Index: tests/regression/Makefile.am
===================================================================
--- tests/regression/Makefile.am	(revision 54088ade157ccd5da09d83809d019879eb18bca1)
+++ tests/regression/Makefile.am	(revision 6c61a977646015caffe230700aebdc01790a832d)
@@ -127,4 +127,5 @@
 	$(srcdir)/Python/testsuite-python.at \
 	$(srcdir)/Python/AllActions/testsuite-python-allactions.at \
+	$(srcdir)/Python/BoxMaker/testsuite-python-boxmaker.at \
 	$(srcdir)/Python/CommandHelp/testsuite-python-commandhelp.at \
 	$(srcdir)/Python/Pythontest/testsuite-python-pythontest.at \
Index: tests/regression/Python/BoxMaker/post/out.data
===================================================================
--- tests/regression/Python/BoxMaker/post/out.data	(revision 6c61a977646015caffe230700aebdc01790a832d)
+++ tests/regression/Python/BoxMaker/post/out.data	(revision 6c61a977646015caffe230700aebdc01790a832d)
@@ -0,0 +1,1002 @@
+# INPUTCONV shift center
+# ATOMDATA	Id	name	type	x=3
+1	Ar1	Argon	5.95304	5.95304	5.95304	
+2	Ar1	Argon	5.95304	5.95304	17.8591	
+3	Ar1	Argon	5.95304	5.95304	29.7652	
+4	Ar1	Argon	5.95304	5.95304	41.6713	
+5	Ar1	Argon	5.95304	5.95304	53.5774	
+6	Ar1	Argon	5.95304	5.95304	65.4835	
+7	Ar1	Argon	5.95304	5.95304	77.3896	
+8	Ar1	Argon	5.95304	5.95304	89.2957	
+9	Ar1	Argon	5.95304	5.95304	101.202	
+10	Ar1	Argon	5.95304	5.95304	113.108	
+11	Ar1	Argon	5.95304	17.8591	5.95304	
+12	Ar1	Argon	5.95304	17.8591	17.8591	
+13	Ar1	Argon	5.95304	17.8591	29.7652	
+14	Ar1	Argon	5.95304	17.8591	41.6713	
+15	Ar1	Argon	5.95304	17.8591	53.5774	
+16	Ar1	Argon	5.95304	17.8591	65.4835	
+17	Ar1	Argon	5.95304	17.8591	77.3896	
+18	Ar1	Argon	5.95304	17.8591	89.2957	
+19	Ar1	Argon	5.95304	17.8591	101.202	
+20	Ar1	Argon	5.95304	17.8591	113.108	
+21	Ar1	Argon	5.95304	29.7652	5.95304	
+22	Ar1	Argon	5.95304	29.7652	17.8591	
+23	Ar1	Argon	5.95304	29.7652	29.7652	
+24	Ar1	Argon	5.95304	29.7652	41.6713	
+25	Ar1	Argon	5.95304	29.7652	53.5774	
+26	Ar1	Argon	5.95304	29.7652	65.4835	
+27	Ar1	Argon	5.95304	29.7652	77.3896	
+28	Ar1	Argon	5.95304	29.7652	89.2957	
+29	Ar1	Argon	5.95304	29.7652	101.202	
+30	Ar1	Argon	5.95304	29.7652	113.108	
+31	Ar1	Argon	5.95304	41.6713	5.95304	
+32	Ar1	Argon	5.95304	41.6713	17.8591	
+33	Ar1	Argon	5.95304	41.6713	29.7652	
+34	Ar1	Argon	5.95304	41.6713	41.6713	
+35	Ar1	Argon	5.95304	41.6713	53.5774	
+36	Ar1	Argon	5.95304	41.6713	65.4835	
+37	Ar1	Argon	5.95304	41.6713	77.3896	
+38	Ar1	Argon	5.95304	41.6713	89.2957	
+39	Ar1	Argon	5.95304	41.6713	101.202	
+40	Ar1	Argon	5.95304	41.6713	113.108	
+41	Ar1	Argon	5.95304	53.5774	5.95304	
+42	Ar1	Argon	5.95304	53.5774	17.8591	
+43	Ar1	Argon	5.95304	53.5774	29.7652	
+44	Ar1	Argon	5.95304	53.5774	41.6713	
+45	Ar1	Argon	5.95304	53.5774	53.5774	
+46	Ar1	Argon	5.95304	53.5774	65.4835	
+47	Ar1	Argon	5.95304	53.5774	77.3896	
+48	Ar1	Argon	5.95304	53.5774	89.2957	
+49	Ar1	Argon	5.95304	53.5774	101.202	
+50	Ar1	Argon	5.95304	53.5774	113.108	
+51	Ar1	Argon	5.95304	65.4835	5.95304	
+52	Ar1	Argon	5.95304	65.4835	17.8591	
+53	Ar1	Argon	5.95304	65.4835	29.7652	
+54	Ar1	Argon	5.95304	65.4835	41.6713	
+55	Ar1	Argon	5.95304	65.4835	53.5774	
+56	Ar1	Argon	5.95304	65.4835	65.4835	
+57	Ar1	Argon	5.95304	65.4835	77.3896	
+58	Ar1	Argon	5.95304	65.4835	89.2957	
+59	Ar1	Argon	5.95304	65.4835	101.202	
+60	Ar1	Argon	5.95304	65.4835	113.108	
+61	Ar1	Argon	5.95304	77.3896	5.95304	
+62	Ar1	Argon	5.95304	77.3896	17.8591	
+63	Ar1	Argon	5.95304	77.3896	29.7652	
+64	Ar1	Argon	5.95304	77.3896	41.6713	
+65	Ar1	Argon	5.95304	77.3896	53.5774	
+66	Ar1	Argon	5.95304	77.3896	65.4835	
+67	Ar1	Argon	5.95304	77.3896	77.3896	
+68	Ar1	Argon	5.95304	77.3896	89.2957	
+69	Ar1	Argon	5.95304	77.3896	101.202	
+70	Ar1	Argon	5.95304	77.3896	113.108	
+71	Ar1	Argon	5.95304	89.2957	5.95304	
+72	Ar1	Argon	5.95304	89.2957	17.8591	
+73	Ar1	Argon	5.95304	89.2957	29.7652	
+74	Ar1	Argon	5.95304	89.2957	41.6713	
+75	Ar1	Argon	5.95304	89.2957	53.5774	
+76	Ar1	Argon	5.95304	89.2957	65.4835	
+77	Ar1	Argon	5.95304	89.2957	77.3896	
+78	Ar1	Argon	5.95304	89.2957	89.2957	
+79	Ar1	Argon	5.95304	89.2957	101.202	
+80	Ar1	Argon	5.95304	89.2957	113.108	
+81	Ar1	Argon	5.95304	101.202	5.95304	
+82	Ar1	Argon	5.95304	101.202	17.8591	
+83	Ar1	Argon	5.95304	101.202	29.7652	
+84	Ar1	Argon	5.95304	101.202	41.6713	
+85	Ar1	Argon	5.95304	101.202	53.5774	
+86	Ar1	Argon	5.95304	101.202	65.4835	
+87	Ar1	Argon	5.95304	101.202	77.3896	
+88	Ar1	Argon	5.95304	101.202	89.2957	
+89	Ar1	Argon	5.95304	101.202	101.202	
+90	Ar1	Argon	5.95304	101.202	113.108	
+91	Ar1	Argon	5.95304	113.108	5.95304	
+92	Ar1	Argon	5.95304	113.108	17.8591	
+93	Ar1	Argon	5.95304	113.108	29.7652	
+94	Ar1	Argon	5.95304	113.108	41.6713	
+95	Ar1	Argon	5.95304	113.108	53.5774	
+96	Ar1	Argon	5.95304	113.108	65.4835	
+97	Ar1	Argon	5.95304	113.108	77.3896	
+98	Ar1	Argon	5.95304	113.108	89.2957	
+99	Ar1	Argon	5.95304	113.108	101.202	
+100	Ar1	Argon	5.95304	113.108	113.108	
+101	Ar1	Argon	17.8591	5.95304	5.95304	
+102	Ar1	Argon	17.8591	5.95304	17.8591	
+103	Ar1	Argon	17.8591	5.95304	29.7652	
+104	Ar1	Argon	17.8591	5.95304	41.6713	
+105	Ar1	Argon	17.8591	5.95304	53.5774	
+106	Ar1	Argon	17.8591	5.95304	65.4835	
+107	Ar1	Argon	17.8591	5.95304	77.3896	
+108	Ar1	Argon	17.8591	5.95304	89.2957	
+109	Ar1	Argon	17.8591	5.95304	101.202	
+110	Ar1	Argon	17.8591	5.95304	113.108	
+111	Ar1	Argon	17.8591	17.8591	5.95304	
+112	Ar1	Argon	17.8591	17.8591	17.8591	
+113	Ar1	Argon	17.8591	17.8591	29.7652	
+114	Ar1	Argon	17.8591	17.8591	41.6713	
+115	Ar1	Argon	17.8591	17.8591	53.5774	
+116	Ar1	Argon	17.8591	17.8591	65.4835	
+117	Ar1	Argon	17.8591	17.8591	77.3896	
+118	Ar1	Argon	17.8591	17.8591	89.2957	
+119	Ar1	Argon	17.8591	17.8591	101.202	
+120	Ar1	Argon	17.8591	17.8591	113.108	
+121	Ar1	Argon	17.8591	29.7652	5.95304	
+122	Ar1	Argon	17.8591	29.7652	17.8591	
+123	Ar1	Argon	17.8591	29.7652	29.7652	
+124	Ar1	Argon	17.8591	29.7652	41.6713	
+125	Ar1	Argon	17.8591	29.7652	53.5774	
+126	Ar1	Argon	17.8591	29.7652	65.4835	
+127	Ar1	Argon	17.8591	29.7652	77.3896	
+128	Ar1	Argon	17.8591	29.7652	89.2957	
+129	Ar1	Argon	17.8591	29.7652	101.202	
+130	Ar1	Argon	17.8591	29.7652	113.108	
+131	Ar1	Argon	17.8591	41.6713	5.95304	
+132	Ar1	Argon	17.8591	41.6713	17.8591	
+133	Ar1	Argon	17.8591	41.6713	29.7652	
+134	Ar1	Argon	17.8591	41.6713	41.6713	
+135	Ar1	Argon	17.8591	41.6713	53.5774	
+136	Ar1	Argon	17.8591	41.6713	65.4835	
+137	Ar1	Argon	17.8591	41.6713	77.3896	
+138	Ar1	Argon	17.8591	41.6713	89.2957	
+139	Ar1	Argon	17.8591	41.6713	101.202	
+140	Ar1	Argon	17.8591	41.6713	113.108	
+141	Ar1	Argon	17.8591	53.5774	5.95304	
+142	Ar1	Argon	17.8591	53.5774	17.8591	
+143	Ar1	Argon	17.8591	53.5774	29.7652	
+144	Ar1	Argon	17.8591	53.5774	41.6713	
+145	Ar1	Argon	17.8591	53.5774	53.5774	
+146	Ar1	Argon	17.8591	53.5774	65.4835	
+147	Ar1	Argon	17.8591	53.5774	77.3896	
+148	Ar1	Argon	17.8591	53.5774	89.2957	
+149	Ar1	Argon	17.8591	53.5774	101.202	
+150	Ar1	Argon	17.8591	53.5774	113.108	
+151	Ar1	Argon	17.8591	65.4835	5.95304	
