction.cpp
+ *
+ *  Created on: Dec 19, 2014
+ *      Author: heber
+ */
+
+// include config.h
+#ifdef HAVE_CONFIG_H
+#include <config.h>
+#endif
+
+#include "CodePatterns/MemDebug.hpp"
+
+#include "CodePatterns/Log.hpp"
+#include "World.hpp"
+
+#include "PushMoleculesAction.hpp"
+
+using namespace MoleCuilder;
+
+// and construct the stuff
+#include "PushMoleculesAction.def"
+#include "Action_impl_pre.hpp"
+/** =========== define the function ====================== */
+ActionState::ptr SelectionPushMoleculesAction::performCall() {
+  LOG(1, "Pushing molecule selection.");
+  World::getInstance().pushMoleculeSelection();
+
+  return Action::success;
+}
+
+ActionState::ptr SelectionPushMoleculesAction::performUndo(ActionState::ptr _state) {
+  LOG(1, "Pushing molecule selection.");
+  World::getInstance().popMoleculeSelection();
+
+  return Action::success;
+}
+
+ActionState::ptr SelectionPushMoleculesAction::performRedo(ActionState::ptr _state){
+  return performCall();
+}
+
+bool SelectionPushMoleculesAction::canUndo() {
+  return true;
+}
+
+bool SelectionPushMoleculesAction::shouldUndo() {
+  return true;
+}
+/** =========== end of function ====================== */
Index: src/Actions/SelectionAction/Molecules/PushMoleculesAction.def
===================================================================
--- src/Actions/SelectionAction/Molecules/PushMoleculesAction.def	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ src/Actions/SelectionAction/Molecules/PushMoleculesAction.def	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,33 @@
+/*
+ * PushMoleculesAction.def
+ *
+ *  Created on: Dec 19, 2014
+ *      Author: heber
+ */
+
+// all includes and forward declarations necessary for non-integral types below
+
+// i.e. there is an integer with variable name Z that can be found in
+// ValueStorage by the token "Z" -> first column: int, Z, "Z"
+// "undefine" if no parameters are required, use (NOPARAM_DEFAULT) for each (undefined) default value
+#undef paramtypes
+#undef paramtokens
+#undef paramdescriptions
+#undef paramdefaults
+#undef paramreferences
+#undef paramvalids
+
+#undef statetypes
+#undef statereferences
+
+// some defines for all the names, you may use ACTION, STATE and PARAMS
+#define CATEGORY Selection
+#define MENUNAME "selection"
+#define MENUPOSITION 1
+#define ACTIONNAME PushMolecules
+#define TOKEN "push-molecule-selection"
+
+
+// finally the information stored in the ActionTrait specialization
+#define DESCRIPTION "push the molecule selection from a stack"
+#undef SHORTFORM
Index: src/Actions/SelectionAction/Molecules/PushMoleculesAction.hpp
===================================================================
--- src/Actions/SelectionAction/Molecules/PushMoleculesAction.hpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ src/Actions/SelectionAction/Molecules/PushMoleculesAction.hpp	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,22 @@
+/*
+ * PushMoleculesAction.hpp
+ *
+ *  Created on: Dec 19, 2014
+ *      Author: heber
+ */
+
+#ifndef PUSHMOLECULESACTION_HPP_
+#define PUSHMOLECULESACTION_HPP_
+
+// include config.h
+#ifdef HAVE_CONFIG_H
+#include <config.h>
+#endif
+
+
+#include "Actions/Action.hpp"
+
+#include "PushMoleculesAction.def"
+#include "Action_impl_header.hpp"
+
+#endif /* PUSHMOLECULESACTION_HPP_ */
Index: tests/regression/Makefile.am
===================================================================
--- tests/regression/Makefile.am	(revision 3213f29e16ba9cf8c7dc57a7343907df2ec3988a)
+++ tests/regression/Makefile.am	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -221,4 +221,6 @@
 	$(srcdir)/Selection/Molecules/MoleculeOfAtom/testsuite-selection-select-atoms-molecules.at \
 	$(srcdir)/Selection/Molecules/MoleculeOfAtom/testsuite-selection-unselect-atoms-molecules.at \
+	$(srcdir)/Selection/Molecules/PopMoleculeSelection/testsuite-selection-pop-molecule-selection.at \
+	$(srcdir)/Selection/Molecules/PushMoleculeSelection/testsuite-selection-push-molecule-selection.at \
 	$(srcdir)/Tesselation/testsuite-tesselation.at \
 	$(srcdir)/Tesselation/BigConvex/testsuite-tesselation-big-convex-envelope.at \
Index: tests/regression/Selection/Molecules/PopMoleculeSelection/post/box.xyz
===================================================================
--- tests/regression/Selection/Molecules/PopMoleculeSelection/post/box.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PopMoleculeSelection/post/box.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,1031 @@
+1029
+	Created by molecuilder for select-molecule-by-id test
+O	0	0	0.504284
+H	0.758602	0	1.00857
+H	0.758602	0	0
+O	0	0	3.36143
+H	0.758602	0	3.86571
+H	0.758602	0	2.85714
+O	0	0	6.21857
+H	0.758602	0	6.72285
+H	0.758602	0	5.71429
+O	0	0	9.07571
+H	0.758602	0	9.58
+H	0.758602	0	8.57143
+O	0	0	11.9329
+H	0.758602	0	12.4371
+H	0.758602	0	11.4286
+O	0	0	14.79
+H	0.758602	0	15.2943
+H	0.758602	0	14.2857
+O	0	0	17.6471
+H	0.758602	0	18.1514
+H	0.758602	0	17.1429
+O	0	2.85714	0.504284
+H	0.758602	2.85714	1.00857
+H	0.758602	2.85714	0
+O	0	2.85714	3.36143
+H	0.758602	2.85714	3.86571
+H	0.758602	2.85714	2.85714
+O	0	2.85714	6.21857
+H	0.758602	2.85714	6.72285
+H	0.758602	2.85714	5.71429
+O	0	2.85714	9.07571
+H	0.758602	2.85714	9.58
+H	0.758602	2.85714	8.57143
+O	0	2.85714	11.9329
+H	0.758602	2.85714	12.4371
+H	0.758602	2.85714	11.4286
+O	0	2.85714	14.79
+H	0.758602	2.85714	15.2943
+H	0.758602	2.85714	14.2857
+O	0	2.85714	17.6471
+H	0.758602	2.85714	18.1514
+H	0.758602	2.85714	17.1429
+O	0	5.71429	0.504284
+H	0.758602	5.71429	1.00857
+H	0.758602	5.71429	0
+O	0	5.71429	3.36143
+H	0.758602	5.71429	3.86571
+H	0.758602	5.71429	2.85714
+O	0	5.71429	6.21857
+H	0.758602	5.71429	6.72285
+H	0.758602	5.71429	5.71429
+O	0	5.71429	9.07571
+H	0.758602	5.71429	9.58
+H	0.758602	5.71429	8.57143
+O	0	5.71429	11.9329
+H	0.758602	5.71429	12.4371
+H	0.758602	5.71429	11.4286
+O	0	5.71429	14.79
+H	0.758602	5.71429	15.2943
+H	0.758602	5.71429	14.2857
+O	0	5.71429	17.6471
+H	0.758602	5.71429	18.1514
+H	0.758602	5.71429	17.1429
+O	0	8.57143	0.504284
+H	0.758602	8.57143	1.00857
+H	0.758602	8.57143	0
+O	0	8.57143	3.36143
+H	0.758602	8.57143	3.86571
+H	0.758602	8.57143	2.85714
+O	0	8.57143	6.21857
+H	0.758602	8.57143	6.72285
+H	0.758602	8.57143	5.71429
+O	0	8.57143	9.07571
+H	0.758602	8.57143	9.58
+H	0.758602	8.57143	8.57143
+O	0	8.57143	11.9329
+H	0.758602	8.57143	12.4371
+H	0.758602	8.57143	11.4286
+O	0	8.57143	14.79
+H	0.758602	8.57143	15.2943
+H	0.758602	8.57143	14.2857
+O	0	8.57143	17.6471
+H	0.758602	8.57143	18.1514
+H	0.758602	8.57143	17.1429
+O	0	11.4286	0.504284
+H	0.758602	11.4286	1.00857
+H	0.758602	11.4286	0
+O	0	11.4286	3.36143
+H	0.758602	11.4286	3.86571
+H	0.758602	11.4286	2.85714
+O	0	11.4286	6.21857
+H	0.758602	11.4286	6.72285
+H	0.758602	11.4286	5.71429
+O	0	11.4286	9.07571
+H	0.758602	11.4286	9.58
+H	0.758602	11.4286	8.57143
+O	0	11.4286	11.9329
+H	0.758602	11.4286	12.4371
+H	0.758602	11.4286	11.4286
+O	0	11.4286	14.79
+H	0.758602	11.4286	15.2943
+H	0.758602	11.4286	14.2857
+O	0	11.4286	17.6471
+H	0.758602	11.4286	18.1514
+H	0.758602	11.4286	17.1429
+O	0	14.2857	0.504284
+H	0.758602	14.2857	1.00857
+H	0.758602	14.2857	0
+O	0	14.2857	3.36143
+H	0.758602	14.2857	3.86571
+H	0.758602	14.2857	2.85714
+O	0	14.2857	6.21857
+H	0.758602	14.2857	6.72285
+H	0.758602	14.2857	5.71429
+O	0	14.2857	9.07571
+H	0.758602	14.2857	9.58
+H	0.758602	14.2857	8.57143
+O	0	14.2857	11.9329
+H	0.758602	14.2857	12.4371
+H	0.758602	14.2857	11.4286
+O	0	14.2857	14.79
+H	0.758602	14.2857	15.2943
+H	0.758602	14.2857	14.2857
+O	0	14.2857	17.6471
+H	0.758602	14.2857	18.1514
+H	0.758602	14.2857	17.1429
+O	0	17.1429	0.504284
+H	0.758602	17.1429	1.00857
+H	0.758602	17.1429	0
+O	0	17.1429	3.36143
+H	0.758602	17.1429	3.86571
+H	0.758602	17.1429	2.85714
+O	0	17.1429	6.21857
+H	0.758602	17.1429	6.72285
+H	0.758602	17.1429	5.71429
+O	0	17.1429	9.07571
+H	0.758602	17.1429	9.58
+H	0.758602	17.1429	8.57143
