id	sid	eid	entity	type
eurjchem-1364	1	1	european journal of chemistry	ORG
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eurjchem-1364	1	3	2	CARDINAL
eurjchem-1364	1	4	2016	CARDINAL
eurjchem-1364	1	5	166‐175	CARDINAL
eurjchem-1364	1	6	2153‐2249	CARDINAL
eurjchem-1364	1	7	2153‐2257	CARDINAL
eurjchem-1364	1	8	2016	CARDINAL
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eurjchem-1364	1	10	the usa http://dx.doi.org/10.5155/eurjchem.7.2.166‐175.1364 european journal of chemistry journal	ORG
eurjchem-1364	1	11	muntadhar abdulbary	ORG
eurjchem-1364	1	12	qhatan adnan yusof department	PERSON
eurjchem-1364	1	13	university of baghdad	ORG
eurjchem-1364	1	14	baghdad	GPE
eurjchem-1364	1	15	00964‐01	DATE
eurjchem-1364	1	16	iraq	GPE
eurjchem-1364	1	17	university of baghdad	ORG
eurjchem-1364	1	18	baghdad	GPE
eurjchem-1364	1	19	00964‐01	DATE
eurjchem-1364	1	20	iraq	GPE
eurjchem-1364	3	1	+964.790.2824400	CARDINAL
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eurjchem-1364	7	4	05 february 2016	CARDINAL
eurjchem-1364	7	5	06	CARDINAL
eurjchem-1364	7	6	february 2016	DATE
eurjchem-1364	7	7	30	CARDINAL
eurjchem-1364	7	8	june 2016	DATE
eurjchem-1364	7	9	30	CARDINAL
eurjchem-1364	8	1	c‐c	ORG
eurjchem-1364	10	1	158.81‐208.90 kcal	QUANTITY
eurjchem-1364	10	2	96.106‐156.976 kcal	QUANTITY
eurjchem-1364	10	3	157.39‐202.34 kcal	QUANTITY
eurjchem-1364	10	4	62.639‐182.423 kcal	QUANTITY
eurjchem-1364	11	1	116‐117 kcal	QUANTITY
eurjchem-1364	12	1	149.75‐161.27	DATE
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eurjchem-1364	14	1	j. chem	ORG
eurjchem-1364	15	1	2016	CARDINAL
eurjchem-1364	15	2	7(2	CARDINAL
eurjchem-1364	15	3	166‐175 1	DATE
eurjchem-1364	19	1	c‐c	ORG
eurjchem-1364	19	2	1	CARDINAL
eurjchem-1364	21	1	2	CARDINAL
eurjchem-1364	21	2	7	CARDINAL
eurjchem-1364	22	1	3	CARDINAL
eurjchem-1364	22	2	h⋅atom	PERSON
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eurjchem-1364	27	1	19,20	CARDINAL
eurjchem-1364	28	1	1	CARDINAL
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eurjchem-1364	29	2	2	CARDINAL
eurjchem-1364	29	3	2016	CARDINAL
eurjchem-1364	29	4	166‐175 167	CARDINAL
eurjchem-1364	29	5	1	CARDINAL
eurjchem-1364	29	6	1	CARDINAL
eurjchem-1364	29	7	ea	CARDINAL
eurjchem-1364	29	8	202.341 kcal/mol	QUANTITY
eurjchem-1364	29	9	79.393 kcal	QUANTITY
eurjchem-1364	29	10	155.974 kcal	QUANTITY
eurjchem-1364	30	1	2	CARDINAL
eurjchem-1364	37	1	24,25	CARDINAL
eurjchem-1364	38	1	26	CARDINAL
eurjchem-1364	39	1	6‐311	CARDINAL
eurjchem-1364	40	1	molek9000	ORG
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eurjchem-1364	41	1	3	CARDINAL
eurjchem-1364	41	2	3.1	CARDINAL
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eurjchem-1364	43	1	nine	CARDINAL
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eurjchem-1364	45	1	202.341 kcal	QUANTITY
eurjchem-1364	46	1	c1h1	ORG
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eurjchem-1364	48	1	2	CARDINAL
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eurjchem-1364	50	1	3.1.1.2	CARDINAL
eurjchem-1364	53	1	3	CARDINAL
eurjchem-1364	53	2	4	CARDINAL
eurjchem-1364	54	1	3.1.1.3	CARDINAL
eurjchem-1364	54	2	5	CARDINAL
eurjchem-1364	54	3	182.369 kcal	QUANTITY
eurjchem-1364	56	1	2	CARDINAL
eurjchem-1364	56	2	c2≡c1	ORG
eurjchem-1364	56	3	1.208	CARDINAL
eurjchem-1364	56	4	6	CARDINAL
eurjchem-1364	56	5	168	CARDINAL
eurjchem-1364	56	6	7	CARDINAL
eurjchem-1364	56	7	2	CARDINAL
eurjchem-1364	56	8	2016	CARDINAL
eurjchem-1364	56	9	166‐175	CARDINAL
eurjchem-1364	56	10	2	CARDINAL
eurjchem-1364	57	1	3	CARDINAL
eurjchem-1364	57	2	ea	CARDINAL
eurjchem-1364	57	3	181.061 kcal	QUANTITY
eurjchem-1364	57	4	136.156 kcal	QUANTITY
eurjchem-1364	57	5	143.008 kcal	QUANTITY
eurjchem-1364	57	6	4	CARDINAL