+152	Ar1	Argon	17.8591	65.4835	17.8591	
+153	Ar1	Argon	17.8591	65.4835	29.7652	
+154	Ar1	Argon	17.8591	65.4835	41.6713	
+155	Ar1	Argon	17.8591	65.4835	53.5774	
+156	Ar1	Argon	17.8591	65.4835	65.4835	
+157	Ar1	Argon	17.8591	65.4835	77.3896	
+158	Ar1	Argon	17.8591	65.4835	89.2957	
+159	Ar1	Argon	17.8591	65.4835	101.202	
+160	Ar1	Argon	17.8591	65.4835	113.108	
+161	Ar1	Argon	17.8591	77.3896	5.95304	
+162	Ar1	Argon	17.8591	77.3896	17.8591	
+163	Ar1	Argon	17.8591	77.3896	29.7652	
+164	Ar1	Argon	17.8591	77.3896	41.6713	
+165	Ar1	Argon	17.8591	77.3896	53.5774	
+166	Ar1	Argon	17.8591	77.3896	65.4835	
+167	Ar1	Argon	17.8591	77.3896	77.3896	
+168	Ar1	Argon	17.8591	77.3896	89.2957	
+169	Ar1	Argon	17.8591	77.3896	101.202	
+170	Ar1	Argon	17.8591	77.3896	113.108	
+171	Ar1	Argon	17.8591	89.2957	5.95304	
+172	Ar1	Argon	17.8591	89.2957	17.8591	
+173	Ar1	Argon	17.8591	89.2957	29.7652	
+174	Ar1	Argon	17.8591	89.2957	41.6713	
+175	Ar1	Argon	17.8591	89.2957	53.5774	
+176	Ar1	Argon	17.8591	89.2957	65.4835	
+177	Ar1	Argon	17.8591	89.2957	77.3896	
+178	Ar1	Argon	17.8591	89.2957	89.2957	
+179	Ar1	Argon	17.8591	89.2957	101.202	
+180	Ar1	Argon	17.8591	89.2957	113.108	
+181	Ar1	Argon	17.8591	101.202	5.95304	
+182	Ar1	Argon	17.8591	101.202	17.8591	
+183	Ar1	Argon	17.8591	101.202	29.7652	
+184	Ar1	Argon	17.8591	101.202	41.6713	
+185	Ar1	Argon	17.8591	101.202	53.5774	
+186	Ar1	Argon	17.8591	101.202	65.4835	
+187	Ar1	Argon	17.8591	101.202	77.3896	
+188	Ar1	Argon	17.8591	101.202	89.2957	
+189	Ar1	Argon	17.8591	101.202	101.202	
+190	Ar1	Argon	17.8591	101.202	113.108	
+191	Ar1	Argon	17.8591	113.108	5.95304	
+192	Ar1	Argon	17.8591	113.108	17.8591	
+193	Ar1	Argon	17.8591	113.108	29.7652	
+194	Ar1	Argon	17.8591	113.108	41.6713	
+195	Ar1	Argon	17.8591	113.108	53.5774	
+196	Ar1	Argon	17.8591	113.108	65.4835	
+197	Ar1	Argon	17.8591	113.108	77.3896	
+198	Ar1	Argon	17.8591	113.108	89.2957	
+199	Ar1	Argon	17.8591	113.108	101.202	
+200	Ar1	Argon	17.8591	113.108	113.108	
+201	Ar1	Argon	29.7652	5.95304	5.95304	
+202	Ar1	Argon	29.7652	5.95304	17.8591	
+203	Ar1	Argon	29.7652	5.95304	29.7652	
+204	Ar1	Argon	29.7652	5.95304	41.6713	
+205	Ar1	Argon	29.7652	5.95304	53.5774	
+206	Ar1	Argon	29.7652	5.95304	65.4835	
+207	Ar1	Argon	29.7652	5.95304	77.3896	
+208	Ar1	Argon	29.7652	5.95304	89.2957	
+209	Ar1	Argon	29.7652	5.95304	101.202	
+210	Ar1	Argon	29.7652	5.95304	113.108	
+211	Ar1	Argon	29.7652	17.8591	5.95304	
+212	Ar1	Argon	29.7652	17.8591	17.8591	
+213	Ar1	Argon	29.7652	17.8591	29.7652	
+214	Ar1	Argon	29.7652	17.8591	41.6713	
+215	Ar1	Argon	29.7652	17.8591	53.5774	
+216	Ar1	Argon	29.7652	17.8591	65.4835	
+217	Ar1	Argon	29.7652	17.8591	77.3896	
+218	Ar1	Argon	29.7652	17.8591	89.2957	
+219	Ar1	Argon	29.7652	17.8591	101.202	
+220	Ar1	Argon	29.7652	17.8591	113.108	
+221	Ar1	Argon	29.7652	29.7652	5.95304	
+222	Ar1	Argon	29.7652	29.7652	17.8591	
+223	Ar1	Argon	29.7652	29.7652	29.7652	
+224	Ar1	Argon	29.7652	29.7652	41.6713	
+225	Ar1	Argon	29.7652	29.7652	53.5774	
+226	Ar1	Argon	29.7652	29.7652	65.4835	
+227	Ar1	Argon	29.7652	29.7652	77.3896	
+228	Ar1	Argon	29.7652	29.7652	89.2957	
+229	Ar1	Argon	29.7652	29.7652	101.202	
+230	Ar1	Argon	29.7652	29.7652	113.108	
+231	Ar1	Argon	29.7652	41.6713	5.95304	
+232	Ar1	Argon	29.7652	41.6713	17.8591	
+233	Ar1	Argon	29.7652	41.6713	29.7652	
+234	Ar1	Argon	29.7652	41.6713	41.6713	
+235	Ar1	Argon	29.7652	41.6713	53.5774	
+236	Ar1	Argon	29.7652	41.6713	65.4835	
+237	Ar1	Argon	29.7652	41.6713	77.3896	
+238	Ar1	Argon	29.7652	41.6713	89.2957	
+239	Ar1	Argon	29.7652	41.6713	101.202	
+240	Ar1	Argon	29.7652	41.6713	113.108	
+241	Ar1	Argon	29.7652	53.5774	5.95304	
+242	Ar1	Argon	29.7652	53.5774	17.8591	
+243	Ar1	Argon	29.7652	53.5774	29.7652	
+244	Ar1	Argon	29.7652	53.5774	41.6713	
+245	Ar1	Argon	29.7652	53.5774	53.5774	
+246	Ar1	Argon	29.7652	53.5774	65.4835	
+247	Ar1	Argon	29.7652	53.5774	77.3896	
+248	Ar1	Argon	29.7652	53.5774	89.2957	
+249	Ar1	Argon	29.7652	53.5774	101.202	
+250	Ar1	Argon	29.7652	53.5774	113.108	
+251	Ar1	Argon	29.7652	65.4835	5.95304	
+252	Ar1	Argon	29.7652	65.4835	17.8591	
+253	Ar1	Argon	29.7652	65.4835	29.7652	
+254	Ar1	Argon	29.7652	65.4835	41.6713	
+255	Ar1	Argon	29.7652	65.4835	53.5774	
+256	Ar1	Argon	29.7652	65.4835	65.4835	
+257	Ar1	Argon	29.7652	65.4835	77.3896	
+258	Ar1	Argon	29.7652	65.4835	89.2957	
+259	Ar1	Argon	29.7652	65.4835	101.202	
+260	Ar1	Argon	29.7652	65.4835	113.108	
+261	Ar1	Argon	29.7652	77.3896	5.95304	
+262	Ar1	Argon	29.7652	77.3896	17.8591	
+263	Ar1	Argon	29.7652	77.3896	29.7652	
+264	Ar1	Argon	29.7652	77.3896	41.6713	
+265	Ar1	Argon	29.7652	77.3896	53.5774	
+266	Ar1	Argon	29.7652	77.3896	65.4835	
+267	Ar1	Argon	29.7652	77.3896	77.3896	
+268	Ar1	Argon	29.7652	77.3896	89.2957	
+269	Ar1	Argon	29.7652	77.3896	101.202	
+270	Ar1	Argon	29.7652	77.3896	113.108	
+271	Ar1	Argon	29.7652	89.2957	5.95304	
+272	Ar1	Argon	29.7652	89.2957	17.8591	
+273	Ar1	Argon	29.7652	89.2957	29.7652	
+274	Ar1	Argon	29.7652	89.2957	41.6713	
+275	Ar1	Argon	29.7652	89.2957	53.5774	
+276	Ar1	Argon	29.7652	89.2957	65.4835	
+277	Ar1	Argon	29.7652	89.2957	77.3896	
+278	Ar1	Argon	29.7652	89.2957	89.2957	
+279	Ar1	Argon	29.7652	89.2957	101.202	
+280	Ar1	Argon	29.7652	89.2957	113.108	
+281	Ar1	Argon	29.7652	101.202	5.95304	
+282	Ar1	Argon	29.7652	101.202	17.8591	
+283	Ar1	Argon	29.7652	101.202	29.7652	
+284	Ar1	Argon	29.7652	101.202	41.6713	
+285	Ar1	Argon	29.7652	101.202	53.5774	
+286	Ar1	Argon	29.7652	101.202	65.4835	
+287	Ar1	Argon	29.7652	101.202	77.3896	
+288	Ar1	Argon	29.7652	101.202	89.2957	
+289	Ar1	Argon	29.7652	101.202	101.202	
+290	Ar1	Argon	29.7652	101.202	113.108	
+291	Ar1	Argon	29.7652	113.108	5.95304	
+292	Ar1	Argon	29.7652	113.108	17.8591	
+293	Ar1	Argon	29.7652	113.108	29.7652	
+294	Ar1	Argon	29.7652	113.108	41.6713	
+295	Ar1	Argon	29.7652	113.108	53.5774	
+296	Ar1	Argon	29.7652	113.108	65.4835	
+297	Ar1	Argon	29.7652	113.108	77.3896	
+298	Ar1	Argon	29.7652	113.108	89.2957	
+299	Ar1	Argon	29.7652	113.108	101.202	
+300	Ar1	Argon	29.7652	113.108	113.108	
+301	Ar1	Argon	41.6713	5.95304	5.95304	
+302	Ar1	Argon	41.6713	5.95304	17.8591	
+303	Ar1	Argon	41.6713	5.95304	29.7652	
+304	Ar1	Argon	41.6713	5.95304	41.6713	
+305	Ar1	Argon	41.6713	5.95304	53.5774	
+306	Ar1	Argon	41.6713	5.95304	65.4835	
+307	Ar1	Argon	41.6713	5.95304	77.3896	
+308	Ar1	Argon	41.6713	5.95304	89.2957	
+309	Ar1	Argon	41.6713	5.95304	101.202	
+310	Ar1	Argon	41.6713	5.95304	113.108	
+311	Ar1	Argon	41.6713	17.8591	5.95304	
+312	Ar1	Argon	41.6713	17.8591	17.8591	
+313	Ar1	Argon	41.6713	17.8591	29.7652	
+314	Ar1	Argon	41.6713	17.8591	41.6713	
+315	Ar1	Argon	41.6713	17.8591	53.5774	
+316	Ar1	Argon	41.6713	17.8591	65.4835	
+317	Ar1	Argon	41.6713	17.8591	77.3896	
+318	Ar1	Argon	41.6713	17.8591	89.2957	
+319	Ar1	Argon	41.6713	17.8591	101.202	
+320	Ar1	Argon	41.6713	17.8591	113.108	
+321	Ar1	Argon	41.6713	29.7652	5.95304	
+322	Ar1	Argon	41.6713	29.7652	17.8591	
+323	Ar1	Argon	41.6713	29.7652	29.7652	
+324	Ar1	Argon	41.6713	29.7652	41.6713	