+O	0	17.1429	11.9329
+H	0.758602	17.1429	12.4371
+H	0.758602	17.1429	11.4286
+O	0	17.1429	14.79
+H	0.758602	17.1429	15.2943
+H	0.758602	17.1429	14.2857
+O	0	17.1429	17.6471
+H	0.758602	17.1429	18.1514
+H	0.758602	17.1429	17.1429
+O	2.85714	0	0.504284
+H	3.61574	0	1.00857
+H	3.61574	0	0
+O	2.85714	0	3.36143
+H	3.61574	0	3.86571
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+H	3.61574	0	5.71429
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+H	3.61574	0	9.58
+H	3.61574	0	8.57143
+O	2.85714	0	11.9329
+H	3.61574	0	12.4371
+H	3.61574	0	11.4286
+O	2.85714	0	14.79
+H	3.61574	0	15.2943
+H	3.61574	0	14.2857
+O	2.85714	0	17.6471
+H	3.61574	0	18.1514
+H	3.61574	0	17.1429
+O	2.85714	2.85714	0.504284
+H	3.61574	2.85714	1.00857
+H	3.61574	2.85714	0
+O	2.85714	2.85714	3.36143
+H	3.61574	2.85714	3.86571
+H	3.61574	2.85714	2.85714
+O	2.85714	2.85714	6.21857
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+H	12.1872	2.85714	8.57143
+O	11.4286	2.85714	11.9329
+H	12.1872	2.85714	12.4371
+H	12.1872	2.85714	11.4286
+O	11.4286	2.85714	14.79
+H	12.1872	2.85714	15.2943
+H	12.1872	2.85714	14.2857
+O	11.4286	2.85714	17.6471
+H	12.1872	2.85714	18.1514
+H	12.1872	2.85714	17.1429
+O	11.4286	5.71429	0.504284
+H	12.1872	5.71429	1.00857
+H	12.1872	5.71429	0
+O	11.4286	5.71429	3.36143
+H	12.1872	5.71429	3.86571
+H	12.1872	5.71429	2.85714
+O	11.4286	5.71429	6.21857
+H	12.1872	5.71429	6.72285
+H	12.1872	5.71429	5.71429
+O	11.4286	5.71429	9.07571
+H	12.1872	5.71429	9.58
+H	12.1872	5.71429	8.57143
+O	11.4286	5.71429	11.9329
+H	12.1872	5.71429	12.4371
+H	12.1872	5.71429	11.4286
+O	11.4286	5.71429	14.79
+H	12.1872	5.71429	15.2943
+H	12.1872	5.71429	14.2857
+O	11.4286	5.71429	17.6471
+H	12.1872	5.71429	18.1514
+H	12.1872	5.71429	17.1429
+O	11.4286	8.57143	0.504284
+H	12.1872	8.57143	1.00857
+H	12.1872	8.57143	0
+O	11.4286	8.57143	3.36143
+H	12.1872	8.57143	3.86571
+H	12.1872	8.57143	2.85714
+O	11.4286	8.57143	6.21857
+H	12.1872	8.57143	6.72285
+H	12.1872	8.57143	5.71429
+O	11.4286	8.57143	9.07571
+H	12.1872	8.57143	9.58
+H	12.1872	8.57143	8.57143
+O	11.4286	8.57143	11.9329
+H	12.1872	8.57143	12.4371
+H	12.1872	8.57143	11.4286
+O	11.4286	8.57143	14.79
+H	12.1872	8.57143	15.2943
+H	12.1872	8.57143	14.2857
+O	11.4286	8.57143	17.6471
+H	12.1872	8.57143	18.1514
+H	12.1872	8.57143	17.1429
+O	11.4286	11.4286	0.504284
+H	12.1872	11.4286	1.00857
+H	12.1872	11.4286	0
+O	11.4286	11.4286	3.36143
+H	12.1872	11.4286	3.86571
+H	12.1872	11.4286	2.85714
+O	11.4286	11.4286	6.21857
+H	12.1872	11.4286	6.72285
+H	12.1872	11.4286	5.71429
+O	11.4286	11.4286	9.07571
+H	12.1872	11.4286	9.58
+H	12.1872	11.4286	8.57143
+O	11.4286	11.4286	11.9329
+H	12.1872	11.4286	12.4371
+H	12.1872	11.4286	11.4286
+O	11.4286	11.4286	14.79
+H	12.1872	11.4286	15.2943
+H	12.1872	11.4286	14.2857
+O	11.4286	11.4286	17.6471
+H	12.1872	11.4286	18.1514
+H	12.1872	11.4286	17.1429
+O	11.4286	14.2857	0.504284
+H	12.1872	14.2857	1.00857
+H	12.1872	14.2857	0
+O	11.4286	14.2857	3.36143
+H	12.1872	14.2857	3.86571
+H	12.1872	14.2857	2.85714
+O	11.4286	14.2857	6.21857
+H	12.1872	14.2857	6.72285
+H	12.1872	14.2857	5.71429
+O	11.4286	14.2857	9.07571
+H	12.1872	14.2857	9.58
+H	12.1872	14.2857	8.57143
+O	11.4286	14.2857	11.9329
+H	12.1872	14.2857	12.4371
+H	12.1872	14.2857	11.4286
+O	11.4286	14.2857	14.79
+H	12.1872	14.2857	15.2943
+H	12.1872	14.2857	14.2857
+O	11.4286	14.2857	17.6471
+H	12.1872	14.2857	18.1514
+H	12.1872	14.2857	17.1429
+O	11.4286	17.1429	0.504284
+H	12.1872	17.1429	1.00857
+H	12.1872	17.1429	0
+O	11.4286	17.1429	3.36143
+H	12.1872	17.1429	3.86571
+H	12.1872	17.1429	2.85714
+O	11.4286	17.1429	6.21857
+H	12.1872	17.1429	6.72285
+H	12.1872	17.1429	5.71429
+O	11.4286	17.1429	9.07571
+H	12.1872	17.1429	9.58
+H	12.1872	17.1429	8.57143
+O	11.4286	17.1429	11.9329
+H	12.1872	17.1429	12.4371
+H	12.1872	17.1429	11.4286
+O	11.4286	17.1429	14.79
+H	12.1872	17.1429	15.2943
+H	12.1872	17.1429	14.2857
+O	11.4286	17.1429	17.6471
+H	12.1872	17.1429	18.1514
+H	12.1872	17.1429	17.1429
+O	14.2857	0	0.504284
+H	15.0443	0	1.00857
+H	15.0443	0	0
+O	14.2857	0	3.36143
+H	15.0443	0	3.86571
+H	15.0443	0	2.85714
+O	14.2857	0	6.21857
+H	15.0443	0	6.72285
+H	15.0443	0	5.71429
+O	14.2857	0	9.07571
+H	15.0443	0	9.58
+H	15.0443	0	8.57143
+O	14.2857	0	11.9329
+H	15.0443	0	12.4371
+H	15.0443	0	11.4286
+O	14.2857	0	14.79
+H	15.0443	0	15.2943
+H	15.0443	0	14.2857
+O	14.2857	0	17.6471
+H	15.0443	0	18.1514
+H	15.0443	0	17.1429
+O	14.2857	2.85714	0.504284
+H	15.0443	2.85714	1.00857
+H	15.0443	2.85714	0
+O	14.2857	2.85714	3.36143
+H	15.0443	2.85714	3.86571
+H	15.0443	2.85714	2.85714
+O	14.2857	2.85714	6.21857
+H	15.0443	2.85714	6.72285
+H	15.0443	2.85714	5.71429
+O	14.2857	2.85714	9.07571
+H	15.0443	2.85714	9.58
+H	15.0443	2.85714	8.57143
+O	14.2857	2.85714	11.9329
+H	15.0443	2.85714	12.4371
+H	15.0443	2.85714	11.4286
+O	14.2857	2.85714	14.79
+H	15.0443	2.85714	15.2943
+H	15.0443	2.85714	14.2857
+O	14.2857	2.85714	17.6471
+H	15.0443	2.85714	18.1514
+H	15.0443	2.85714	17.1429
+O	14.2857	5.71429	0.504284
+H	15.0443	5.71429	1.00857
+H	15.0443	5.71429	0
+O	14.2857	5.71429	3.36143
+H	15.0443	5.71429	3.86571
+H	15.0443	5.71429	2.85714
+O	14.2857	5.71429	6.21857
+H	15.0443	5.71429	6.72285
+H	15.0443	5.71429	5.71429
+O	14.2857	5.71429	9.07571
+H	15.0443	5.71429	9.58
+H	15.0443	5.71429	8.57143
+O	14.2857	5.71429	11.9329
+H	15.0443	5.71429	12.4371
+H	15.0443	5.71429	11.4286
+O	14.2857	5.71429	14.79
+H	15.0443	5.71429	15.2943
+H	15.0443	5.71429	14.2857
+O	14.2857	5.71429	17.6471
+H	15.0443	5.71429	18.1514
+H	15.0443	5.71429	17.1429
+O	14.2857	8.57143	0.504284
+H	15.0443	8.57143	1.00857
+H	15.0443	8.57143	0
+O	14.2857	8.57143	3.36143
+H	15.0443	8.57143	3.86571
+H	15.0443	8.57143	2.85714
+O	14.2857	8.57143	6.21857
+H	15.0443	8.57143	6.72285
+H	15.0443	8.57143	5.71429
+O	14.2857	8.57143	9.07571
+H	15.0443	8.57143	9.58
+H	15.0443	8.57143	8.57143
+O	14.2857	8.57143	11.9329
+H	15.0443	8.57143	12.4371
+H	15.0443	8.57143	11.4286
+O	14.2857	8.57143	14.79
+H	15.0443	8.57143	15.2943
+H	15.0443	8.57143	14.2857
+O	14.2857	8.57143	17.6471
+H	15.0443	8.57143	18.1514
+H	15.0443	8.57143	17.1429
+O	14.2857	11.4286	0.504284
+H	15.0443	11.4286	1.00857
+H	15.0443	11.4286	0
+O	14.2857	11.4286	3.36143
+H	15.0443	11.4286	3.86571
+H	15.0443	11.4286	2.85714
+O	14.2857	11.4286	6.21857
+H	15.0443	11.4286	6.72285
+H	15.0443	11.4286	5.71429
+O	14.2857	11.4286	9.07571
+H	15.0443	11.4286	9.58
+H	15.0443	11.4286	8.57143
+O	14.2857	11.4286	11.9329
+H	15.0443	11.4286	12.4371
+H	15.0443	11.4286	11.4286
+O	14.2857	11.4286	14.79
+H	15.0443	11.4286	15.2943
+H	15.0443	11.4286	14.2857
+O	14.2857	11.4286	17.6471
+H	15.0443	11.4286	18.1514
+H	15.0443	11.4286	17.1429
+O	14.2857	14.2857	0.504284
+H	15.0443	14.2857	1.00857
+H	15.0443	14.2857	0
+O	14.2857	14.2857	3.36143
+H	15.0443	14.2857	3.86571
+H	15.0443	14.2857	2.85714
+O	14.2857	14.2857	6.21857
+H	15.0443	14.2857	6.72285
+H	15.0443	14.2857	5.71429
+O	14.2857	14.2857	9.07571
+H	15.0443	14.2857	9.58
+H	15.0443	14.2857	8.57143
+O	14.2857	14.2857	11.9329
+H	15.0443	14.2857	12.4371
+H	15.0443	14.2857	11.4286
+O	14.2857	14.2857	14.79
+H	15.0443	14.2857	15.2943
+H	15.0443	14.2857	14.2857
+O	14.2857	14.2857	17.6471
+H	15.0443	14.2857	18.1514
+H	15.0443	14.2857	17.1429
+O	14.2857	17.1429	0.504284
+H	15.0443	17.1429	1.00857
+H	15.0443	17.1429	0
+O	14.2857	17.1429	3.36143
+H	15.0443	17.1429	3.86571
+H	15.0443	17.1429	2.85714
+O	14.2857	17.1429	6.21857
+H	15.0443	17.1429	6.72285
+H	15.0443	17.1429	5.71429
+O	14.2857	17.1429	9.07571
+H	15.0443	17.1429	9.58
+H	15.0443	17.1429	8.57143
+O	14.2857	17.1429	11.9329
+H	15.0443	17.1429	12.4371
+H	15.0443	17.1429	11.4286
+O	14.2857	17.1429	14.79
+H	15.0443	17.1429	15.2943
+H	15.0443	17.1429	14.2857
+O	14.2857	17.1429	17.6471
+H	15.0443	17.1429	18.1514
+H	15.0443	17.1429	17.1429
+O	17.1429	0	0.504284
+H	17.9015	0	1.00857
+H	17.9015	0	0
+O	17.1429	0	3.36143
+H	17.9015	0	3.86571
+H	17.9015	0	2.85714
+O	17.1429	0	6.21857