+325	Ar1	Argon	41.6713	29.7652	53.5774	
+326	Ar1	Argon	41.6713	29.7652	65.4835	
+327	Ar1	Argon	41.6713	29.7652	77.3896	
+328	Ar1	Argon	41.6713	29.7652	89.2957	
+329	Ar1	Argon	41.6713	29.7652	101.202	
+330	Ar1	Argon	41.6713	29.7652	113.108	
+331	Ar1	Argon	41.6713	41.6713	5.95304	
+332	Ar1	Argon	41.6713	41.6713	17.8591	
+333	Ar1	Argon	41.6713	41.6713	29.7652	
+334	Ar1	Argon	41.6713	41.6713	41.6713	
+335	Ar1	Argon	41.6713	41.6713	53.5774	
+336	Ar1	Argon	41.6713	41.6713	65.4835	
+337	Ar1	Argon	41.6713	41.6713	77.3896	
+338	Ar1	Argon	41.6713	41.6713	89.2957	
+339	Ar1	Argon	41.6713	41.6713	101.202	
+340	Ar1	Argon	41.6713	41.6713	113.108	
+341	Ar1	Argon	41.6713	53.5774	5.95304	
+342	Ar1	Argon	41.6713	53.5774	17.8591	
+343	Ar1	Argon	41.6713	53.5774	29.7652	
+344	Ar1	Argon	41.6713	53.5774	41.6713	
+345	Ar1	Argon	41.6713	53.5774	53.5774	
+346	Ar1	Argon	41.6713	53.5774	65.4835	
+347	Ar1	Argon	41.6713	53.5774	77.3896	
+348	Ar1	Argon	41.6713	53.5774	89.2957	
+349	Ar1	Argon	41.6713	53.5774	101.202	
+350	Ar1	Argon	41.6713	53.5774	113.108	
+351	Ar1	Argon	41.6713	65.4835	5.95304	
+352	Ar1	Argon	41.6713	65.4835	17.8591	
+353	Ar1	Argon	41.6713	65.4835	29.7652	
+354	Ar1	Argon	41.6713	65.4835	41.6713	
+355	Ar1	Argon	41.6713	65.4835	53.5774	
+356	Ar1	Argon	41.6713	65.4835	65.4835	
+357	Ar1	Argon	41.6713	65.4835	77.3896	
+358	Ar1	Argon	41.6713	65.4835	89.2957	
+359	Ar1	Argon	41.6713	65.4835	101.202	
+360	Ar1	Argon	41.6713	65.4835	113.108	
+361	Ar1	Argon	41.6713	77.3896	5.95304	
+362	Ar1	Argon	41.6713	77.3896	17.8591	
+363	Ar1	Argon	41.6713	77.3896	29.7652	
+364	Ar1	Argon	41.6713	77.3896	41.6713	
+365	Ar1	Argon	41.6713	77.3896	53.5774	
+366	Ar1	Argon	41.6713	77.3896	65.4835	
+367	Ar1	Argon	41.6713	77.3896	77.3896	
+368	Ar1	Argon	41.6713	77.3896	89.2957	
+369	Ar1	Argon	41.6713	77.3896	101.202	
+370	Ar1	Argon	41.6713	77.3896	113.108	
+371	Ar1	Argon	41.6713	89.2957	5.95304	
+372	Ar1	Argon	41.6713	89.2957	17.8591	
+373	Ar1	Argon	41.6713	89.2957	29.7652	
+374	Ar1	Argon	41.6713	89.2957	41.6713	
+375	Ar1	Argon	41.6713	89.2957	53.5774	
+376	Ar1	Argon	41.6713	89.2957	65.4835	
+377	Ar1	Argon	41.6713	89.2957	77.3896	
+378	Ar1	Argon	41.6713	89.2957	89.2957	
+379	Ar1	Argon	41.6713	89.2957	101.202	
+380	Ar1	Argon	41.6713	89.2957	113.108	
+381	Ar1	Argon	41.6713	101.202	5.95304	
+382	Ar1	Argon	41.6713	101.202	17.8591	
+383	Ar1	Argon	41.6713	101.202	29.7652	
+384	Ar1	Argon	41.6713	101.202	41.6713	
+385	Ar1	Argon	41.6713	101.202	53.5774	
+386	Ar1	Argon	41.6713	101.202	65.4835	
+387	Ar1	Argon	41.6713	101.202	77.3896	
+388	Ar1	Argon	41.6713	101.202	89.2957	
+389	Ar1	Argon	41.6713	101.202	101.202	
+390	Ar1	Argon	41.6713	101.202	113.108	
+391	Ar1	Argon	41.6713	113.108	5.95304	
+392	Ar1	Argon	41.6713	113.108	17.8591	
+393	Ar1	Argon	41.6713	113.108	29.7652	
+394	Ar1	Argon	41.6713	113.108	41.6713	
+395	Ar1	Argon	41.6713	113.108	53.5774	
+396	Ar1	Argon	41.6713	113.108	65.4835	
+397	Ar1	Argon	41.6713	113.108	77.3896	
+398	Ar1	Argon	41.6713	113.108	89.2957	
+399	Ar1	Argon	41.6713	113.108	101.202	
+400	Ar1	Argon	41.6713	113.108	113.108	
+401	Ar1	Argon	53.5774	5.95304	5.95304	
+402	Ar1	Argon	53.5774	5.95304	17.8591	
+403	Ar1	Argon	53.5774	5.95304	29.7652	
+404	Ar1	Argon	53.5774	5.95304	41.6713	
+405	Ar1	Argon	53.5774	5.95304	53.5774	
+406	Ar1	Argon	53.5774	5.95304	65.4835	
+407	Ar1	Argon	53.5774	5.95304	77.3896	
+408	Ar1	Argon	53.5774	5.95304	89.2957	
+409	Ar1	Argon	53.5774	5.95304	101.202	
+410	Ar1	Argon	53.5774	5.95304	113.108	
+411	Ar1	Argon	53.5774	17.8591	5.95304	
+412	Ar1	Argon	53.5774	17.8591	17.8591	
+413	Ar1	Argon	53.5774	17.8591	29.7652	
+414	Ar1	Argon	53.5774	17.8591	41.6713	
+415	Ar1	Argon	53.5774	17.8591	53.5774	
+416	Ar1	Argon	53.5774	17.8591	65.4835	
+417	Ar1	Argon	53.5774	17.8591	77.3896	
+418	Ar1	Argon	53.5774	17.8591	89.2957	
+419	Ar1	Argon	53.5774	17.8591	101.202	
+420	Ar1	Argon	53.5774	17.8591	113.108	
+421	Ar1	Argon	53.5774	29.7652	5.95304	
+422	Ar1	Argon	53.5774	29.7652	17.8591	
+423	Ar1	Argon	53.5774	29.7652	29.7652	
+424	Ar1	Argon	53.5774	29.7652	41.6713	
+425	Ar1	Argon	53.5774	29.7652	53.5774	
+426	Ar1	Argon	53.5774	29.7652	65.4835	
+427	Ar1	Argon	53.5774	29.7652	77.3896	
+428	Ar1	Argon	53.5774	29.7652	89.2957	
+429	Ar1	Argon	53.5774	29.7652	101.202	
+430	Ar1	Argon	53.5774	29.7652	113.108	
+431	Ar1	Argon	53.5774	41.6713	5.95304	
+432	Ar1	Argon	53.5774	41.6713	17.8591	
+433	Ar1	Argon	53.5774	41.6713	29.7652	
+434	Ar1	Argon	53.5774	41.6713	41.6713	
+435	Ar1	Argon	53.5774	41.6713	53.5774	
+436	Ar1	Argon	53.5774	41.6713	65.4835	
+437	Ar1	Argon	53.5774	41.6713	77.3896	
+438	Ar1	Argon	53.5774	41.6713	89.2957	
+439	Ar1	Argon	53.5774	41.6713	101.202	
+440	Ar1	Argon	53.5774	41.6713	113.108	
+441	Ar1	Argon	53.5774	53.5774	5.95304	
+442	Ar1	Argon	53.5774	53.5774	17.8591	
+443	Ar1	Argon	53.5774	53.5774	29.7652	
+444	Ar1	Argon	53.5774	53.5774	41.6713	
+445	Ar1	Argon	53.5774	53.5774	53.5774	
+446	Ar1	Argon	53.5774	53.5774	65.4835	
+447	Ar1	Argon	53.5774	53.5774	77.3896	
+448	Ar1	Argon	53.5774	53.5774	89.2957	
+449	Ar1	Argon	53.5774	53.5774	101.202	
+450	Ar1	Argon	53.5774	53.5774	113.108	
+451	Ar1	Argon	53.5774	65.4835	5.95304	
+452	Ar1	Argon	53.5774	65.4835	17.8591	
+453	Ar1	Argon	53.5774	65.4835	29.7652	
+454	Ar1	Argon	53.5774	65.4835	41.6713	
+455	Ar1	Argon	53.5774	65.4835	53.5774	
+456	Ar1	Argon	53.5774	65.4835	65.4835	
+457	Ar1	Argon	53.5774	65.4835	77.3896	
+458	Ar1	Argon	53.5774	65.4835	89.2957	
+459	Ar1	Argon	53.5774	65.4835	101.202	
+460	Ar1	Argon	53.5774	65.4835	113.108	
+461	Ar1	Argon	53.5774	77.3896	5.95304	
+462	Ar1	Argon	53.5774	77.3896	17.8591	
+463	Ar1	Argon	53.5774	77.3896	29.7652	
+464	Ar1	Argon	53.5774	77.3896	41.6713	
+465	Ar1	Argon	53.5774	77.3896	53.5774	
+466	Ar1	Argon	53.5774	77.3896	65.4835	
+467	Ar1	Argon	53.5774	77.3896	77.3896	
+468	Ar1	Argon	53.5774	77.3896	89.2957	
+469	Ar1	Argon	53.5774	77.3896	101.202	
+470	Ar1	Argon	53.5774	77.3896	113.108	
+471	Ar1	Argon	53.5774	89.2957	5.95304	
+472	Ar1	Argon	53.5774	89.2957	17.8591	
+473	Ar1	Argon	53.5774	89.2957	29.7652	
+474	Ar1	Argon	53.5774	89.2957	41.6713	
+475	Ar1	Argon	53.5774	89.2957	53.5774	
+476	Ar1	Argon	53.5774	89.2957	65.4835	
+477	Ar1	Argon	53.5774	89.2957	77.3896	
+478	Ar1	Argon	53.5774	89.2957	89.2957	
+479	Ar1	Argon	53.5774	89.2957	101.202	
+480	Ar1	Argon	53.5774	89.2957	113.108	
+481	Ar1	Argon	53.5774	101.202	5.95304	
+482	Ar1	Argon	53.5774	101.202	17.8591	
+483	Ar1	Argon	53.5774	101.202	29.7652	
+484	Ar1	Argon	53.5774	101.202	41.6713	
+485	Ar1	Argon	53.5774	101.202	53.5774	
+486	Ar1	Argon	53.5774	101.202	65.4835	
+487	Ar1	Argon	53.5774	101.202	77.3896	
+488	Ar1	Argon	53.5774	101.202	89.2957	
+489	Ar1	Argon	53.5774	101.202	101.202	
+490	Ar1	Argon	53.5774	101.202	113.108	
+491	Ar1	Argon	53.5774	113.108	5.95304	
+492	Ar1	Argon	53.5774	113.108	17.8591	
+493	Ar1	Argon	53.5774	113.108	29.7652	
+494	Ar1	Argon	53.5774	113.108	41.6713	
+495	Ar1	Argon	53.5774	113.108	53.5774	
+496	Ar1	Argon	53.5774	113.108	65.4835	
+497	Ar1	Argon	53.5774	113.108	77.3896	
+498	Ar1	Argon	53.5774	113.108	89.2957	
+499	Ar1	Argon	53.5774	113.108	101.202	
+500	Ar1	Argon	53.5774	113.108	113.108	
+501	Ar1	Argon	65.4835	5.95304	5.95304	
+502	Ar1	Argon	65.4835	5.95304	17.8591	
+503	Ar1	Argon	65.4835	5.95304	29.7652	
+504	Ar1	Argon	65.4835	5.95304	41.6713	
+505	Ar1	Argon	65.4835	5.95304	53.5774	
+506	Ar1	Argon	65.4835	5.95304	65.4835	
+507	Ar1	Argon	65.4835	5.95304	77.3896	
+508	Ar1	Argon	65.4835	5.95304	89.2957	
+509	Ar1	Argon	65.4835	5.95304	101.202	
+510	Ar1	Argon	65.4835	5.95304	113.108	
+511	Ar1	Argon	65.4835	17.8591	5.95304	
+512	Ar1	Argon	65.4835	17.8591	17.8591	
+513	Ar1	Argon	65.4835	17.8591	29.7652	
+514	Ar1	Argon	65.4835	17.8591	41.6713	
+515	Ar1	Argon	65.4835	17.8591	53.5774	
+516	Ar1	Argon	65.4835	17.8591	65.4835	
+517	Ar1	Argon	65.4835	17.8591	77.3896	
+518	Ar1	Argon	65.4835	17.8591	89.2957	
+519	Ar1	Argon	65.4835	17.8591	101.202	
+520	Ar1	Argon	65.4835	17.8591	113.108	
+521	Ar1	Argon	65.4835	29.7652	5.95304	
+522	Ar1	Argon	65.4835	29.7652	17.8591	
+523	Ar1	Argon	65.4835	29.7652	29.7652	
+524	Ar1	Argon	65.4835	29.7652	41.6713	
+525	Ar1	Argon	65.4835	29.7652	53.5774	
+526	Ar1	Argon	65.4835	29.7652	65.4835	
+527	Ar1	Argon	65.4835	29.7652	77.3896	
+528	Ar1	Argon	65.4835	29.7652	89.2957	
+529	Ar1	Argon	65.4835	29.7652	101.202	
+530	Ar1	Argon	65.4835	29.7652	113.108	
+531	Ar1	Argon	65.4835	41.6713	5.95304	
+532	Ar1	Argon	65.4835	41.6713	17.8591	
+533	Ar1	Argon	65.4835	41.6713	29.7652	
+534	Ar1	Argon	65.4835	41.6713	41.6713	
+535	Ar1	Argon	65.4835	41.6713	53.5774	
+536	Ar1	Argon	65.4835	41.6713	65.4835	
+537	Ar1	Argon	65.4835	41.6713	77.3896	
+538	Ar1	Argon	65.4835	41.6713	89.2957	
+539	Ar1	Argon	65.4835	41.6713	101.202	
+540	Ar1	Argon	65.4835	41.6713	113.108	
+541	Ar1	Argon	65.4835	53.5774	5.95304	
+542	Ar1	Argon	65.4835	53.5774	17.8591	
+543	Ar1	Argon	65.4835	53.5774	29.7652	
+544	Ar1	Argon	65.4835	53.5774	41.6713	
+545	Ar1	Argon	65.4835	53.5774	53.5774	
+546	Ar1	Argon	65.4835	53.5774	65.4835	
+547	Ar1	Argon	65.4835	53.5774	77.3896	
+548	Ar1	Argon	65.4835	53.5774	89.2957	
+549	Ar1	Argon	65.4835	53.5774	101.202	
+550	Ar1	Argon	65.4835	53.5774	113.108	
+551	Ar1	Argon	65.4835	65.4835	5.95304	
+552	Ar1	Argon	65.4835	65.4835	17.8591	
+553	Ar1	Argon	65.4835	65.4835	29.7652	
+554	Ar1	Argon	65.4835	65.4835	41.6713	
+555	Ar1	Argon	65.4835	65.4835	53.5774	
+556	Ar1	Argon	65.4835	65.4835	65.4835	
+557	Ar1	Argon	65.4835	65.4835	77.3896	
+558	Ar1	Argon	65.4835	65.4835	89.2957	
+559	Ar1	Argon	65.4835	65.4835	101.202	
+560	Ar1	Argon	65.4835	65.4835	113.108	
+561	Ar1	Argon	65.4835	77.3896	5.95304	
+562	Ar1	Argon	65.4835	77.3896	17.8591	
+563	Ar1	Argon	65.4835	77.3896	29.7652	
+564	Ar1	Argon	65.4835	77.3896	41.6713	
+565	Ar1	Argon	65.4835	77.3896	53.5774	
+566	Ar1	Argon	65.4835	77.3896	65.4835	
+567	Ar1	Argon	65.4835	77.3896	77.3896	
+568	Ar1	Argon	65.4835	77.3896	89.2957	
+569	Ar1	Argon	65.4835	77.3896	101.202	
+570	Ar1	Argon	65.4835	77.3896	113.108	
+571	Ar1	Argon	65.4835	89.2957	5.95304	
+572	Ar1	Argon	65.4835	89.2957	17.8591	
+573	Ar1	Argon	65.4835	89.2957	29.7652	
+574	Ar1	Argon	65.4835	89.2957	41.6713	
+575	Ar1	Argon	65.4835	89.2957	53.5774	
+576	Ar1	Argon	65.4835	89.2957	65.4835	
+577	Ar1	Argon	65.4835	89.2957	77.3896	
+578	Ar1	Argon	65.4835	89.2957	89.2957	
+579	Ar1	Argon	65.4835	89.2957	101.202	
+580	Ar1	Argon	65.4835	89.2957	113.108	
+581	Ar1	Argon	65.4835	101.202	5.95304	
+582	Ar1	Argon	65.4835	101.202	17.8591	
+583	Ar1	Argon	65.4835	101.202	29.7652	
+584	Ar1	Argon	65.4835	101.202	41.6713	
+585	Ar1	Argon	65.4835	101.202	53.5774	
+586	Ar1	Argon	65.4835	101.202	65.4835	
+587	Ar1	Argon	65.4835	101.202	77.3896	
+588	Ar1	Argon	65.4835	101.202	89.2957	
+589	Ar1	Argon	65.4835	101.202	101.202	
+590	Ar1	Argon	65.4835	101.202	113.108	
+591	Ar1	Argon	65.4835	113.108	5.95304	
+592	Ar1	Argon	65.4835	113.108	17.8591	
+593	Ar1	Argon	65.4835	113.108	29.7652	
+594	Ar1	Argon	65.4835	113.108	41.6713	
+595	Ar1	Argon	65.4835	113.108	53.5774	
+596	Ar1	Argon	65.4835	113.108	65.4835	
+597	Ar1	Argon	65.4835	113.108	77.3896	
+598	Ar1	Argon	65.4835	113.108	89.2957	
+599	Ar1	Argon	65.4835	113.108	101.202	
+600	Ar1	Argon	65.4835	113.108	113.108	
+601	Ar1	Argon	77.3896	5.95304	5.95304	
+602	Ar1	Argon	77.3896	5.95304	17.8591	
+603	Ar1	Argon	77.3896	5.95304	29.7652	
+604	Ar1	Argon	77.3896	5.95304	41.6713	
+605	Ar1	Argon	77.3896	5.95304	53.5774	
+606	Ar1	Argon	77.3896	5.95304	65.4835	
+607	Ar1	Argon	77.3896	5.95304	77.3896	
+608	Ar1	Argon	77.3896	5.95304	89.2957	
+609	Ar1	Argon	77.3896	5.95304	101.202	
+610	Ar1	Argon	77.3896	5.95304	113.108	
+611	Ar1	Argon	77.3896	17.8591	5.95304	
+612	Ar1	Argon	77.3896	17.8591	17.8591	
+613	Ar1	Argon	77.3896	17.8591	29.7652	
+614	Ar1	Argon	77.3896	17.8591	41.6713	
+615	Ar1	Argon	77.3896	17.8591	53.5774	
+616	Ar1	Argon	77.3896	17.8591	65.4835	
+617	Ar1	Argon	77.3896	17.8591	77.3896	
+618	Ar1	Argon	77.3896	17.8591	89.2957	
+619	Ar1	Argon	77.3896	17.8591	101.202	
+620	Ar1	Argon	77.3896	17.8591	113.108	
+621	Ar1	Argon	77.3896	29.7652	5.95304	
+622	Ar1	Argon	77.3896	29.7652	17.8591	
+623	Ar1	Argon	77.3896	29.7652	29.7652	
+624	Ar1	Argon	77.3896	29.7652	41.6713	
+625	Ar1	Argon	77.3896	29.7652	53.5774	
+626	Ar1	Argon	77.3896	29.7652	65.4835	
+627	Ar1	Argon	77.3896	29.7652	77.3896	
+628	Ar1	Argon	77.3896	29.7652	89.2957	
+629	Ar1	Argon	77.3896	29.7652	101.202	
+630	Ar1	Argon	77.3896	29.7652	113.108	
+631	Ar1	Argon	77.3896	41.6713	5.95304	
+632	Ar1	Argon	77.3896	41.6713	17.8591	
+633	Ar1	Argon	77.3896	41.6713	29.7652	
+634	Ar1	Argon	77.3896	41.6713	41.6713	
+635	Ar1	Argon	77.3896	41.6713	53.5774	
+636	Ar1	Argon	77.3896	41.6713	65.4835	
+637	Ar1	Argon	77.3896	41.6713	77.3896	
+638	Ar1	Argon	77.3896	41.6713	89.2957	
+639	Ar1	Argon	77.3896	41.6713	101.202	
+640	Ar1	Argon	77.3896	41.6713	113.108	
+641	Ar1	Argon	77.3896	53.5774	5.95304	
+642	Ar1	Argon	77.3896	53.5774	17.8591	
+643	Ar1	Argon	77.3896	53.5774	29.7652	
+644	Ar1	Argon	77.3896	53.5774	41.6713	
+645	Ar1	Argon	77.3896	53.5774	53.5774	
+646	Ar1	Argon	77.3896	53.5774	65.4835	
+647	Ar1	Argon	77.3896	53.5774	77.3896	
+648	Ar1	Argon	77.3896	53.5774	89.2957	
+649	Ar1	Argon	77.3896	53.5774	101.202	
+650	Ar1	Argon	77.3896	53.5774	113.108	
+651	Ar1	Argon	77.3896	65.4835	5.95304	
+652	Ar1	Argon	77.3896	65.4835	17.8591	
+653	Ar1	Argon	77.3896	65.4835	29.7652	
+654	Ar1	Argon	77.3896	65.4835	41.6713	
+655	Ar1	Argon	77.3896	65.4835	53.5774	
+656	Ar1	Argon	77.3896	65.4835	65.4835	
+657	Ar1	Argon	77.3896	65.4835	77.3896	
+658	Ar1	Argon	77.3896	65.4835	89.2957	
+659	Ar1	Argon	77.3896	65.4835	101.202	
+660	Ar1	Argon	77.3896	65.4835	113.108	
+661	Ar1	Argon	77.3896	77.3896	5.95304	
+662	Ar1	Argon	77.3896	77.3896	17.8591	
+663	Ar1	Argon	77.3896	77.3896	29.7652	
+664	Ar1	Argon	77.3896	77.3896	41.6713	
+665	Ar1	Argon	77.3896	77.3896	53.5774	
+666	Ar1	Argon	77.3896	77.3896	65.4835	
+667	Ar1	Argon	77.3896	77.3896	77.3896	
+668	Ar1	Argon	77.3896	77.3896	89.2957	
+669	Ar1	Argon	77.3896	77.3896	101.202	