+H	17.9015	0	6.72285
+H	17.9015	0	5.71429
+O	17.1429	0	9.07571
+H	17.9015	0	9.58
+H	17.9015	0	8.57143
+O	17.1429	0	11.9329
+H	17.9015	0	12.4371
+H	17.9015	0	11.4286
+O	17.1429	0	14.79
+H	17.9015	0	15.2943
+H	17.9015	0	14.2857
+O	17.1429	0	17.6471
+H	17.9015	0	18.1514
+H	17.9015	0	17.1429
+O	17.1429	2.85714	0.504284
+H	17.9015	2.85714	1.00857
+H	17.9015	2.85714	0
+O	17.1429	2.85714	3.36143
+H	17.9015	2.85714	3.86571
+H	17.9015	2.85714	2.85714
+O	17.1429	2.85714	6.21857
+H	17.9015	2.85714	6.72285
+H	17.9015	2.85714	5.71429
+O	17.1429	2.85714	9.07571
+H	17.9015	2.85714	9.58
+H	17.9015	2.85714	8.57143
+O	17.1429	2.85714	11.9329
+H	17.9015	2.85714	12.4371
+H	17.9015	2.85714	11.4286
+O	17.1429	2.85714	14.79
+H	17.9015	2.85714	15.2943
+H	17.9015	2.85714	14.2857
+O	17.1429	2.85714	17.6471
+H	17.9015	2.85714	18.1514
+H	17.9015	2.85714	17.1429
+O	17.1429	5.71429	0.504284
+H	17.9015	5.71429	1.00857
+H	17.9015	5.71429	0
+O	17.1429	5.71429	3.36143
+H	17.9015	5.71429	3.86571
+H	17.9015	5.71429	2.85714
+O	17.1429	5.71429	6.21857
+H	17.9015	5.71429	6.72285
+H	17.9015	5.71429	5.71429
+O	17.1429	5.71429	9.07571
+H	17.9015	5.71429	9.58
+H	17.9015	5.71429	8.57143
+O	17.1429	5.71429	11.9329
+H	17.9015	5.71429	12.4371
+H	17.9015	5.71429	11.4286
+O	17.1429	5.71429	14.79
+H	17.9015	5.71429	15.2943
+H	17.9015	5.71429	14.2857
+O	17.1429	5.71429	17.6471
+H	17.9015	5.71429	18.1514
+H	17.9015	5.71429	17.1429
+O	17.1429	8.57143	0.504284
+H	17.9015	8.57143	1.00857
+H	17.9015	8.57143	0
+O	17.1429	8.57143	3.36143
+H	17.9015	8.57143	3.86571
+H	17.9015	8.57143	2.85714
+O	17.1429	8.57143	6.21857
+H	17.9015	8.57143	6.72285
+H	17.9015	8.57143	5.71429
+O	17.1429	8.57143	9.07571
+H	17.9015	8.57143	9.58
+H	17.9015	8.57143	8.57143
+O	17.1429	8.57143	11.9329
+H	17.9015	8.57143	12.4371
+H	17.9015	8.57143	11.4286
+O	17.1429	8.57143	14.79
+H	17.9015	8.57143	15.2943
+H	17.9015	8.57143	14.2857
+O	17.1429	8.57143	17.6471
+H	17.9015	8.57143	18.1514
+H	17.9015	8.57143	17.1429
+O	17.1429	11.4286	0.504284
+H	17.9015	11.4286	1.00857
+H	17.9015	11.4286	0
+O	17.1429	11.4286	3.36143
+H	17.9015	11.4286	3.86571
+H	17.9015	11.4286	2.85714
+O	17.1429	11.4286	6.21857
+H	17.9015	11.4286	6.72285
+H	17.9015	11.4286	5.71429
+O	17.1429	11.4286	9.07571
+H	17.9015	11.4286	9.58
+H	17.9015	11.4286	8.57143
+O	17.1429	11.4286	11.9329
+H	17.9015	11.4286	12.4371
+H	17.9015	11.4286	11.4286
+O	17.1429	11.4286	14.79
+H	17.9015	11.4286	15.2943
+H	17.9015	11.4286	14.2857
+O	17.1429	11.4286	17.6471
+H	17.9015	11.4286	18.1514
+H	17.9015	11.4286	17.1429
+O	17.1429	14.2857	0.504284
+H	17.9015	14.2857	1.00857
+H	17.9015	14.2857	0
+O	17.1429	14.2857	3.36143
+H	17.9015	14.2857	3.86571
+H	17.9015	14.2857	2.85714
+O	17.1429	14.2857	6.21857
+H	17.9015	14.2857	6.72285
+H	17.9015	14.2857	5.71429
+O	17.1429	14.2857	9.07571
+H	17.9015	14.2857	9.58
+H	17.9015	14.2857	8.57143
+O	17.1429	14.2857	11.9329
+H	17.9015	14.2857	12.4371
+H	17.9015	14.2857	11.4286
+O	17.1429	14.2857	14.79
+H	17.9015	14.2857	15.2943
+H	17.9015	14.2857	14.2857
+O	17.1429	14.2857	17.6471
+H	17.9015	14.2857	18.1514
+H	17.9015	14.2857	17.1429
+O	17.1429	17.1429	0.504284
+H	17.9015	17.1429	1.00857
+H	17.9015	17.1429	0
+O	17.1429	17.1429	3.36143
+H	17.9015	17.1429	3.86571
+H	17.9015	17.1429	2.85714
+O	17.1429	17.1429	6.21857
+H	17.9015	17.1429	6.72285
+H	17.9015	17.1429	5.71429
+O	17.1429	17.1429	9.07571
+H	17.9015	17.1429	9.58
+H	17.9015	17.1429	8.57143
+O	17.1429	17.1429	11.9329
+H	17.9015	17.1429	12.4371
+H	17.9015	17.1429	11.4286
+O	17.1429	17.1429	14.79
+H	17.9015	17.1429	15.2943
+H	17.9015	17.1429	14.2857
+O	17.1429	17.1429	17.6471
+H	17.9015	17.1429	18.1514
+H	17.9015	17.1429	17.1429
Index: tests/regression/Selection/Molecules/PopMoleculeSelection/post/empty.xyz
===================================================================
--- tests/regression/Selection/Molecules/PopMoleculeSelection/post/empty.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PopMoleculeSelection/post/empty.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,2 @@
+0
+	Created by molecuilder for select-molecule-by-id test
Index: tests/regression/Selection/Molecules/PopMoleculeSelection/post/id2_4_missing.xyz
===================================================================
--- tests/regression/Selection/Molecules/PopMoleculeSelection/post/id2_4_missing.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PopMoleculeSelection/post/id2_4_missing.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,1025 @@
+1023
+	Created by molecuilder for select-molecule-by-id test
+O	0	0	0.504284
+H	0.758602	0	1.00857
+H	0.758602	0	0
+O	0	0	3.36143
+H	0.758602	0	3.86571
+H	0.758602	0	2.85714
+O	0	0	9.07571
+H	0.758602	0	9.58
+H	0.758602	0	8.57143
+O	0	0	14.79
+H	0.758602	0	15.2943
+H	0.758602	0	14.2857
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+H	17.9015	2.85714	9.58
+H	17.9015	2.85714	8.57143
+O	17.1429	2.85714	11.9329
+H	17.9015	2.85714	12.4371
+H	17.9015	2.85714	11.4286
+O	17.1429	2.85714	14.79
+H	17.9015	2.85714	15.2943
+H	17.9015	2.85714	14.2857
+O	17.1429	2.85714	17.6471
+H	17.9015	2.85714	18.1514
+H	17.9015	2.85714	17.1429
+O	17.1429	5.71429	0.504284
+H	17.9015	5.71429	1.00857
+H	17.9015	5.71429	0
+O	17.1429	5.71429	3.36143
+H	17.9015	5.71429	3.86571
+H	17.9015	5.71429	2.85714
+O	17.1429	5.71429	6.21857
+H	17.9015	5.71429	6.72285
+H	17.9015	5.71429	5.71429
+O	17.1429	5.71429	9.07571
+H	17.9015	5.71429	9.58
+H	17.9015	5.71429	8.57143
+O	17.1429	5.71429	11.9329
+H	17.9015	5.71429	12.4371
+H	17.9015	5.71429	11.4286
+O	17.1429	5.71429	14.79
+H	17.9015	5.71429	15.2943
+H	17.9015	5.71429	14.2857
+O	17.1429	5.71429	17.6471
+H	17.9015	5.71429	18.1514
+H	17.9015	5.71429	17.1429
+O	17.1429	8.57143	0.504284
+H	17.9015	8.57143	1.00857
+H	17.9015	8.57143	0
+O	17.1429	8.57143	3.36143
+H	17.9015	8.57143	3.86571
+H	17.9015	8.57143	2.85714
+O	17.1429	8.57143	6.21857
+H	17.9015	8.57143	6.72285
+H	17.9015	8.57143	5.71429
+O	17.1429	8.57143	9.07571
+H	17.9015	8.57143	9.58
+H	17.9015	8.57143	8.57143
+O	17.1429	8.57143	11.9329
+H	17.9015	8.57143	12.4371
+H	17.9015	8.57143	11.4286
+O	17.1429	8.57143	14.79
+H	17.9015	8.57143	15.2943
+H	17.9015	8.57143	14.2857
+O	17.1429	8.57143	17.6471
+H	17.9015	8.57143	18.1514
+H	17.9015	8.57143	17.1429
+O	17.1429	11.4286	0.504284
+H	17.9015	11.4286	1.00857
+H	17.9015	11.4286	0
+O	17.1429	11.4286	3.36143
+H	17.9015	11.4286	3.86571
+H	17.9015	11.4286	2.85714
+O	17.1429	11.4286	6.21857
+H	17.9015	11.4286	6.72285
+H	17.9015	11.4286	5.71429
+O	17.1429	11.4286	9.07571
+H	17.9015	11.4286	9.58
+H	17.9015	11.4286	8.57143
+O	17.1429	11.4286	11.9329
+H	17.9015	11.4286	12.4371
+H	17.9015	11.4286	11.4286
+O	17.1429	11.4286	14.79
+H	17.9015	11.4286	15.2943
+H	17.9015	11.4286	14.2857
+O	17.1429	11.4286	17.6471
+H	17.9015	11.4286	18.1514
+H	17.9015	11.4286	17.1429
+O	17.1429	14.2857	0.504284
+H	17.9015	14.2857	1.00857
+H	17.9015	14.2857	0
+O	17.1429	14.2857	3.36143
+H	17.9015	14.2857	3.86571
+H	17.9015	14.2857	2.85714
+O	17.1429	14.2857	6.21857
+H	17.9015	14.2857	6.72285
+H	17.9015	14.2857	5.71429
+O	17.1429	14.2857	9.07571
+H	17.9015	14.2857	9.58
+H	17.9015	14.2857	8.57143
+O	17.1429	14.2857	11.9329
+H	17.9015	14.2857	12.4371
+H	17.9015	14.2857	11.4286
+O	17.1429	14.2857	14.79
+H	17.9015	14.2857	15.2943
+H	17.9015	14.2857	14.2857
+O	17.1429	14.2857	17.6471
+H	17.9015	14.2857	18.1514
+H	17.9015	14.2857	17.1429
+O	17.1429	17.1429	0.504284
+H	17.9015	17.1429	1.00857
+H	17.9015	17.1429	0
+O	17.1429	17.1429	3.36143
+H	17.9015	17.1429	3.86571
+H	17.9015	17.1429	2.85714
+O	17.1429	17.1429	6.21857
+H	17.9015	17.1429	6.72285
+H	17.9015	17.1429	5.71429
+O	17.1429	17.1429	9.07571
+H	17.9015	17.1429	9.58
+H	17.9015	17.1429	8.57143
+O	17.1429	17.1429	11.9329
+H	17.9015	17.1429	12.4371
+H	17.9015	17.1429	11.4286
+O	17.1429	17.1429	14.79
+H	17.9015	17.1429	15.2943
+H	17.9015	17.1429	14.2857
+O	17.1429	17.1429	17.6471
+H	17.9015	17.1429	18.1514
+H	17.9015	17.1429	17.1429