+670	Ar1	Argon	77.3896	77.3896	113.108	
+671	Ar1	Argon	77.3896	89.2957	5.95304	
+672	Ar1	Argon	77.3896	89.2957	17.8591	
+673	Ar1	Argon	77.3896	89.2957	29.7652	
+674	Ar1	Argon	77.3896	89.2957	41.6713	
+675	Ar1	Argon	77.3896	89.2957	53.5774	
+676	Ar1	Argon	77.3896	89.2957	65.4835	
+677	Ar1	Argon	77.3896	89.2957	77.3896	
+678	Ar1	Argon	77.3896	89.2957	89.2957	
+679	Ar1	Argon	77.3896	89.2957	101.202	
+680	Ar1	Argon	77.3896	89.2957	113.108	
+681	Ar1	Argon	77.3896	101.202	5.95304	
+682	Ar1	Argon	77.3896	101.202	17.8591	
+683	Ar1	Argon	77.3896	101.202	29.7652	
+684	Ar1	Argon	77.3896	101.202	41.6713	
+685	Ar1	Argon	77.3896	101.202	53.5774	
+686	Ar1	Argon	77.3896	101.202	65.4835	
+687	Ar1	Argon	77.3896	101.202	77.3896	
+688	Ar1	Argon	77.3896	101.202	89.2957	
+689	Ar1	Argon	77.3896	101.202	101.202	
+690	Ar1	Argon	77.3896	101.202	113.108	
+691	Ar1	Argon	77.3896	113.108	5.95304	
+692	Ar1	Argon	77.3896	113.108	17.8591	
+693	Ar1	Argon	77.3896	113.108	29.7652	
+694	Ar1	Argon	77.3896	113.108	41.6713	
+695	Ar1	Argon	77.3896	113.108	53.5774	
+696	Ar1	Argon	77.3896	113.108	65.4835	
+697	Ar1	Argon	77.3896	113.108	77.3896	
+698	Ar1	Argon	77.3896	113.108	89.2957	
+699	Ar1	Argon	77.3896	113.108	101.202	
+700	Ar1	Argon	77.3896	113.108	113.108	
+701	Ar1	Argon	89.2957	5.95304	5.95304	
+702	Ar1	Argon	89.2957	5.95304	17.8591	
+703	Ar1	Argon	89.2957	5.95304	29.7652	
+704	Ar1	Argon	89.2957	5.95304	41.6713	
+705	Ar1	Argon	89.2957	5.95304	53.5774	
+706	Ar1	Argon	89.2957	5.95304	65.4835	
+707	Ar1	Argon	89.2957	5.95304	77.3896	
+708	Ar1	Argon	89.2957	5.95304	89.2957	
+709	Ar1	Argon	89.2957	5.95304	101.202	
+710	Ar1	Argon	89.2957	5.95304	113.108	
+711	Ar1	Argon	89.2957	17.8591	5.95304	
+712	Ar1	Argon	89.2957	17.8591	17.8591	
+713	Ar1	Argon	89.2957	17.8591	29.7652	
+714	Ar1	Argon	89.2957	17.8591	41.6713	
+715	Ar1	Argon	89.2957	17.8591	53.5774	
+716	Ar1	Argon	89.2957	17.8591	65.4835	
+717	Ar1	Argon	89.2957	17.8591	77.3896	
+718	Ar1	Argon	89.2957	17.8591	89.2957	
+719	Ar1	Argon	89.2957	17.8591	101.202	
+720	Ar1	Argon	89.2957	17.8591	113.108	
+721	Ar1	Argon	89.2957	29.7652	5.95304	
+722	Ar1	Argon	89.2957	29.7652	17.8591	
+723	Ar1	Argon	89.2957	29.7652	29.7652	
+724	Ar1	Argon	89.2957	29.7652	41.6713	
+725	Ar1	Argon	89.2957	29.7652	53.5774	
+726	Ar1	Argon	89.2957	29.7652	65.4835	
+727	Ar1	Argon	89.2957	29.7652	77.3896	
+728	Ar1	Argon	89.2957	29.7652	89.2957	
+729	Ar1	Argon	89.2957	29.7652	101.202	
+730	Ar1	Argon	89.2957	29.7652	113.108	
+731	Ar1	Argon	89.2957	41.6713	5.95304	
+732	Ar1	Argon	89.2957	41.6713	17.8591	
+733	Ar1	Argon	89.2957	41.6713	29.7652	
+734	Ar1	Argon	89.2957	41.6713	41.6713	
+735	Ar1	Argon	89.2957	41.6713	53.5774	
+736	Ar1	Argon	89.2957	41.6713	65.4835	
+737	Ar1	Argon	89.2957	41.6713	77.3896	
+738	Ar1	Argon	89.2957	41.6713	89.2957	
+739	Ar1	Argon	89.2957	41.6713	101.202	
+740	Ar1	Argon	89.2957	41.6713	113.108	
+741	Ar1	Argon	89.2957	53.5774	5.95304	
+742	Ar1	Argon	89.2957	53.5774	17.8591	
+743	Ar1	Argon	89.2957	53.5774	29.7652	
+744	Ar1	Argon	89.2957	53.5774	41.6713	
+745	Ar1	Argon	89.2957	53.5774	53.5774	
+746	Ar1	Argon	89.2957	53.5774	65.4835	
+747	Ar1	Argon	89.2957	53.5774	77.3896	
+748	Ar1	Argon	89.2957	53.5774	89.2957	
+749	Ar1	Argon	89.2957	53.5774	101.202	
+750	Ar1	Argon	89.2957	53.5774	113.108	
+751	Ar1	Argon	89.2957	65.4835	5.95304	
+752	Ar1	Argon	89.2957	65.4835	17.8591	
+753	Ar1	Argon	89.2957	65.4835	29.7652	
+754	Ar1	Argon	89.2957	65.4835	41.6713	
+755	Ar1	Argon	89.2957	65.4835	53.5774	
+756	Ar1	Argon	89.2957	65.4835	65.4835	
+757	Ar1	Argon	89.2957	65.4835	77.3896	
+758	Ar1	Argon	89.2957	65.4835	89.2957	
+759	Ar1	Argon	89.2957	65.4835	101.202	
+760	Ar1	Argon	89.2957	65.4835	113.108	
+761	Ar1	Argon	89.2957	77.3896	5.95304	
+762	Ar1	Argon	89.2957	77.3896	17.8591	
+763	Ar1	Argon	89.2957	77.3896	29.7652	
+764	Ar1	Argon	89.2957	77.3896	41.6713	
+765	Ar1	Argon	89.2957	77.3896	53.5774	
+766	Ar1	Argon	89.2957	77.3896	65.4835	
+767	Ar1	Argon	89.2957	77.3896	77.3896	
+768	Ar1	Argon	89.2957	77.3896	89.2957	
+769	Ar1	Argon	89.2957	77.3896	101.202	
+770	Ar1	Argon	89.2957	77.3896	113.108	
+771	Ar1	Argon	89.2957	89.2957	5.95304	
+772	Ar1	Argon	89.2957	89.2957	17.8591	
+773	Ar1	Argon	89.2957	89.2957	29.7652	
+774	Ar1	Argon	89.2957	89.2957	41.6713	
+775	Ar1	Argon	89.2957	89.2957	53.5774	
+776	Ar1	Argon	89.2957	89.2957	65.4835	
+777	Ar1	Argon	89.2957	89.2957	77.3896	
+778	Ar1	Argon	89.2957	89.2957	89.2957	
+779	Ar1	Argon	89.2957	89.2957	101.202	
+780	Ar1	Argon	89.2957	89.2957	113.108	
+781	Ar1	Argon	89.2957	101.202	5.95304	
+782	Ar1	Argon	89.2957	101.202	17.8591	
+783	Ar1	Argon	89.2957	101.202	29.7652	
+784	Ar1	Argon	89.2957	101.202	41.6713	
+785	Ar1	Argon	89.2957	101.202	53.5774	
+786	Ar1	Argon	89.2957	101.202	65.4835	
+787	Ar1	Argon	89.2957	101.202	77.3896	
+788	Ar1	Argon	89.2957	101.202	89.2957	
+789	Ar1	Argon	89.2957	101.202	101.202	
+790	Ar1	Argon	89.2957	101.202	113.108	
+791	Ar1	Argon	89.2957	113.108	5.95304	
+792	Ar1	Argon	89.2957	113.108	17.8591	
+793	Ar1	Argon	89.2957	113.108	29.7652	
+794	Ar1	Argon	89.2957	113.108	41.6713	
+795	Ar1	Argon	89.2957	113.108	53.5774	
+796	Ar1	Argon	89.2957	113.108	65.4835	
+797	Ar1	Argon	89.2957	113.108	77.3896	
+798	Ar1	Argon	89.2957	113.108	89.2957	
+799	Ar1	Argon	89.2957	113.108	101.202	
+800	Ar1	Argon	89.2957	113.108	113.108	
+801	Ar1	Argon	101.202	5.95304	5.95304	
+802	Ar1	Argon	101.202	5.95304	17.8591	
+803	Ar1	Argon	101.202	5.95304	29.7652	
+804	Ar1	Argon	101.202	5.95304	41.6713	
+805	Ar1	Argon	101.202	5.95304	53.5774	
+806	Ar1	Argon	101.202	5.95304	65.4835	
+807	Ar1	Argon	101.202	5.95304	77.3896	
+808	Ar1	Argon	101.202	5.95304	89.2957	
+809	Ar1	Argon	101.202	5.95304	101.202	
+810	Ar1	Argon	101.202	5.95304	113.108	
+811	Ar1	Argon	101.202	17.8591	5.95304	
+812	Ar1	Argon	101.202	17.8591	17.8591	
+813	Ar1	Argon	101.202	17.8591	29.7652	
+814	Ar1	Argon	101.202	17.8591	41.6713	
+815	Ar1	Argon	101.202	17.8591	53.5774	
+816	Ar1	Argon	101.202	17.8591	65.4835	
+817	Ar1	Argon	101.202	17.8591	77.3896	
+818	Ar1	Argon	101.202	17.8591	89.2957	
+819	Ar1	Argon	101.202	17.8591	101.202	
+820	Ar1	Argon	101.202	17.8591	113.108	
+821	Ar1	Argon	101.202	29.7652	5.95304	
+822	Ar1	Argon	101.202	29.7652	17.8591	
+823	Ar1	Argon	101.202	29.7652	29.7652	
+824	Ar1	Argon	101.202	29.7652	41.6713	
+825	Ar1	Argon	101.202	29.7652	53.5774	
+826	Ar1	Argon	101.202	29.7652	65.4835	
+827	Ar1	Argon	101.202	29.7652	77.3896	
+828	Ar1	Argon	101.202	29.7652	89.2957	
+829	Ar1	Argon	101.202	29.7652	101.202	
+830	Ar1	Argon	101.202	29.7652	113.108	
+831	Ar1	Argon	101.202	41.6713	5.95304	
+832	Ar1	Argon	101.202	41.6713	17.8591	
+833	Ar1	Argon	101.202	41.6713	29.7652	
+834	Ar1	Argon	101.202	41.6713	41.6713	
+835	Ar1	Argon	101.202	41.6713	53.5774	
+836	Ar1	Argon	101.202	41.6713	65.4835	
+837	Ar1	Argon	101.202	41.6713	77.3896	
+838	Ar1	Argon	101.202	41.6713	89.2957	
+839	Ar1	Argon	101.202	41.6713	101.202	
+840	Ar1	Argon	101.202	41.6713	113.108	
+841	Ar1	Argon	101.202	53.5774	5.95304	
+842	Ar1	Argon	101.202	53.5774	17.8591	