Index: tests/regression/Selection/Molecules/PopMoleculeSelection/post/water_id2_4.xyz
===================================================================
--- tests/regression/Selection/Molecules/PopMoleculeSelection/post/water_id2_4.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PopMoleculeSelection/post/water_id2_4.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,8 @@
+6
+	Created by molecuilder for select-molecule-by-id test
+O	0	0	6.21857
+H	0.758602	0	6.72285
+H	0.758602	0	5.71429
+O	0	0	11.9329
+H	0.758602	0	12.4371
+H	0.758602	0	11.4286
Index: tests/regression/Selection/Molecules/PopMoleculeSelection/pre/box.xyz
===================================================================
--- tests/regression/Selection/Molecules/PopMoleculeSelection/pre/box.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PopMoleculeSelection/pre/box.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,1031 @@
+1029
+	Created by molecuilder for select-molecule-by-id test
+O	0	0	0.504284
+H	0.758602	0	1.00857
+H	0.758602	0	0
+O	0	0	3.36143
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+H	0.758602	0	2.85714
+O	0	0	6.21857
+H	0.758602	0	6.72285
+H	0.758602	0	5.71429
+O	0	0	9.07571
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+H	0.758602	0	8.57143
+O	0	0	11.9329
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+H	0.758602	0	11.4286
+O	0	0	14.79
+H	0.758602	0	15.2943
+H	0.758602	0	14.2857
+O	0	0	17.6471
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+H	0.758602	2.85714	1.00857
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+H	0.758602	2.85714	3.86571
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+O	0	2.85714	6.21857
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+H	0.758602	2.85714	5.71429
+O	0	2.85714	9.07571
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+O	0	2.85714	14.79
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+O	0	5.71429	0.504284
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+H	15.0443	0	18.1514
+H	15.0443	0	17.1429
+O	14.2857	2.85714	0.504284
+H	15.0443	2.85714	1.00857
+H	15.0443	2.85714	0
+O	14.2857	2.85714	3.36143
+H	15.0443	2.85714	3.86571
+H	15.0443	2.85714	2.85714
+O	14.2857	2.85714	6.21857
+H	15.0443	2.85714	6.72285
+H	15.0443	2.85714	5.71429
+O	14.2857	2.85714	9.07571
+H	15.0443	2.85714	9.58
+H	15.0443	2.85714	8.57143
+O	14.2857	2.85714	11.9329
+H	15.0443	2.85714	12.4371
+H	15.0443	2.85714	11.4286
+O	14.2857	2.85714	14.79
+H	15.0443	2.85714	15.2943
+H	15.0443	2.85714	14.2857
+O	14.2857	2.85714	17.6471
+H	15.0443	2.85714	18.1514
+H	15.0443	2.85714	17.1429
+O	14.2857	5.71429	0.504284
+H	15.0443	5.71429	1.00857
+H	15.0443	5.71429	0
+O	14.2857	5.71429	3.36143
+H	15.0443	5.71429	3.86571
+H	15.0443	5.71429	2.85714
+O	14.2857	5.71429	6.21857
+H	15.0443	5.71429	6.72285
+H	15.0443	5.71429	5.71429
+O	14.2857	5.71429	9.07571
+H	15.0443	5.71429	9.58
+H	15.0443	5.71429	8.57143
+O	14.2857	5.71429	11.9329
+H	15.0443	5.71429	12.4371
+H	15.0443	5.71429	11.4286
+O	14.2857	5.71429	14.79
+H	15.0443	5.71429	15.2943
+H	15.0443	5.71429	14.2857
+O	14.2857	5.71429	17.6471
+H	15.0443	5.71429	18.1514
+H	15.0443	5.71429	17.1429
+O	14.2857	8.57143	0.504284
+H	15.0443	8.57143	1.00857
+H	15.0443	8.57143	0
+O	14.2857	8.57143	3.36143
+H	15.0443	8.57143	3.86571
+H	15.0443	8.57143	2.85714
+O	14.2857	8.57143	6.21857
+H	15.0443	8.57143	6.72285
+H	15.0443	8.57143	5.71429
+O	14.2857	8.57143	9.07571
+H	15.0443	8.57143	9.58
+H	15.0443	8.57143	8.57143
+O	14.2857	8.57143	11.9329
+H	15.0443	8.57143	12.4371
+H	15.0443	8.57143	11.4286
+O	14.2857	8.57143	14.79
+H	15.0443	8.57143	15.2943
+H	15.0443	8.57143	14.2857
+O	14.2857	8.57143	17.6471
+H	15.0443	8.57143	18.1514
+H	15.0443	8.57143	17.1429
+O	14.2857	11.4286	0.504284
+H	15.0443	11.4286	1.00857
+H	15.0443	11.4286	0
+O	14.2857	11.4286	3.36143
+H	15.0443	11.4286	3.86571
+H	15.0443	11.4286	2.85714
+O	14.2857	11.4286	6.21857
+H	15.0443	11.4286	6.72285
+H	15.0443	11.4286	5.71429
+O	14.2857	11.4286	9.07571
+H	15.0443	11.4286	9.58
+H	15.0443	11.4286	8.57143
+O	14.2857	11.4286	11.9329
+H	15.0443	11.4286	12.4371
+H	15.0443	11.4286	11.4286
+O	14.2857	11.4286	14.79
+H	15.0443	11.4286	15.2943
+H	15.0443	11.4286	14.2857
+O	14.2857	11.4286	17.6471
+H	15.0443	11.4286	18.1514
+H	15.0443	11.4286	17.1429
+O	14.2857	14.2857	0.504284
+H	15.0443	14.2857	1.00857
+H	15.0443	14.2857	0
+O	14.2857	14.2857	3.36143
+H	15.0443	14.2857	3.86571
+H	15.0443	14.2857	2.85714
+O	14.2857	14.2857	6.21857
+H	15.0443	14.2857	6.72285
+H	15.0443	14.2857	5.71429
+O	14.2857	14.2857	9.07571
+H	15.0443	14.2857	9.58
+H	15.0443	14.2857	8.57143
+O	14.2857	14.2857	11.9329
+H	15.0443	14.2857	12.4371
+H	15.0443	14.2857	11.4286
+O	14.2857	14.2857	14.79
+H	15.0443	14.2857	15.2943
+H	15.0443	14.2857	14.2857
+O	14.2857	14.2857	17.6471
+H	15.0443	14.2857	18.1514
+H	15.0443	14.2857	17.1429
+O	14.2857	17.1429	0.504284
+H	15.0443	17.1429	1.00857
+H	15.0443	17.1429	0
+O	14.2857	17.1429	3.36143
+H	15.0443	17.1429	3.86571
+H	15.0443	17.1429	2.85714
+O	14.2857	17.1429	6.21857
+H	15.0443	17.1429	6.72285
+H	15.0443	17.1429	5.71429
+O	14.2857	17.1429	9.07571
+H	15.0443	17.1429	9.58
+H	15.0443	17.1429	8.57143
+O	14.2857	17.1429	11.9329
+H	15.0443	17.1429	12.4371
+H	15.0443	17.1429	11.4286
+O	14.2857	17.1429	14.79
+H	15.0443	17.1429	15.2943
+H	15.0443	17.1429	14.2857
+O	14.2857	17.1429	17.6471
+H	15.0443	17.1429	18.1514
+H	15.0443	17.1429	17.1429
+O	17.1429	0	0.504284
+H	17.9015	0	1.00857
+H	17.9015	0	0
+O	17.1429	0	3.36143
+H	17.9015	0	3.86571
+H	17.9015	0	2.85714
+O	17.1429	0	6.21857
+H	17.9015	0	6.72285
+H	17.9015	0	5.71429
+O	17.1429	0	9.07571
+H	17.9015	0	9.58
+H	17.9015	0	8.57143
+O	17.1429	0	11.9329
+H	17.9015	0	12.4371
+H	17.9015	0	11.4286
+O	17.1429	0	14.79
+H	17.9015	0	15.2943
+H	17.9015	0	14.2857
+O	17.1429	0	17.6471
+H	17.9015	0	18.1514
+H	17.9015	0	17.1429
+O	17.1429	2.85714	0.504284
+H	17.9015	2.85714	1.00857
+H	17.9015	2.85714	0
+O	17.1429	2.85714	3.36143
+H	17.9015	2.85714	3.86571
+H	17.9015	2.85714	2.85714
+O	17.1429	2.85714	6.21857
+H	17.9015	2.85714	6.72285
+H	17.9015	2.85714	5.71429
+O	17.1429	2.85714	9.07571
+H	17.9015	2.85714	9.58
+H	17.9015	2.85714	8.57143
+O	17.1429	2.85714	11.9329
+H	17.9015	2.85714	12.4371
+H	17.9015	2.85714	11.4286
+O	17.1429	2.85714	14.79
+H	17.9015	2.85714	15.2943
+H	17.9015	2.85714	14.2857
+O	17.1429	2.85714	17.6471
+H	17.9015	2.85714	18.1514
+H	17.9015	2.85714	17.1429
+O	17.1429	5.71429	0.504284
+H	17.9015	5.71429	1.00857
+H	17.9015	5.71429	0
+O	17.1429	5.71429	3.36143
+H	17.9015	5.71429	3.86571
+H	17.9015	5.71429	2.85714
+O	17.1429	5.71429	6.21857
+H	17.9015	5.71429	6.72285
+H	17.9015	5.71429	5.71429
+O	17.1429	5.71429	9.07571
+H	17.9015	5.71429	9.58
+H	17.9015	5.71429	8.57143
+O	17.1429	5.71429	11.9329
+H	17.9015	5.71429	12.4371
+H	17.9015	5.71429	11.4286
+O	17.1429	5.71429	14.79
+H	17.9015	5.71429	15.2943
+H	17.9015	5.71429	14.2857
+O	17.1429	5.71429	17.6471
+H	17.9015	5.71429	18.1514
+H	17.9015	5.71429	17.1429
+O	17.1429	8.57143	0.504284
+H	17.9015	8.57143	1.00857
+H	17.9015	8.57143	0
+O	17.1429	8.57143	3.36143
+H	17.9015	8.57143	3.86571
+H	17.9015	8.57143	2.85714
+O	17.1429	8.57143	6.21857
+H	17.9015	8.57143	6.72285
+H	17.9015	8.57143	5.71429
+O	17.1429	8.57143	9.07571
+H	17.9015	8.57143	9.58
+H	17.9015	8.57143	8.57143
+O	17.1429	8.57143	11.9329
+H	17.9015	8.57143	12.4371
+H	17.9015	8.57143	11.4286
+O	17.1429	8.57143	14.79
+H	17.9015	8.57143	15.2943
+H	17.9015	8.57143	14.2857
+O	17.1429	8.57143	17.6471
+H	17.9015	8.57143	18.1514
+H	17.9015	8.57143	17.1429
+O	17.1429	11.4286	0.504284
+H	17.9015	11.4286	1.00857
+H	17.9015	11.4286	0
+O	17.1429	11.4286	3.36143
+H	17.9015	11.4286	3.86571
+H	17.9015	11.4286	2.85714
+O	17.1429	11.4286	6.21857
+H	17.9015	11.4286	6.72285
+H	17.9015	11.4286	5.71429
+O	17.1429	11.4286	9.07571
+H	17.9015	11.4286	9.58
+H	17.9015	11.4286	8.57143
+O	17.1429	11.4286	11.9329
+H	17.9015	11.4286	12.4371
+H	17.9015	11.4286	11.4286
+O	17.1429	11.4286	14.79
+H	17.9015	11.4286	15.2943