+843	Ar1	Argon	101.202	53.5774	29.7652	
+844	Ar1	Argon	101.202	53.5774	41.6713	
+845	Ar1	Argon	101.202	53.5774	53.5774	
+846	Ar1	Argon	101.202	53.5774	65.4835	
+847	Ar1	Argon	101.202	53.5774	77.3896	
+848	Ar1	Argon	101.202	53.5774	89.2957	
+849	Ar1	Argon	101.202	53.5774	101.202	
+850	Ar1	Argon	101.202	53.5774	113.108	
+851	Ar1	Argon	101.202	65.4835	5.95304	
+852	Ar1	Argon	101.202	65.4835	17.8591	
+853	Ar1	Argon	101.202	65.4835	29.7652	
+854	Ar1	Argon	101.202	65.4835	41.6713	
+855	Ar1	Argon	101.202	65.4835	53.5774	
+856	Ar1	Argon	101.202	65.4835	65.4835	
+857	Ar1	Argon	101.202	65.4835	77.3896	
+858	Ar1	Argon	101.202	65.4835	89.2957	
+859	Ar1	Argon	101.202	65.4835	101.202	
+860	Ar1	Argon	101.202	65.4835	113.108	
+861	Ar1	Argon	101.202	77.3896	5.95304	
+862	Ar1	Argon	101.202	77.3896	17.8591	
+863	Ar1	Argon	101.202	77.3896	29.7652	
+864	Ar1	Argon	101.202	77.3896	41.6713	
+865	Ar1	Argon	101.202	77.3896	53.5774	
+866	Ar1	Argon	101.202	77.3896	65.4835	
+867	Ar1	Argon	101.202	77.3896	77.3896	
+868	Ar1	Argon	101.202	77.3896	89.2957	
+869	Ar1	Argon	101.202	77.3896	101.202	
+870	Ar1	Argon	101.202	77.3896	113.108	
+871	Ar1	Argon	101.202	89.2957	5.95304	
+872	Ar1	Argon	101.202	89.2957	17.8591	
+873	Ar1	Argon	101.202	89.2957	29.7652	
+874	Ar1	Argon	101.202	89.2957	41.6713	
+875	Ar1	Argon	101.202	89.2957	53.5774	
+876	Ar1	Argon	101.202	89.2957	65.4835	
+877	Ar1	Argon	101.202	89.2957	77.3896	
+878	Ar1	Argon	101.202	89.2957	89.2957	
+879	Ar1	Argon	101.202	89.2957	101.202	
+880	Ar1	Argon	101.202	89.2957	113.108	
+881	Ar1	Argon	101.202	101.202	5.95304	
+882	Ar1	Argon	101.202	101.202	17.8591	
+883	Ar1	Argon	101.202	101.202	29.7652	
+884	Ar1	Argon	101.202	101.202	41.6713	
+885	Ar1	Argon	101.202	101.202	53.5774	
+886	Ar1	Argon	101.202	101.202	65.4835	
+887	Ar1	Argon	101.202	101.202	77.3896	
+888	Ar1	Argon	101.202	101.202	89.2957	
+889	Ar1	Argon	101.202	101.202	101.202	
+890	Ar1	Argon	101.202	101.202	113.108	
+891	Ar1	Argon	101.202	113.108	5.95304	
+892	Ar1	Argon	101.202	113.108	17.8591	
+893	Ar1	Argon	101.202	113.108	29.7652	
+894	Ar1	Argon	101.202	113.108	41.6713	
+895	Ar1	Argon	101.202	113.108	53.5774	
+896	Ar1	Argon	101.202	113.108	65.4835	
+897	Ar1	Argon	101.202	113.108	77.3896	
+898	Ar1	Argon	101.202	113.108	89.2957	
+899	Ar1	Argon	101.202	113.108	101.202	
+900	Ar1	Argon	101.202	113.108	113.108	
+901	Ar1	Argon	113.108	5.95304	5.95304	
+902	Ar1	Argon	113.108	5.95304	17.8591	
+903	Ar1	Argon	113.108	5.95304	29.7652	
+904	Ar1	Argon	113.108	5.95304	41.6713	
+905	Ar1	Argon	113.108	5.95304	53.5774	
+906	Ar1	Argon	113.108	5.95304	65.4835	
+907	Ar1	Argon	113.108	5.95304	77.3896	
+908	Ar1	Argon	113.108	5.95304	89.2957	
+909	Ar1	Argon	113.108	5.95304	101.202	
+910	Ar1	Argon	113.108	5.95304	113.108	
+911	Ar1	Argon	113.108	17.8591	5.95304	
+912	Ar1	Argon	113.108	17.8591	17.8591	
+913	Ar1	Argon	113.108	17.8591	29.7652	
+914	Ar1	Argon	113.108	17.8591	41.6713	
+915	Ar1	Argon	113.108	17.8591	53.5774	
+916	Ar1	Argon	113.108	17.8591	65.4835	
+917	Ar1	Argon	113.108	17.8591	77.3896	
+918	Ar1	Argon	113.108	17.8591	89.2957	
+919	Ar1	Argon	113.108	17.8591	101.202	
+920	Ar1	Argon	113.108	17.8591	113.108	
+921	Ar1	Argon	113.108	29.7652	5.95304	
+922	Ar1	Argon	113.108	29.7652	17.8591	
+923	Ar1	Argon	113.108	29.7652	29.7652	
+924	Ar1	Argon	113.108	29.7652	41.6713	
+925	Ar1	Argon	113.108	29.7652	53.5774	
+926	Ar1	Argon	113.108	29.7652	65.4835	
+927	Ar1	Argon	113.108	29.7652	77.3896	
+928	Ar1	Argon	113.108	29.7652	89.2957	
+929	Ar1	Argon	113.108	29.7652	101.202	
+930	Ar1	Argon	113.108	29.7652	113.108	
+931	Ar1	Argon	113.108	41.6713	5.95304	
+932	Ar1	Argon	113.108	41.6713	17.8591	
+933	Ar1	Argon	113.108	41.6713	29.7652	
+934	Ar1	Argon	113.108	41.6713	41.6713	
+935	Ar1	Argon	113.108	41.6713	53.5774	
+936	Ar1	Argon	113.108	41.6713	65.4835	
+937	Ar1	Argon	113.108	41.6713	77.3896	
+938	Ar1	Argon	113.108	41.6713	89.2957	
+939	Ar1	Argon	113.108	41.6713	101.202	
+940	Ar1	Argon	113.108	41.6713	113.108	
+941	Ar1	Argon	113.108	53.5774	5.95304	
+942	Ar1	Argon	113.108	53.5774	17.8591	
+943	Ar1	Argon	113.108	53.5774	29.7652	
+944	Ar1	Argon	113.108	53.5774	41.6713	
+945	Ar1	Argon	113.108	53.5774	53.5774	
+946	Ar1	Argon	113.108	53.5774	65.4835	
+947	Ar1	Argon	113.108	53.5774	77.3896	
+948	Ar1	Argon	113.108	53.5774	89.2957	
+949	Ar1	Argon	113.108	53.5774	101.202	
+950	Ar1	Argon	113.108	53.5774	113.108	
+951	Ar1	Argon	113.108	65.4835	5.95304	
+952	Ar1	Argon	113.108	65.4835	17.8591	
+953	Ar1	Argon	113.108	65.4835	29.7652	
+954	Ar1	Argon	113.108	65.4835	41.6713	
+955	Ar1	Argon	113.108	65.4835	53.5774	
+956	Ar1	Argon	113.108	65.4835	65.4835	
+957	Ar1	Argon	113.108	65.4835	77.3896	
+958	Ar1	Argon	113.108	65.4835	89.2957	
+959	Ar1	Argon	113.108	65.4835	101.202	
+960	Ar1	Argon	113.108	65.4835	113.108	
+961	Ar1	Argon	113.108	77.3896	5.95304	
+962	Ar1	Argon	113.108	77.3896	17.8591	
+963	Ar1	Argon	113.108	77.3896	29.7652	
+964	Ar1	Argon	113.108	77.3896	41.6713	
+965	Ar1	Argon	113.108	77.3896	53.5774	
+966	Ar1	Argon	113.108	77.3896	65.4835	
+967	Ar1	Argon	113.108	77.3896	77.3896	
+968	Ar1	Argon	113.108	77.3896	89.2957	
+969	Ar1	Argon	113.108	77.3896	101.202	
+970	Ar1	Argon	113.108	77.3896	113.108	
+971	Ar1	Argon	113.108	89.2957	5.95304	
+972	Ar1	Argon	113.108	89.2957	17.8591	
+973	Ar1	Argon	113.108	89.2957	29.7652	
+974	Ar1	Argon	113.108	89.2957	41.6713	
+975	Ar1	Argon	113.108	89.2957	53.5774	
+976	Ar1	Argon	113.108	89.2957	65.4835	
+977	Ar1	Argon	113.108	89.2957	77.3896	
+978	Ar1	Argon	113.108	89.2957	89.2957	
+979	Ar1	Argon	113.108	89.2957	101.202	
+980	Ar1	Argon	113.108	89.2957	113.108	
+981	Ar1	Argon	113.108	101.202	5.95304	
+982	Ar1	Argon	113.108	101.202	17.8591	
+983	Ar1	Argon	113.108	101.202	29.7652	
+984	Ar1	Argon	113.108	101.202	41.6713	
+985	Ar1	Argon	113.108	101.202	53.5774	
+986	Ar1	Argon	113.108	101.202	65.4835	
+987	Ar1	Argon	113.108	101.202	77.3896	
+988	Ar1	Argon	113.108	101.202	89.2957	
+989	Ar1	Argon	113.108	101.202	101.202	
+990	Ar1	Argon	113.108	101.202	113.108	
+991	Ar1	Argon	113.108	113.108	5.95304	
+992	Ar1	Argon	113.108	113.108	17.8591	
+993	Ar1	Argon	113.108	113.108	29.7652	
+994	Ar1	Argon	113.108	113.108	41.6713	
+995	Ar1	Argon	113.108	113.108	53.5774	
+996	Ar1	Argon	113.108	113.108	65.4835	
+997	Ar1	Argon	113.108	113.108	77.3896	
+998	Ar1	Argon	113.108	113.108	89.2957	
+999	Ar1	Argon	113.108	113.108	101.202	
+1000	Ar1	Argon	113.108	113.108	113.108	
Index: tests/regression/Python/BoxMaker/post/out.xyz
===================================================================
--- tests/regression/Python/BoxMaker/post/out.xyz	(revision 6c61a977646015caffe230700aebdc01790a832d)
+++ tests/regression/Python/BoxMaker/post/out.xyz	(revision 6c61a977646015caffe230700aebdc01790a832d)
@@ -0,0 +1,1002 @@
+1000
+	Created by molecuilder on Wed Nov  2 00:15:21 2011, time step 0
+Ar	5.95304	5.95304	5.95304
+Ar	5.95304	5.95304	17.8591
+Ar	5.95304	5.95304	29.7652
+Ar	5.95304	5.95304	41.6713
+Ar	5.95304	5.95304	53.5774
+Ar	5.95304	5.95304	65.4835