+H	17.9015	11.4286	14.2857
+O	17.1429	11.4286	17.6471
+H	17.9015	11.4286	18.1514
+H	17.9015	11.4286	17.1429
+O	17.1429	14.2857	0.504284
+H	17.9015	14.2857	1.00857
+H	17.9015	14.2857	0
+O	17.1429	14.2857	3.36143
+H	17.9015	14.2857	3.86571
+H	17.9015	14.2857	2.85714
+O	17.1429	14.2857	6.21857
+H	17.9015	14.2857	6.72285
+H	17.9015	14.2857	5.71429
+O	17.1429	14.2857	9.07571
+H	17.9015	14.2857	9.58
+H	17.9015	14.2857	8.57143
+O	17.1429	14.2857	11.9329
+H	17.9015	14.2857	12.4371
+H	17.9015	14.2857	11.4286
+O	17.1429	14.2857	14.79
+H	17.9015	14.2857	15.2943
+H	17.9015	14.2857	14.2857
+O	17.1429	14.2857	17.6471
+H	17.9015	14.2857	18.1514
+H	17.9015	14.2857	17.1429
+O	17.1429	17.1429	0.504284
+H	17.9015	17.1429	1.00857
+H	17.9015	17.1429	0
+O	17.1429	17.1429	3.36143
+H	17.9015	17.1429	3.86571
+H	17.9015	17.1429	2.85714
+O	17.1429	17.1429	6.21857
+H	17.9015	17.1429	6.72285
+H	17.9015	17.1429	5.71429
+O	17.1429	17.1429	9.07571
+H	17.9015	17.1429	9.58
+H	17.9015	17.1429	8.57143
+O	17.1429	17.1429	11.9329
+H	17.9015	17.1429	12.4371
+H	17.9015	17.1429	11.4286
+O	17.1429	17.1429	14.79
+H	17.9015	17.1429	15.2943
+H	17.9015	17.1429	14.2857
+O	17.1429	17.1429	17.6471
+H	17.9015	17.1429	18.1514
+H	17.9015	17.1429	17.1429
Index: tests/regression/Selection/Molecules/PopMoleculeSelection/testsuite-selection-pop-molecule-selection.at
===================================================================
--- tests/regression/Selection/Molecules/PopMoleculeSelection/testsuite-selection-pop-molecule-selection.at	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PopMoleculeSelection/testsuite-selection-pop-molecule-selection.at	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,61 @@
+#
+#    MoleCuilder - creates and alters molecular systems
+#    Copyright (C) 2014 Frederik Heber
+#
+#    This program is free software: you can redistribute it and/or modify
+#    it under the terms of the GNU General Public License as published by
+#    the Free Software Foundation, either version 3 of the License, or
+#    (at your option) any later version.
+#
+#    This program is distributed in the hope that it will be useful,
+#    but WITHOUT ANY WARRANTY; without even the implied warranty of
+#    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
+#    GNU General Public License for more details.
+#
+#    You should have received a copy of the GNU General Public License
+#    along with this program.  If not, see <http://www.gnu.org/licenses/>.
+#
+### 10. pop molecule selection
+
+
+AT_SETUP([Selection - Pop molecule selection])
+AT_KEYWORDS([selection molecule select-molecule-by-id push-molecule-selection pop-molecule-selection unselect-all-molecules])
+
+regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/PopMoleculeSelection"
+srcfile=box.xyz
+testfile=test.xyz
+targetfile=water_id2_4.xyz
+AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
+AT_CHECK([../../molecuilder -i $testfile -I --select-molecule-by-id 2 4 --push-molecule-selection --unselect-all-molecules --pop-molecule-selection -s $targetfile], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+
+AT_SETUP([Selection - Pop molecule selection with Undo])
+AT_KEYWORDS([selection molecule select-molecule-by-id push-molecule-selection pop-molecule-selection unselect-all-molecules undo])
+
+regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/PopMoleculeSelection"
+srcfile=box.xyz
+testfile=test.xyz
+targetfile=empty.xyz
+AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
+AT_CHECK([../../molecuilder -i $testfile -I --select-molecule-by-id 2 4 --push-molecule-selection --unselect-all-molecules --pop-molecule-selection --undo -s $targetfile], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+
+AT_SETUP([Selection - Pop molecule selection with Redo])
+AT_KEYWORDS([selection molecule select-molecule-by-id push-molecule-selection pop-molecule-selection unselect-all-molecules redo])
+
+regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/PopMoleculeSelection"
+srcfile=box.xyz
+testfile=test.xyz
+targetfile=water_id2_4.xyz
+AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
+AT_CHECK([../../molecuilder -i $testfile -I --select-molecule-by-id 2 4 --push-molecule-selection --unselect-all-molecules --pop-molecule-selection --undo --redo -s $targetfile], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
Index: tests/regression/Selection/Molecules/PushMoleculeSelection/post/box.xyz
===================================================================
--- tests/regression/Selection/Molecules/PushMoleculeSelection/post/box.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PushMoleculeSelection/post/box.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,1031 @@
+1029
+	Created by molecuilder for select-molecule-by-id test
+O	0	0	0.504284
+H	0.758602	0	1.00857
+H	0.758602	0	0
+O	0	0	3.36143
+H	0.758602	0	3.86571
+H	0.758602	0	2.85714
+O	0	0	6.21857
+H	0.758602	0	6.72285
+H	0.758602	0	5.71429
+O	0	0	9.07571
+H	0.758602	0	9.58
+H	0.758602	0	8.57143
+O	0	0	11.9329
+H	0.758602	0	12.4371
+H	0.758602	0	11.4286
+O	0	0	14.79
+H	0.758602	0	15.2943
+H	0.758602	0	14.2857
+O	0	0	17.6471
+H	0.758602	0	18.1514
+H	0.758602	0	17.1429
+O	0	2.85714	0.504284
+H	0.758602	2.85714	1.00857
+H	0.758602	2.85714	0
+O	0	2.85714	3.36143
+H	0.758602	2.85714	3.86571
+H	0.758602	2.85714	2.85714
+O	0	2.85714	6.21857
+H	0.758602	2.85714	6.72285
+H	0.758602	2.85714	5.71429
+O	0	2.85714	9.07571
+H	0.758602	2.85714	9.58
+H	0.758602	2.85714	8.57143
+O	0	2.85714	11.9329
+H	0.758602	2.85714	12.4371
+H	0.758602	2.85714	11.4286
+O	0	2.85714	14.79
+H	0.758602	2.85714	15.2943
+H	0.758602	2.85714	14.2857
+O	0	2.85714	17.6471
+H	0.758602	2.85714	18.1514
+H	0.758602	2.85714	17.1429
+O	0	5.71429	0.504284
+H	0.758602	5.71429	1.00857
+H	0.758602	5.71429	0
+O	0	5.71429	3.36143
+H	0.758602	5.71429	3.86571
+H	0.758602	5.71429	2.85714
+O	0	5.71429	6.21857
+H	0.758602	5.71429	6.72285
+H	0.758602	5.71429	5.71429
+O	0	5.71429	9.07571
+H	0.758602	5.71429	9.58
+H	0.758602	5.71429	8.57143
+O	0	5.71429	11.9329
+H	0.758602	5.71429	12.4371
+H	0.758602	5.71429	11.4286
+O	0	5.71429	14.79
+H	0.758602	5.71429	15.2943
+H	0.758602	5.71429	14.2857
+O	0	5.71429	17.6471
+H	0.758602	5.71429	18.1514
+H	0.758602	5.71429	17.1429
+O	0	8.57143	0.504284
+H	0.758602	8.57143	1.00857
+H	0.758602	8.57143	0
+O	0	8.57143	3.36143
+H	0.758602	8.57143	3.86571
+H	0.758602	8.57143	2.85714
+O	0	8.57143	6.21857
+H	0.758602	8.57143	6.72285
+H	0.758602	8.57143	5.71429
+O	0	8.57143	9.07571
+H	0.758602	8.57143	9.58
+H	0.758602	8.57143	8.57143
+O	0	8.57143	11.9329
+H	0.758602	8.57143	12.4371
+H	0.758602	8.57143	11.4286
+O	0	8.57143	14.79
+H	0.758602	8.57143	15.2943
+H	0.758602	8.57143	14.2857
+O	0	8.57143	17.6471
+H	0.758602	8.57143	18.1514
+H	0.758602	8.57143	17.1429
+O	0	11.4286	0.504284
+H	0.758602	11.4286	1.00857
+H	0.758602	11.4286	0
+O	0	11.4286	3.36143
+H	0.758602	11.4286	3.86571
+H	0.758602	11.4286	2.85714
+O	0	11.4286	6.21857
+H	0.758602	11.4286	6.72285
+H	0.758602	11.4286	5.71429
+O	0	11.4286	9.07571
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+H	17.9015	11.4286	18.1514
+H	17.9015	11.4286	17.1429
+O	17.1429	14.2857	0.504284
+H	17.9015	14.2857	1.00857
+H	17.9015	14.2857	0
+O	17.1429	14.2857	3.36143
+H	17.9015	14.2857	3.86571
+H	17.9015	14.2857	2.85714
+O	17.1429	14.2857	6.21857
+H	17.9015	14.2857	6.72285
+H	17.9015	14.2857	5.71429
+O	17.1429	14.2857	9.07571
+H	17.9015	14.2857	9.58
+H	17.9015	14.2857	8.57143
+O	17.1429	14.2857	11.9329
+H	17.9015	14.2857	12.4371
+H	17.9015	14.2857	11.4286
+O	17.1429	14.2857	14.79
+H	17.9015	14.2857	15.2943
+H	17.9015	14.2857	14.2857
+O	17.1429	14.2857	17.6471
+H	17.9015	14.2857	18.1514
+H	17.9015	14.2857	17.1429
+O	17.1429	17.1429	0.504284
+H	17.9015	17.1429	1.00857
+H	17.9015	17.1429	0
+O	17.1429	17.1429	3.36143
+H	17.9015	17.1429	3.86571
+H	17.9015	17.1429	2.85714
+O	17.1429	17.1429	6.21857
+H	17.9015	17.1429	6.72285
+H	17.9015	17.1429	5.71429
+O	17.1429	17.1429	9.07571
+H	17.9015	17.1429	9.58
+H	17.9015	17.1429	8.57143
+O	17.1429	17.1429	11.9329
+H	17.9015	17.1429	12.4371
+H	17.9015	17.1429	11.4286
+O	17.1429	17.1429	14.79
+H	17.9015	17.1429	15.2943
+H	17.9015	17.1429	14.2857
+O	17.1429	17.1429	17.6471
+H	17.9015	17.1429	18.1514
+H	17.9015	17.1429	17.1429
Index: tests/regression/Selection/Molecules/PushMoleculeSelection/post/empty.xyz
===================================================================
--- tests/regression/Selection/Molecules/PushMoleculeSelection/post/empty.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PushMoleculeSelection/post/empty.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,2 @@
+0
+	Created by molecuilder for select-molecule-by-id test
Index: tests/regression/Selection/Molecules/PushMoleculeSelection/post/id2_4_missing.xyz
===================================================================
--- tests/regression/Selection/Molecules/PushMoleculeSelection/post/id2_4_missing.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PushMoleculeSelection/post/id2_4_missing.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,1025 @@
+1023
+	Created by molecuilder for select-molecule-by-id test
+O	0	0	0.504284
+H	0.758602	0	1.00857
+H	0.758602	0	0
+O	0	0	3.36143
+H	0.758602	0	3.86571
+H	0.758602	0	2.85714
+O	0	0	9.07571
+H	0.758602	0	9.58
+H	0.758602	0	8.57143
+O	0	0	14.79
+H	0.758602	0	15.2943
+H	0.758602	0	14.2857
+O	0	0	17.6471
+H	0.758602	0	18.1514
+H	0.758602	0	17.1429
+O	0	2.85714	0.504284
+H	0.758602	2.85714	1.00857
+H	0.758602	2.85714	0
+O	0	2.85714	3.36143
+H	0.758602	2.85714	3.86571
+H	0.758602	2.85714	2.85714
+O	0	2.85714	6.21857
+H	0.758602	2.85714	6.72285
+H	0.758602	2.85714	5.71429
+O	0	2.85714	9.07571
+H	0.758602	2.85714	9.58
+H	0.758602	2.85714	8.57143
+O	0	2.85714	11.9329
+H	0.758602	2.85714	12.4371
+H	0.758602	2.85714	11.4286
+O	0	2.85714	14.79
+H	0.758602	2.85714	15.2943
+H	0.758602	2.85714	14.2857
+O	0	2.85714	17.6471
+H	0.758602	2.85714	18.1514
+H	0.758602	2.85714	17.1429
+O	0	5.71429	0.504284
+H	0.758602	5.71429	1.00857
+H	0.758602	5.71429	0
+O	0	5.71429	3.36143
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+H	0.758602	5.71429	2.85714
+O	0	5.71429	6.21857
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+O	0	5.71429	9.07571
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+O	0	5.71429	14.79
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+H	0.758602	11.4286	14.2857
+O	0	11.4286	17.6471
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+H	15.0443	11.4286	15.2943
+H	15.0443	11.4286	14.2857
+O	14.2857	11.4286	17.6471
+H	15.0443	11.4286	18.1514
+H	15.0443	11.4286	17.1429
+O	14.2857	14.2857	0.504284
+H	15.0443	14.2857	1.00857
+H	15.0443	14.2857	0
+O	14.2857	14.2857	3.36143
+H	15.0443	14.2857	3.86571
+H	15.0443	14.2857	2.85714
+O	14.2857	14.2857	6.21857
+H	15.0443	14.2857	6.72285
+H	15.0443	14.2857	5.71429
+O	14.2857	14.2857	9.07571
+H	15.0443	14.2857	9.58
+H	15.0443	14.2857	8.57143
+O	14.2857	14.2857	11.9329
+H	15.0443	14.2857	12.4371
+H	15.0443	14.2857	11.4286
+O	14.2857	14.2857	14.79
+H	15.0443	14.2857	15.2943
+H	15.0443	14.2857	14.2857
+O	14.2857	14.2857	17.6471
+H	15.0443	14.2857	18.1514
+H	15.0443	14.2857	17.1429
+O	14.2857	17.1429	0.504284
+H	15.0443	17.1429	1.00857
+H	15.0443	17.1429	0
+O	14.2857	17.1429	3.36143
+H	15.0443	17.1429	3.86571
+H	15.0443	17.1429	2.85714
+O	14.2857	17.1429	6.21857
+H	15.0443	17.1429	6.72285
+H	15.0443	17.1429	5.71429
+O	14.2857	17.1429	9.07571
+H	15.0443	17.1429	9.58
+H	15.0443	17.1429	8.57143
+O	14.2857	17.1429	11.9329
+H	15.0443	17.1429	12.4371
+H	15.0443	17.1429	11.4286
+O	14.2857	17.1429	14.79
+H	15.0443	17.1429	15.2943
+H	15.0443	17.1429	14.2857
+O	14.2857	17.1429	17.6471
+H	15.0443	17.1429	18.1514
+H	15.0443	17.1429	17.1429
+O	17.1429	0	0.504284
+H	17.9015	0	1.00857
+H	17.9015	0	0
+O	17.1429	0	3.36143
+H	17.9015	0	3.86571
+H	17.9015	0	2.85714
+O	17.1429	0	6.21857
+H	17.9015	0	6.72285
+H	17.9015	0	5.71429
+O	17.1429	0	9.07571
+H	17.9015	0	9.58
+H	17.9015	0	8.57143
+O	17.1429	0	11.9329
+H	17.9015	0	12.4371
+H	17.9015	0	11.4286
+O	17.1429	0	14.79
+H	17.9015	0	15.2943
+H	17.9015	0	14.2857
+O	17.1429	0	17.6471
+H	17.9015	0	18.1514
+H	17.9015	0	17.1429
+O	17.1429	2.85714	0.504284
+H	17.9015	2.85714	1.00857
+H	17.9015	2.85714	0
+O	17.1429	2.85714	3.36143
+H	17.9015	2.85714	3.86571
+H	17.9015	2.85714	2.85714
+O	17.1429	2.85714	6.21857
+H	17.9015	2.85714	6.72285
+H	17.9015	2.85714	5.71429
+O	17.1429	2.85714	9.07571
+H	17.9015	2.85714	9.58
+H	17.9015	2.85714	8.57143
+O	17.1429	2.85714	11.9329
+H	17.9015	2.85714	12.4371
+H	17.9015	2.85714	11.4286
+O	17.1429	2.85714	14.79
+H	17.9015	2.85714	15.2943
+H	17.9015	2.85714	14.2857
+O	17.1429	2.85714	17.6471
+H	17.9015	2.85714	18.1514
+H	17.9015	2.85714	17.1429
+O	17.1429	5.71429	0.504284
+H	17.9015	5.71429	1.00857
+H	17.9015	5.71429	0
+O	17.1429	5.71429	3.36143
+H	17.9015	5.71429	3.86571
+H	17.9015	5.71429	2.85714
+O	17.1429	5.71429	6.21857
+H	17.9015	5.71429	6.72285
+H	17.9015	5.71429	5.71429
+O	17.1429	5.71429	9.07571
+H	17.9015	5.71429	9.58
+H	17.9015	5.71429	8.57143
+O	17.1429	5.71429	11.9329
+H	17.9015	5.71429	12.4371
+H	17.9015	5.71429	11.4286
+O	17.1429	5.71429	14.79
+H	17.9015	5.71429	15.2943
+H	17.9015	5.71429	14.2857
+O	17.1429	5.71429	17.6471
+H	17.9015	5.71429	18.1514
+H	17.9015	5.71429	17.1429
+O	17.1429	8.57143	0.504284
+H	17.9015	8.57143	1.00857
+H	17.9015	8.57143	0
+O	17.1429	8.57143	3.36143
+H	17.9015	8.57143	3.86571
+H	17.9015	8.57143	2.85714
+O	17.1429	8.57143	6.21857
+H	17.9015	8.57143	6.72285
+H	17.9015	8.57143	5.71429
+O	17.1429	8.57143	9.07571
+H	17.9015	8.57143	9.58
+H	17.9015	8.57143	8.57143
+O	17.1429	8.57143	11.9329
+H	17.9015	8.57143	12.4371
+H	17.9015	8.57143	11.4286
+O	17.1429	8.57143	14.79
+H	17.9015	8.57143	15.2943
+H	17.9015	8.57143	14.2857
+O	17.1429	8.57143	17.6471
+H	17.9015	8.57143	18.1514
+H	17.9015	8.57143	17.1429
+O	17.1429	11.4286	0.504284
+H	17.9015	11.4286	1.00857
+H	17.9015	11.4286	0
+O	17.1429	11.4286	3.36143
+H	17.9015	11.4286	3.86571
+H	17.9015	11.4286	2.85714
+O	17.1429	11.4286	6.21857
+H	17.9015	11.4286	6.72285
+H	17.9015	11.4286	5.71429
+O	17.1429	11.4286	9.07571
+H	17.9015	11.4286	9.58
+H	17.9015	11.4286	8.57143
+O	17.1429	11.4286	11.9329
+H	17.9015	11.4286	12.4371
+H	17.9015	11.4286	11.4286
+O	17.1429	11.4286	14.79
+H	17.9015	11.4286	15.2943
+H	17.9015	11.4286	14.2857
+O	17.1429	11.4286	17.6471
+H	17.9015	11.4286	18.1514
+H	17.9015	11.4286	17.1429
+O	17.1429	14.2857	0.504284
+H	17.9015	14.2857	1.00857
+H	17.9015	14.2857	0
+O	17.1429	14.2857	3.36143
+H	17.9015	14.2857	3.86571
+H	17.9015	14.2857	2.85714
+O	17.1429	14.2857	6.21857
+H	17.9015	14.2857	6.72285
+H	17.9015	14.2857	5.71429
+O	17.1429	14.2857	9.07571
+H	17.9015	14.2857	9.58
+H	17.9015	14.2857	8.57143
+O	17.1429	14.2857	11.9329
+H	17.9015	14.2857	12.4371
+H	17.9015	14.2857	11.4286
+O	17.1429	14.2857	14.79
+H	17.9015	14.2857	15.2943
+H	17.9015	14.2857	14.2857
+O	17.1429	14.2857	17.6471
+H	17.9015	14.2857	18.1514
+H	17.9015	14.2857	17.1429
+O	17.1429	17.1429	0.504284
+H	17.9015	17.1429	1.00857
+H	17.9015	17.1429	0
+O	17.1429	17.1429	3.36143
+H	17.9015	17.1429	3.86571
+H	17.9015	17.1429	2.85714
+O	17.1429	17.1429	6.21857
+H	17.9015	17.1429	6.72285
+H	17.9015	17.1429	5.71429
+O	17.1429	17.1429	9.07571
+H	17.9015	17.1429	9.58
+H	17.9015	17.1429	8.57143
+O	17.1429	17.1429	11.9329
+H	17.9015	17.1429	12.4371
+H	17.9015	17.1429	11.4286
+O	17.1429	17.1429	14.79
+H	17.9015	17.1429	15.2943
+H	17.9015	17.1429	14.2857
+O	17.1429	17.1429	17.6471
+H	17.9015	17.1429	18.1514
+H	17.9015	17.1429	17.1429
Index: tests/regression/Selection/Molecules/PushMoleculeSelection/post/water_id2_4.xyz
===================================================================
--- tests/regression/Selection/Molecules/PushMoleculeSelection/post/water_id2_4.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PushMoleculeSelection/post/water_id2_4.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,8 @@