+Ar	5.95304	5.95304	77.3896
+Ar	5.95304	5.95304	89.2957
+Ar	5.95304	5.95304	101.202
+Ar	5.95304	5.95304	113.108
+Ar	5.95304	17.8591	5.95304
+Ar	5.95304	17.8591	17.8591
+Ar	5.95304	17.8591	29.7652
+Ar	5.95304	17.8591	41.6713
+Ar	5.95304	17.8591	53.5774
+Ar	5.95304	17.8591	65.4835
+Ar	5.95304	17.8591	77.3896
+Ar	5.95304	17.8591	89.2957
+Ar	5.95304	17.8591	101.202
+Ar	5.95304	17.8591	113.108
+Ar	5.95304	29.7652	5.95304
+Ar	5.95304	29.7652	17.8591
+Ar	5.95304	29.7652	29.7652
+Ar	5.95304	29.7652	41.6713
+Ar	5.95304	29.7652	53.5774
+Ar	5.95304	29.7652	65.4835
+Ar	5.95304	29.7652	77.3896
+Ar	5.95304	29.7652	89.2957
+Ar	5.95304	29.7652	101.202
+Ar	5.95304	29.7652	113.108
+Ar	5.95304	41.6713	5.95304
+Ar	5.95304	41.6713	17.8591
+Ar	5.95304	41.6713	29.7652
+Ar	5.95304	41.6713	41.6713
+Ar	5.95304	41.6713	53.5774
+Ar	5.95304	41.6713	65.4835
+Ar	5.95304	41.6713	77.3896
+Ar	5.95304	41.6713	89.2957
+Ar	5.95304	41.6713	101.202
+Ar	5.95304	41.6713	113.108
+Ar	5.95304	53.5774	5.95304
+Ar	5.95304	53.5774	17.8591
+Ar	5.95304	53.5774	29.7652
+Ar	5.95304	53.5774	41.6713
+Ar	5.95304	53.5774	53.5774
+Ar	5.95304	53.5774	65.4835
+Ar	5.95304	53.5774	77.3896
+Ar	5.95304	53.5774	89.2957
+Ar	5.95304	53.5774	101.202
+Ar	5.95304	53.5774	113.108
+Ar	5.95304	65.4835	5.95304
+Ar	5.95304	65.4835	17.8591
+Ar	5.95304	65.4835	29.7652
+Ar	5.95304	65.4835	41.6713
+Ar	5.95304	65.4835	53.5774
+Ar	5.95304	65.4835	65.4835
+Ar	5.95304	65.4835	77.3896
+Ar	5.95304	65.4835	89.2957
+Ar	5.95304	65.4835	101.202
+Ar	5.95304	65.4835	113.108
+Ar	5.95304	77.3896	5.95304
+Ar	5.95304	77.3896	17.8591
+Ar	5.95304	77.3896	29.7652
+Ar	5.95304	77.3896	41.6713
+Ar	5.95304	77.3896	53.5774
+Ar	5.95304	77.3896	65.4835
+Ar	5.95304	77.3896	77.3896
+Ar	5.95304	77.3896	89.2957
+Ar	5.95304	77.3896	101.202
+Ar	5.95304	77.3896	113.108
+Ar	5.95304	89.2957	5.95304
+Ar	5.95304	89.2957	17.8591
+Ar	5.95304	89.2957	29.7652
+Ar	5.95304	89.2957	41.6713
+Ar	5.95304	89.2957	53.5774
+Ar	5.95304	89.2957	65.4835
+Ar	5.95304	89.2957	77.3896
+Ar	5.95304	89.2957	89.2957
+Ar	5.95304	89.2957	101.202
+Ar	5.95304	89.2957	113.108
+Ar	5.95304	101.202	5.95304
+Ar	5.95304	101.202	17.8591
+Ar	5.95304	101.202	29.7652
+Ar	5.95304	101.202	41.6713
+Ar	5.95304	101.202	53.5774
+Ar	5.95304	101.202	65.4835
+Ar	5.95304	101.202	77.3896
+Ar	5.95304	101.202	89.2957
+Ar	5.95304	101.202	101.202
+Ar	5.95304	101.202	113.108
+Ar	5.95304	113.108	5.95304
+Ar	5.95304	113.108	17.8591
+Ar	5.95304	113.108	29.7652
+Ar	5.95304	113.108	41.6713
+Ar	5.95304	113.108	53.5774
+Ar	5.95304	113.108	65.4835
+Ar	5.95304	113.108	77.3896
+Ar	5.95304	113.108	89.2957
+Ar	5.95304	113.108	101.202
+Ar	5.95304	113.108	113.108
+Ar	17.8591	5.95304	5.95304
+Ar	17.8591	5.95304	17.8591
+Ar	17.8591	5.95304	29.7652
+Ar	17.8591	5.95304	41.6713
+Ar	17.8591	5.95304	53.5774
+Ar	17.8591	5.95304	65.4835
+Ar	17.8591	5.95304	77.3896
+Ar	17.8591	5.95304	89.2957
+Ar	17.8591	5.95304	101.202
+Ar	17.8591	5.95304	113.108
+Ar	17.8591	17.8591	5.95304
+Ar	17.8591	17.8591	17.8591
+Ar	17.8591	17.8591	29.7652
+Ar	17.8591	17.8591	41.6713
+Ar	17.8591	17.8591	53.5774
+Ar	17.8591	17.8591	65.4835
+Ar	17.8591	17.8591	77.3896
+Ar	17.8591	17.8591	89.2957
+Ar	17.8591	17.8591	101.202
+Ar	17.8591	17.8591	113.108
+Ar	17.8591	29.7652	5.95304
+Ar	17.8591	29.7652	17.8591
+Ar	17.8591	29.7652	29.7652
+Ar	17.8591	29.7652	41.6713
+Ar	17.8591	29.7652	53.5774
+Ar	17.8591	29.7652	65.4835
+Ar	17.8591	29.7652	77.3896
+Ar	17.8591	29.7652	89.2957
+Ar	17.8591	29.7652	101.202
+Ar	17.8591	29.7652	113.108
+Ar	17.8591	41.6713	5.95304
+Ar	17.8591	41.6713	17.8591
+Ar	17.8591	41.6713	29.7652
+Ar	17.8591	41.6713	41.6713
+Ar	17.8591	41.6713	53.5774
+Ar	17.8591	41.6713	65.4835
+Ar	17.8591	41.6713	77.3896
+Ar	17.8591	41.6713	89.2957
+Ar	17.8591	41.6713	101.202
+Ar	17.8591	41.6713	113.108
+Ar	17.8591	53.5774	5.95304
+Ar	17.8591	53.5774	17.8591
+Ar	17.8591	53.5774	29.7652
+Ar	17.8591	53.5774	41.6713
+Ar	17.8591	53.5774	53.5774
+Ar	17.8591	53.5774	65.4835
+Ar	17.8591	53.5774	77.3896
+Ar	17.8591	53.5774	89.2957
+Ar	17.8591	53.5774	101.202
+Ar	17.8591	53.5774	113.108
+Ar	17.8591	65.4835	5.95304
+Ar	17.8591	65.4835	17.8591
+Ar	17.8591	65.4835	29.7652
+Ar	17.8591	65.4835	41.6713
+Ar	17.8591	65.4835	53.5774
+Ar	17.8591	65.4835	65.4835
+Ar	17.8591	65.4835	77.3896
+Ar	17.8591	65.4835	89.2957
+Ar	17.8591	65.4835	101.202
+Ar	17.8591	65.4835	113.108
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+Ar	17.8591	77.3896	17.8591
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+Ar	17.8591	77.3896	53.5774
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+Ar	17.8591	77.3896	77.3896
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+Ar	89.2957	101.202	65.4835
+Ar	89.2957	101.202	77.3896
+Ar	89.2957	101.202	89.2957
+Ar	89.2957	101.202	101.202
+Ar	89.2957	101.202	113.108
+Ar	89.2957	113.108	5.95304
+Ar	89.2957	113.108	17.8591
+Ar	89.2957	113.108	29.7652
+Ar	89.2957	113.108	41.6713
+Ar	89.2957	113.108	53.5774
+Ar	89.2957	113.108	65.4835
+Ar	89.2957	113.108	77.3896
+Ar	89.2957	113.108	89.2957
+Ar	89.2957	113.108	101.202
+Ar	89.2957	113.108	113.108
+Ar	101.202	5.95304	5.95304
+Ar	101.202	5.95304	17.8591
+Ar	101.202	5.95304	29.7652
+Ar	101.202	5.95304	41.6713
+Ar	101.202	5.95304	53.5774
+Ar	101.202	5.95304	65.4835
+Ar	101.202	5.95304	77.3896
+Ar	101.202	5.95304	89.2957
+Ar	101.202	5.95304	101.202
+Ar	101.202	5.95304	113.108
+Ar	101.202	17.8591	5.95304
+Ar	101.202	17.8591	17.8591
+Ar	101.202	17.8591	29.7652
+Ar	101.202	17.8591	41.6713
+Ar	101.202	17.8591	53.5774
+Ar	101.202	17.8591	65.4835
+Ar	101.202	17.8591	77.3896
+Ar	101.202	17.8591	89.2957
+Ar	101.202	17.8591	101.202
+Ar	101.202	17.8591	113.108
+Ar	101.202	29.7652	5.95304
+Ar	101.202	29.7652	17.8591
+Ar	101.202	29.7652	29.7652
+Ar	101.202	29.7652	41.6713
+Ar	101.202	29.7652	53.5774
+Ar	101.202	29.7652	65.4835
+Ar	101.202	29.7652	77.3896
+Ar	101.202	29.7652	89.2957
+Ar	101.202	29.7652	101.202
+Ar	101.202	29.7652	113.108
+Ar	101.202	41.6713	5.95304
+Ar	101.202	41.6713	17.8591
+Ar	101.202	41.6713	29.7652
+Ar	101.202	41.6713	41.6713
+Ar	101.202	41.6713	53.5774
+Ar	101.202	41.6713	65.4835
+Ar	101.202	41.6713	77.3896
+Ar	101.202	41.6713	89.2957
+Ar	101.202	41.6713	101.202
+Ar	101.202	41.6713	113.108
+Ar	101.202	53.5774	5.95304
+Ar	101.202	53.5774	17.8591
+Ar	101.202	53.5774	29.7652
+Ar	101.202	53.5774	41.6713
+Ar	101.202	53.5774	53.5774
+Ar	101.202	53.5774	65.4835
+Ar	101.202	53.5774	77.3896
+Ar	101.202	53.5774	89.2957
+Ar	101.202	53.5774	101.202
+Ar	101.202	53.5774	113.108
+Ar	101.202	65.4835	5.95304
+Ar	101.202	65.4835	17.8591
+Ar	101.202	65.4835	29.7652
+Ar	101.202	65.4835	41.6713
+Ar	101.202	65.4835	53.5774
+Ar	101.202	65.4835	65.4835
+Ar	101.202	65.4835	77.3896
+Ar	101.202	65.4835	89.2957
+Ar	101.202	65.4835	101.202
+Ar	101.202	65.4835	113.108
+Ar	101.202	77.3896	5.95304
+Ar	101.202	77.3896	17.8591
+Ar	101.202	77.3896	29.7652
+Ar	101.202	77.3896	41.6713
+Ar	101.202	77.3896	53.5774
+Ar	101.202	77.3896	65.4835
+Ar	101.202	77.3896	77.3896
+Ar	101.202	77.3896	89.2957
+Ar	101.202	77.3896	101.202
+Ar	101.202	77.3896	113.108
+Ar	101.202	89.2957	5.95304
+Ar	101.202	89.2957	17.8591
+Ar	101.202	89.2957	29.7652
+Ar	101.202	89.2957	41.6713
+Ar	101.202	89.2957	53.5774
+Ar	101.202	89.2957	65.4835
+Ar	101.202	89.2957	77.3896
+Ar	101.202	89.2957	89.2957
+Ar	101.202	89.2957	101.202
+Ar	101.202	89.2957	113.108
+Ar	101.202	101.202	5.95304
+Ar	101.202	101.202	17.8591
+Ar	101.202	101.202	29.7652
+Ar	101.202	101.202	41.6713
+Ar	101.202	101.202	53.5774
+Ar	101.202	101.202	65.4835
+Ar	101.202	101.202	77.3896
+Ar	101.202	101.202	89.2957
+Ar	101.202	101.202	101.202
+Ar	101.202	101.202	113.108
+Ar	101.202	113.108	5.95304
+Ar	101.202	113.108	17.8591
+Ar	101.202	113.108	29.7652
+Ar	101.202	113.108	41.6713
+Ar	101.202	113.108	53.5774
+Ar	101.202	113.108	65.4835
+Ar	101.202	113.108	77.3896
+Ar	101.202	113.108	89.2957
+Ar	101.202	113.108	101.202
+Ar	101.202	113.108	113.108
+Ar	113.108	5.95304	5.95304
+Ar	113.108	5.95304	17.8591
+Ar	113.108	5.95304	29.7652
+Ar	113.108	5.95304	41.6713
+Ar	113.108	5.95304	53.5774
+Ar	113.108	5.95304	65.4835
+Ar	113.108	5.95304	77.3896
+Ar	113.108	5.95304	89.2957
+Ar	113.108	5.95304	101.202
+Ar	113.108	5.95304	113.108
+Ar	113.108	17.8591	5.95304
+Ar	113.108	17.8591	17.8591
+Ar	113.108	17.8591	29.7652
+Ar	113.108	17.8591	41.6713
+Ar	113.108	17.8591	53.5774
+Ar	113.108	17.8591	65.4835
+Ar	113.108	17.8591	77.3896
+Ar	113.108	17.8591	89.2957
+Ar	113.108	17.8591	101.202
+Ar	113.108	17.8591	113.108
+Ar	113.108	29.7652	5.95304
+Ar	113.108	29.7652	17.8591
+Ar	113.108	29.7652	29.7652
+Ar	113.108	29.7652	41.6713
+Ar	113.108	29.7652	53.5774
+Ar	113.108	29.7652	65.4835
+Ar	113.108	29.7652	77.3896
+Ar	113.108	29.7652	89.2957
+Ar	113.108	29.7652	101.202
+Ar	113.108	29.7652	113.108
+Ar	113.108	41.6713	5.95304
+Ar	113.108	41.6713	17.8591
+Ar	113.108	41.6713	29.7652
+Ar	113.108	41.6713	41.6713
+Ar	113.108	41.6713	53.5774
+Ar	113.108	41.6713	65.4835
+Ar	113.108	41.6713	77.3896
+Ar	113.108	41.6713	89.2957
+Ar	113.108	41.6713	101.202
+Ar	113.108	41.6713	113.108
+Ar	113.108	53.5774	5.95304
+Ar	113.108	53.5774	17.8591
+Ar	113.108	53.5774	29.7652
+Ar	113.108	53.5774	41.6713
+Ar	113.108	53.5774	53.5774
+Ar	113.108	53.5774	65.4835
+Ar	113.108	53.5774	77.3896
+Ar	113.108	53.5774	89.2957
+Ar	113.108	53.5774	101.202
+Ar	113.108	53.5774	113.108
+Ar	113.108	65.4835	5.95304
+Ar	113.108	65.4835	17.8591
+Ar	113.108	65.4835	29.7652
+Ar	113.108	65.4835	41.6713
+Ar	113.108	65.4835	53.5774
+Ar	113.108	65.4835	65.4835
+Ar	113.108	65.4835	77.3896
+Ar	113.108	65.4835	89.2957
+Ar	113.108	65.4835	101.202
+Ar	113.108	65.4835	113.108
+Ar	113.108	77.3896	5.95304
+Ar	113.108	77.3896	17.8591
+Ar	113.108	77.3896	29.7652
+Ar	113.108	77.3896	41.6713
+Ar	113.108	77.3896	53.5774
+Ar	113.108	77.3896	65.4835
+Ar	113.108	77.3896	77.3896
+Ar	113.108	77.3896	89.2957
+Ar	113.108	77.3896	101.202
+Ar	113.108	77.3896	113.108
+Ar	113.108	89.2957	5.95304
+Ar	113.108	89.2957	17.8591
+Ar	113.108	89.2957	29.7652
+Ar	113.108	89.2957	41.6713
+Ar	113.108	89.2957	53.5774
+Ar	113.108	89.2957	65.4835
+Ar	113.108	89.2957	77.3896
+Ar	113.108	89.2957	89.2957
+Ar	113.108	89.2957	101.202
+Ar	113.108	89.2957	113.108
+Ar	113.108	101.202	5.95304
+Ar	113.108	101.202	17.8591
+Ar	113.108	101.202	29.7652
+Ar	113.108	101.202	41.6713
+Ar	113.108	101.202	53.5774
+Ar	113.108	101.202	65.4835
+Ar	113.108	101.202	77.3896
+Ar	113.108	101.202	89.2957
+Ar	113.108	101.202	101.202
+Ar	113.108	101.202	113.108
+Ar	113.108	113.108	5.95304
+Ar	113.108	113.108	17.8591
+Ar	113.108	113.108	29.7652
+Ar	113.108	113.108	41.6713
+Ar	113.108	113.108	53.5774
+Ar	113.108	113.108	65.4835
+Ar	113.108	113.108	77.3896
+Ar	113.108	113.108	89.2957
+Ar	113.108	113.108	101.202
+Ar	113.108	113.108	113.108
Index: tests/regression/Python/BoxMaker/pre/argon.data
===================================================================
--- tests/regression/Python/BoxMaker/pre/argon.data	(revision 6c61a977646015caffe230700aebdc01790a832d)
+++ tests/regression/Python/BoxMaker/pre/argon.data	(revision 6c61a977646015caffe230700aebdc01790a832d)
@@ -0,0 +1,2 @@
+# ATOMDATA	Id	name	type	x=3
+1	Ar1	Argon	0.	0.	0.	
Index: tests/regression/Python/BoxMaker/pre/argon.potentials
===================================================================
--- tests/regression/Python/BoxMaker/pre/argon.potentials	(revision 6c61a977646015caffe230700aebdc01790a832d)
+++ tests/regression/Python/BoxMaker/pre/argon.potentials	(revision 6c61a977646015caffe230700aebdc01790a832d)
@@ -0,0 +1,6 @@
+particles	{
+	particle:	particle_type=Argon,	element_name=Ar,	sigma=1,	epsilon=1,	sigma14=1,	epsilon14=1,	mass=1,	free=3,	charge=0;
+	};
+nonbonded_2body_potentials	{
+	ljspline:	particle_type1=Argon,	particle_type2=Argon,	r_cut=2.3,	r_l=1.9;
+	};
Index: tests/regression/Python/BoxMaker/pre/argon.tremolo
===================================================================
--- tests/regression/Python/BoxMaker/pre/argon.tremolo	(revision 6c61a977646015caffe230700aebdc01790a832d)
+++ tests/regression/Python/BoxMaker/pre/argon.tremolo	(revision 6c61a977646015caffe230700aebdc01790a832d)
@@ -0,0 +1,16 @@
+global: defaultpath="/home/heber/tmp/argon";
+global: projectname="argon";
+global: comment="Argon example";
+global: systemofunits=custom;
+
+
+custom: lengthunit=angstrom;
+custom: lengthscalingfactor=3.4;
+custom: timeunit=ps;
+custom: timescalingfactor=2.17;
+custom: massunit=u;
+custom: massscalingfactor=39.948;
+custom: currentunit="e/s";
+custom: currentscalingfactor=1;
+custom: temperatureunit=K;
+custom: temperaturescalingfactor=120;
Index: tests/regression/Python/BoxMaker/testsuite-python-boxmaker.at
===================================================================
--- tests/regression/Python/BoxMaker/testsuite-python-boxmaker.at	(revision 6c61a977646015caffe230700aebdc01790a832d)
+++ tests/regression/Python/BoxMaker/testsuite-python-boxmaker.at	(revision 6c61a977646015caffe230700aebdc01790a832d)
@@ -0,0 +1,8 @@
+# BoxMaker
+
+AT_SETUP([Python externalization - BoxMaker: argon-filled domain])
+AT_KEYWORDS([python boxmaker])
+AT_CHECK([cp -f ${abs_top_srcdir}/tests/regression/Python/BoxMaker/pre/argon.* .], 0)
+AT_CHECK([../../Python/run ${abs_top_builddir}/utils/boxmaker.py argon source argon.data density 0.001g/cm^3], 0, [stdout], [ignore])
+AT_CHECK([diff -I ".*reated by.*" out.xyz ${abs_top_srcdir}/tests/regression/Python/BoxMaker/post/out.xyz], 0, [ignore], [ignore])
+AT_CLEANUP
Index: tests/regression/Python/testsuite-python.at
===================================================================
--- tests/regression/Python/testsuite-python.at	(revision 54088ade157ccd5da09d83809d019879eb18bca1)
+++ tests/regression/Python/testsuite-python.at	(revision 6c61a977646015caffe230700aebdc01790a832d)
@@ -12,2 +12,5 @@
 # ReturnValueActions
 m4_include([Python/ReturnValueActions/testsuite-python-returnvalueactions.at])
+
+# BoxMaker
+m4_include([Python/BoxMaker/testsuite-python-boxmaker.at])