+6
+	Created by molecuilder for select-molecule-by-id test
+O	0	0	6.21857
+H	0.758602	0	6.72285
+H	0.758602	0	5.71429
+O	0	0	11.9329
+H	0.758602	0	12.4371
+H	0.758602	0	11.4286
Index: tests/regression/Selection/Molecules/PushMoleculeSelection/pre/box.xyz
===================================================================
--- tests/regression/Selection/Molecules/PushMoleculeSelection/pre/box.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PushMoleculeSelection/pre/box.xyz	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,1031 @@
+1029
+	Created by molecuilder for select-molecule-by-id test
+O	0	0	0.504284
+H	0.758602	0	1.00857
+H	0.758602	0	0
+O	0	0	3.36143
+H	0.758602	0	3.86571
+H	0.758602	0	2.85714
+O	0	0	6.21857
+H	0.758602	0	6.72285
+H	0.758602	0	5.71429
+O	0	0	9.07571
+H	0.758602	0	9.58
+H	0.758602	0	8.57143
+O	0	0	11.9329
+H	0.758602	0	12.4371
+H	0.758602	0	11.4286
+O	0	0	14.79
+H	0.758602	0	15.2943
+H	0.758602	0	14.2857
+O	0	0	17.6471
+H	0.758602	0	18.1514
+H	0.758602	0	17.1429
+O	0	2.85714	0.504284
+H	0.758602	2.85714	1.00857
+H	0.758602	2.85714	0
+O	0	2.85714	3.36143
+H	0.758602	2.85714	3.86571
+H	0.758602	2.85714	2.85714
+O	0	2.85714	6.21857
+H	0.758602	2.85714	6.72285
+H	0.758602	2.85714	5.71429
+O	0	2.85714	9.07571
+H	0.758602	2.85714	9.58
+H	0.758602	2.85714	8.57143
+O	0	2.85714	11.9329
+H	0.758602	2.85714	12.4371
+H	0.758602	2.85714	11.4286
+O	0	2.85714	14.79
+H	0.758602	2.85714	15.2943
+H	0.758602	2.85714	14.2857
+O	0	2.85714	17.6471
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+H	0.758602	2.85714	17.1429
+O	0	5.71429	0.504284
+H	0.758602	5.71429	1.00857
+H	0.758602	5.71429	0
+O	0	5.71429	3.36143
+H	0.758602	5.71429	3.86571
+H	0.758602	5.71429	2.85714
+O	0	5.71429	6.21857
+H	0.758602	5.71429	6.72285
+H	0.758602	5.71429	5.71429
+O	0	5.71429	9.07571
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+O	0	5.71429	11.9329
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+O	0	5.71429	14.79
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+H	0.758602	5.71429	14.2857
+O	0	5.71429	17.6471
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+O	0	8.57143	14.79
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+O	0	11.4286	11.9329
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+H	0.758602	11.4286	11.4286
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+H	0.758602	14.2857	11.4286
+O	0	14.2857	14.79
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+O	0	14.2857	17.6471
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+O	0	17.1429	0.504284
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+H	0.758602	17.1429	8.57143
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+H	12.1872	11.4286	1.00857
+H	12.1872	11.4286	0
+O	11.4286	11.4286	3.36143
+H	12.1872	11.4286	3.86571
+H	12.1872	11.4286	2.85714
+O	11.4286	11.4286	6.21857
+H	12.1872	11.4286	6.72285
+H	12.1872	11.4286	5.71429
+O	11.4286	11.4286	9.07571
+H	12.1872	11.4286	9.58
+H	12.1872	11.4286	8.57143
+O	11.4286	11.4286	11.9329
+H	12.1872	11.4286	12.4371
+H	12.1872	11.4286	11.4286
+O	11.4286	11.4286	14.79
+H	12.1872	11.4286	15.2943
+H	12.1872	11.4286	14.2857
+O	11.4286	11.4286	17.6471
+H	12.1872	11.4286	18.1514
+H	12.1872	11.4286	17.1429
+O	11.4286	14.2857	0.504284
+H	12.1872	14.2857	1.00857
+H	12.1872	14.2857	0
+O	11.4286	14.2857	3.36143
+H	12.1872	14.2857	3.86571
+H	12.1872	14.2857	2.85714
+O	11.4286	14.2857	6.21857
+H	12.1872	14.2857	6.72285
+H	12.1872	14.2857	5.71429
+O	11.4286	14.2857	9.07571
+H	12.1872	14.2857	9.58
+H	12.1872	14.2857	8.57143
+O	11.4286	14.2857	11.9329
+H	12.1872	14.2857	12.4371
+H	12.1872	14.2857	11.4286
+O	11.4286	14.2857	14.79
+H	12.1872	14.2857	15.2943
+H	12.1872	14.2857	14.2857
+O	11.4286	14.2857	17.6471
+H	12.1872	14.2857	18.1514
+H	12.1872	14.2857	17.1429
+O	11.4286	17.1429	0.504284
+H	12.1872	17.1429	1.00857
+H	12.1872	17.1429	0
+O	11.4286	17.1429	3.36143
+H	12.1872	17.1429	3.86571
+H	12.1872	17.1429	2.85714
+O	11.4286	17.1429	6.21857
+H	12.1872	17.1429	6.72285
+H	12.1872	17.1429	5.71429
+O	11.4286	17.1429	9.07571
+H	12.1872	17.1429	9.58
+H	12.1872	17.1429	8.57143
+O	11.4286	17.1429	11.9329
+H	12.1872	17.1429	12.4371
+H	12.1872	17.1429	11.4286
+O	11.4286	17.1429	14.79
+H	12.1872	17.1429	15.2943
+H	12.1872	17.1429	14.2857
+O	11.4286	17.1429	17.6471
+H	12.1872	17.1429	18.1514
+H	12.1872	17.1429	17.1429
+O	14.2857	0	0.504284
+H	15.0443	0	1.00857
+H	15.0443	0	0
+O	14.2857	0	3.36143
+H	15.0443	0	3.86571
+H	15.0443	0	2.85714
+O	14.2857	0	6.21857
+H	15.0443	0	6.72285
+H	15.0443	0	5.71429
+O	14.2857	0	9.07571
+H	15.0443	0	9.58
+H	15.0443	0	8.57143
+O	14.2857	0	11.9329
+H	15.0443	0	12.4371
+H	15.0443	0	11.4286
+O	14.2857	0	14.79
+H	15.0443	0	15.2943
+H	15.0443	0	14.2857
+O	14.2857	0	17.6471
+H	15.0443	0	18.1514
+H	15.0443	0	17.1429
+O	14.2857	2.85714	0.504284
+H	15.0443	2.85714	1.00857
+H	15.0443	2.85714	0
+O	14.2857	2.85714	3.36143
+H	15.0443	2.85714	3.86571
+H	15.0443	2.85714	2.85714
+O	14.2857	2.85714	6.21857
+H	15.0443	2.85714	6.72285
+H	15.0443	2.85714	5.71429
+O	14.2857	2.85714	9.07571
+H	15.0443	2.85714	9.58
+H	15.0443	2.85714	8.57143
+O	14.2857	2.85714	11.9329
+H	15.0443	2.85714	12.4371
+H	15.0443	2.85714	11.4286
+O	14.2857	2.85714	14.79
+H	15.0443	2.85714	15.2943
+H	15.0443	2.85714	14.2857
+O	14.2857	2.85714	17.6471
+H	15.0443	2.85714	18.1514
+H	15.0443	2.85714	17.1429
+O	14.2857	5.71429	0.504284
+H	15.0443	5.71429	1.00857
+H	15.0443	5.71429	0
+O	14.2857	5.71429	3.36143
+H	15.0443	5.71429	3.86571
+H	15.0443	5.71429	2.85714
+O	14.2857	5.71429	6.21857
+H	15.0443	5.71429	6.72285
+H	15.0443	5.71429	5.71429
+O	14.2857	5.71429	9.07571
+H	15.0443	5.71429	9.58
+H	15.0443	5.71429	8.57143
+O	14.2857	5.71429	11.9329
+H	15.0443	5.71429	12.4371
+H	15.0443	5.71429	11.4286
+O	14.2857	5.71429	14.79
+H	15.0443	5.71429	15.2943
+H	15.0443	5.71429	14.2857
+O	14.2857	5.71429	17.6471
+H	15.0443	5.71429	18.1514
+H	15.0443	5.71429	17.1429
+O	14.2857	8.57143	0.504284
+H	15.0443	8.57143	1.00857
+H	15.0443	8.57143	0
+O	14.2857	8.57143	3.36143
+H	15.0443	8.57143	3.86571
+H	15.0443	8.57143	2.85714
+O	14.2857	8.57143	6.21857
+H	15.0443	8.57143	6.72285
+H	15.0443	8.57143	5.71429
+O	14.2857	8.57143	9.07571
+H	15.0443	8.57143	9.58
+H	15.0443	8.57143	8.57143
+O	14.2857	8.57143	11.9329
+H	15.0443	8.57143	12.4371
+H	15.0443	8.57143	11.4286
+O	14.2857	8.57143	14.79
+H	15.0443	8.57143	15.2943
+H	15.0443	8.57143	14.2857
+O	14.2857	8.57143	17.6471
+H	15.0443	8.57143	18.1514
+H	15.0443	8.57143	17.1429
+O	14.2857	11.4286	0.504284
+H	15.0443	11.4286	1.00857
+H	15.0443	11.4286	0
+O	14.2857	11.4286	3.36143
+H	15.0443	11.4286	3.86571
+H	15.0443	11.4286	2.85714
+O	14.2857	11.4286	6.21857
+H	15.0443	11.4286	6.72285
+H	15.0443	11.4286	5.71429
+O	14.2857	11.4286	9.07571
+H	15.0443	11.4286	9.58
+H	15.0443	11.4286	8.57143
+O	14.2857	11.4286	11.9329
+H	15.0443	11.4286	12.4371
+H	15.0443	11.4286	11.4286
+O	14.2857	11.4286	14.79
+H	15.0443	11.4286	15.2943
+H	15.0443	11.4286	14.2857
+O	14.2857	11.4286	17.6471
+H	15.0443	11.4286	18.1514
+H	15.0443	11.4286	17.1429
+O	14.2857	14.2857	0.504284
+H	15.0443	14.2857	1.00857
+H	15.0443	14.2857	0
+O	14.2857	14.2857	3.36143
+H	15.0443	14.2857	3.86571
+H	15.0443	14.2857	2.85714
+O	14.2857	14.2857	6.21857
+H	15.0443	14.2857	6.72285
+H	15.0443	14.2857	5.71429
+O	14.2857	14.2857	9.07571
+H	15.0443	14.2857	9.58
+H	15.0443	14.2857	8.57143
+O	14.2857	14.2857	11.9329
+H	15.0443	14.2857	12.4371
+H	15.0443	14.2857	11.4286
+O	14.2857	14.2857	14.79
+H	15.0443	14.2857	15.2943
+H	15.0443	14.2857	14.2857
+O	14.2857	14.2857	17.6471
+H	15.0443	14.2857	18.1514
+H	15.0443	14.2857	17.1429
+O	14.2857	17.1429	0.504284
+H	15.0443	17.1429	1.00857
+H	15.0443	17.1429	0
+O	14.2857	17.1429	3.36143
+H	15.0443	17.1429	3.86571
+H	15.0443	17.1429	2.85714
+O	14.2857	17.1429	6.21857
+H	15.0443	17.1429	6.72285
+H	15.0443	17.1429	5.71429
+O	14.2857	17.1429	9.07571
+H	15.0443	17.1429	9.58
+H	15.0443	17.1429	8.57143
+O	14.2857	17.1429	11.9329
+H	15.0443	17.1429	12.4371
+H	15.0443	17.1429	11.4286
+O	14.2857	17.1429	14.79
+H	15.0443	17.1429	15.2943
+H	15.0443	17.1429	14.2857
+O	14.2857	17.1429	17.6471
+H	15.0443	17.1429	18.1514
+H	15.0443	17.1429	17.1429
+O	17.1429	0	0.504284
+H	17.9015	0	1.00857
+H	17.9015	0	0
+O	17.1429	0	3.36143
+H	17.9015	0	3.86571
+H	17.9015	0	2.85714
+O	17.1429	0	6.21857
+H	17.9015	0	6.72285
+H	17.9015	0	5.71429
+O	17.1429	0	9.07571
+H	17.9015	0	9.58
+H	17.9015	0	8.57143
+O	17.1429	0	11.9329
+H	17.9015	0	12.4371
+H	17.9015	0	11.4286
+O	17.1429	0	14.79
+H	17.9015	0	15.2943
+H	17.9015	0	14.2857
+O	17.1429	0	17.6471
+H	17.9015	0	18.1514
+H	17.9015	0	17.1429
+O	17.1429	2.85714	0.504284
+H	17.9015	2.85714	1.00857
+H	17.9015	2.85714	0
+O	17.1429	2.85714	3.36143
+H	17.9015	2.85714	3.86571
+H	17.9015	2.85714	2.85714
+O	17.1429	2.85714	6.21857
+H	17.9015	2.85714	6.72285
+H	17.9015	2.85714	5.71429
+O	17.1429	2.85714	9.07571
+H	17.9015	2.85714	9.58
+H	17.9015	2.85714	8.57143
+O	17.1429	2.85714	11.9329
+H	17.9015	2.85714	12.4371
+H	17.9015	2.85714	11.4286
+O	17.1429	2.85714	14.79
+H	17.9015	2.85714	15.2943
+H	17.9015	2.85714	14.2857
+O	17.1429	2.85714	17.6471
+H	17.9015	2.85714	18.1514
+H	17.9015	2.85714	17.1429
+O	17.1429	5.71429	0.504284
+H	17.9015	5.71429	1.00857
+H	17.9015	5.71429	0
+O	17.1429	5.71429	3.36143
+H	17.9015	5.71429	3.86571
+H	17.9015	5.71429	2.85714
+O	17.1429	5.71429	6.21857
+H	17.9015	5.71429	6.72285
+H	17.9015	5.71429	5.71429
+O	17.1429	5.71429	9.07571
+H	17.9015	5.71429	9.58
+H	17.9015	5.71429	8.57143
+O	17.1429	5.71429	11.9329
+H	17.9015	5.71429	12.4371
+H	17.9015	5.71429	11.4286
+O	17.1429	5.71429	14.79
+H	17.9015	5.71429	15.2943
+H	17.9015	5.71429	14.2857
+O	17.1429	5.71429	17.6471
+H	17.9015	5.71429	18.1514
+H	17.9015	5.71429	17.1429
+O	17.1429	8.57143	0.504284
+H	17.9015	8.57143	1.00857
+H	17.9015	8.57143	0
+O	17.1429	8.57143	3.36143
+H	17.9015	8.57143	3.86571
+H	17.9015	8.57143	2.85714
+O	17.1429	8.57143	6.21857
+H	17.9015	8.57143	6.72285
+H	17.9015	8.57143	5.71429
+O	17.1429	8.57143	9.07571
+H	17.9015	8.57143	9.58
+H	17.9015	8.57143	8.57143
+O	17.1429	8.57143	11.9329
+H	17.9015	8.57143	12.4371
+H	17.9015	8.57143	11.4286
+O	17.1429	8.57143	14.79
+H	17.9015	8.57143	15.2943
+H	17.9015	8.57143	14.2857
+O	17.1429	8.57143	17.6471
+H	17.9015	8.57143	18.1514
+H	17.9015	8.57143	17.1429
+O	17.1429	11.4286	0.504284
+H	17.9015	11.4286	1.00857
+H	17.9015	11.4286	0
+O	17.1429	11.4286	3.36143
+H	17.9015	11.4286	3.86571
+H	17.9015	11.4286	2.85714
+O	17.1429	11.4286	6.21857
+H	17.9015	11.4286	6.72285
+H	17.9015	11.4286	5.71429
+O	17.1429	11.4286	9.07571
+H	17.9015	11.4286	9.58
+H	17.9015	11.4286	8.57143
+O	17.1429	11.4286	11.9329
+H	17.9015	11.4286	12.4371
+H	17.9015	11.4286	11.4286
+O	17.1429	11.4286	14.79
+H	17.9015	11.4286	15.2943
+H	17.9015	11.4286	14.2857
+O	17.1429	11.4286	17.6471
+H	17.9015	11.4286	18.1514
+H	17.9015	11.4286	17.1429
+O	17.1429	14.2857	0.504284
+H	17.9015	14.2857	1.00857
+H	17.9015	14.2857	0
+O	17.1429	14.2857	3.36143
+H	17.9015	14.2857	3.86571
+H	17.9015	14.2857	2.85714
+O	17.1429	14.2857	6.21857
+H	17.9015	14.2857	6.72285
+H	17.9015	14.2857	5.71429
+O	17.1429	14.2857	9.07571
+H	17.9015	14.2857	9.58
+H	17.9015	14.2857	8.57143
+O	17.1429	14.2857	11.9329
+H	17.9015	14.2857	12.4371
+H	17.9015	14.2857	11.4286
+O	17.1429	14.2857	14.79
+H	17.9015	14.2857	15.2943
+H	17.9015	14.2857	14.2857
+O	17.1429	14.2857	17.6471
+H	17.9015	14.2857	18.1514
+H	17.9015	14.2857	17.1429
+O	17.1429	17.1429	0.504284
+H	17.9015	17.1429	1.00857
+H	17.9015	17.1429	0
+O	17.1429	17.1429	3.36143
+H	17.9015	17.1429	3.86571
+H	17.9015	17.1429	2.85714
+O	17.1429	17.1429	6.21857
+H	17.9015	17.1429	6.72285
+H	17.9015	17.1429	5.71429
+O	17.1429	17.1429	9.07571
+H	17.9015	17.1429	9.58
+H	17.9015	17.1429	8.57143
+O	17.1429	17.1429	11.9329
+H	17.9015	17.1429	12.4371
+H	17.9015	17.1429	11.4286
+O	17.1429	17.1429	14.79
+H	17.9015	17.1429	15.2943
+H	17.9015	17.1429	14.2857
+O	17.1429	17.1429	17.6471
+H	17.9015	17.1429	18.1514
+H	17.9015	17.1429	17.1429
Index: tests/regression/Selection/Molecules/PushMoleculeSelection/testsuite-selection-push-molecule-selection.at
===================================================================
--- tests/regression/Selection/Molecules/PushMoleculeSelection/testsuite-selection-push-molecule-selection.at	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
+++ tests/regression/Selection/Molecules/PushMoleculeSelection/testsuite-selection-push-molecule-selection.at	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -0,0 +1,61 @@
+#
+#    MoleCuilder - creates and alters molecular systems
+#    Copyright (C) 2014 Frederik Heber
+#
+#    This program is free software: you can redistribute it and/or modify
+#    it under the terms of the GNU General Public License as published by
+#    the Free Software Foundation, either version 3 of the License, or
+#    (at your option) any later version.
+#
+#    This program is distributed in the hope that it will be useful,
+#    but WITHOUT ANY WARRANTY; without even the implied warranty of
+#    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
+#    GNU General Public License for more details.
+#
+#    You should have received a copy of the GNU General Public License
+#    along with this program.  If not, see <http://www.gnu.org/licenses/>.
+#
+### 9. push molecule selection
+
+
+AT_SETUP([Selection - Push molecule selection])
+AT_KEYWORDS([selection molecule select-all-molecules push-molecule-selection select-molecule-by-id])
+
+regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/PushMoleculeSelection"
+srcfile=box.xyz
+testfile=test.xyz
+targetfile=water_id2_4.xyz
+AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
+AT_CHECK([../../molecuilder -i $testfile -I --select-all-molecules --push-molecule-selection --select-molecule-by-id 2 4 -s $targetfile], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+
+AT_SETUP([Selection - Push molecule selection with Undo])
+AT_KEYWORDS([selection molecule select-all-molecules push-molecule-selection select-molecule-by-id undo])
+
+regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/PushMoleculeSelection"
+srcfile=box.xyz
+testfile=test.xyz
+targetfile=box.xyz
+AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
+AT_CHECK([../../molecuilder -i $testfile -I --select-all-molecules --push-molecule-selection --undo --select-molecule-by-id 2 4 -s $targetfile], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+
+AT_SETUP([Selection - Push molecule selection with Redo])
+AT_KEYWORDS([selection molecule select-all-molecules push-molecule-selection select-molecule-by-id redo])
+
+regressionpath="${abs_top_srcdir}/tests/regression/Selection/Molecules/PushMoleculeSelection"
+srcfile=box.xyz
+testfile=test.xyz
+targetfile=water_id2_4.xyz
+AT_CHECK([cp -n ${regressionpath}/pre/$srcfile $testfile], 0)
+AT_CHECK([../../molecuilder -i $testfile -I --select-all-molecules --push-molecule-selection --undo --redo --select-molecule-by-id 2 4 -s $targetfile], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $targetfile ${regressionpath}/post/$targetfile], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
Index: tests/regression/Selection/Molecules/testsuite-selection-molecules.at
===================================================================
--- tests/regression/Selection/Molecules/testsuite-selection-molecules.at	(revision 3213f29e16ba9cf8c7dc57a7343907df2ec3988a)
+++ tests/regression/Selection/Molecules/testsuite-selection-molecules.at	(revision a84e8d0ab1d22d7db69a2ac4a869d411549a066b)
@@ -52,2 +52,7 @@
 m4_include(Selection/Molecules/InvertMolecules/testsuite-selection-invert-molecules.at)
 
+# push molecule selection
+m4_include(Selection/Molecules/PushMoleculeSelection/testsuite-selection-push-molecule-selection.at)
+
+# pop molecule selection
+m4_include(Selection/Molecules/PopMoleculeSelection/testsuite-selection-pop-molecule-selection.at)