eurjchem-1364	58	1	7	CARDINAL
eurjchem-1364	58	2	2	CARDINAL
eurjchem-1364	58	3	2016	CARDINAL
eurjchem-1364	59	1	166‐175 169	CARDINAL
eurjchem-1364	59	2	5	CARDINAL
eurjchem-1364	59	3	ea	CARDINAL
eurjchem-1364	59	4	182.369 kcal	QUANTITY
eurjchem-1364	59	5	64.239 kcal	QUANTITY
eurjchem-1364	59	6	140.994 kcal	QUANTITY
eurjchem-1364	59	7	6	CARDINAL
eurjchem-1364	60	1	7	CARDINAL
eurjchem-1364	60	2	ea	CARDINAL
eurjchem-1364	60	3	200.567 kcal	QUANTITY
eurjchem-1364	60	4	78.0412 kcal/mol	QUANTITY
eurjchem-1364	60	5	154.490 kcal	QUANTITY
eurjchem-1364	61	1	200.567 kcal	QUANTITY
eurjchem-1364	61	2	7	CARDINAL
eurjchem-1364	61	3	8	DATE
eurjchem-1364	63	1	c2≡c3	NORP
eurjchem-1364	64	1	1.217	CARDINAL
eurjchem-1364	65	1	170	CARDINAL
eurjchem-1364	65	2	7	CARDINAL
eurjchem-1364	65	3	2	CARDINAL
eurjchem-1364	65	4	2016	CARDINAL
eurjchem-1364	65	5	166‐175	CARDINAL
eurjchem-1364	65	6	8	CARDINAL
eurjchem-1364	66	1	9	CARDINAL
eurjchem-1364	66	2	ea	CARDINAL
eurjchem-1364	66	3	194.503 kcal	QUANTITY
eurjchem-1364	66	4	62.639 kcal	QUANTITY
eurjchem-1364	66	5	158.460 kcal	QUANTITY
eurjchem-1364	67	1	9	CARDINAL
eurjchem-1364	67	2	ea	CARDINAL
eurjchem-1364	67	3	194.503 kcal	QUANTITY
eurjchem-1364	68	1	95 kcal	QUANTITY
eurjchem-1364	69	1	non‐coplanar	DATE
eurjchem-1364	69	2	c2c3c4	ORG
eurjchem-1364	71	1	180.447 kcal	QUANTITY
eurjchem-1364	72	1	130.624 kcal	QUANTITY
eurjchem-1364	72	2	11	CARDINAL
eurjchem-1364	73	1	155 degrees	QUANTITY
eurjchem-1364	74	1	12	CARDINAL
eurjchem-1364	75	1	3.1.1.7	CARDINAL
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eurjchem-1364	76	1	3.1å	CARDINAL
eurjchem-1364	77	1	10	CARDINAL
eurjchem-1364	78	1	13 kcal	QUANTITY
eurjchem-1364	78	2	13	CARDINAL
eurjchem-1364	80	1	14	CARDINAL
eurjchem-1364	82	1	3.7 å	PERCENT
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eurjchem-1364	83	1	2	CARDINAL
eurjchem-1364	83	2	16	CARDINAL
eurjchem-1364	84	1	169.751 kcal	QUANTITY
eurjchem-1364	85	1	c5	ORG
eurjchem-1364	85	2	c9	ORG
eurjchem-1364	86	1	97.296 kcal	QUANTITY
eurjchem-1364	88	1	132.336 kcal	QUANTITY
eurjchem-1364	88	2	7	CARDINAL
eurjchem-1364	88	3	2	CARDINAL
eurjchem-1364	88	4	2016	CARDINAL
eurjchem-1364	89	1	166‐175 171	CARDINAL
eurjchem-1364	89	2	10	CARDINAL
eurjchem-1364	90	1	11	CARDINAL
eurjchem-1364	91	1	180.447 kcal	QUANTITY
eurjchem-1364	91	2	130.624 kcal	QUANTITY
eurjchem-1364	91	3	12	CARDINAL
eurjchem-1364	93	1	17	CARDINAL
eurjchem-1364	93	2	18	CARDINAL
eurjchem-1364	94	1	191.594 kcal	QUANTITY
eurjchem-1364	96	1	182.423 kcal/mol	QUANTITY
eurjchem-1364	97	1	anthracene 3.1.2.1	PERSON
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eurjchem-1364	102	1	172	CARDINAL
eurjchem-1364	102	2	7	CARDINAL
eurjchem-1364	102	3	2	CARDINAL
eurjchem-1364	102	4	2016	CARDINAL
eurjchem-1364	102	5	166‐175	CARDINAL
eurjchem-1364	102	6	13	CARDINAL
eurjchem-1364	103	1	ea	CARDINAL
eurjchem-1364	103	2	157.392 kcal	QUANTITY
eurjchem-1364	103	3	126.671 kcal	QUANTITY
eurjchem-1364	103	4	139.462 kcal	QUANTITY
eurjchem-1364	103	5	14	CARDINAL
eurjchem-1364	105	1	15	CARDINAL
eurjchem-1364	106	1	thec8a‐c9	LOC
eurjchem-1364	106	2	ea	CARDINAL
eurjchem-1364	106	3	169.751 kcal/mol	QUANTITY
eurjchem-1364	106	4	97.2962 kcal	QUANTITY
eurjchem-1364	106	5	132.336 kcal	QUANTITY
eurjchem-1364	107	1	7	CARDINAL
eurjchem-1364	107	2	2	CARDINAL
eurjchem-1364	107	3	2016	CARDINAL
eurjchem-1364	108	1	166‐175 173	CARDINAL
eurjchem-1364	108	2	16	CARDINAL
eurjchem-1364	109	1	c8a‐c9	ORG
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eurjchem-1364	111	1	ea	CARDINAL
eurjchem-1364	111	2	191.594 kcal	QUANTITY
eurjchem-1364	111	3	182.423 kcal/mol	QUANTITY
eurjchem-1364	111	4	18	CARDINAL
eurjchem-1364	113	1	192.507 kcal	QUANTITY
eurjchem-1364	113	2	122.311 kcal	QUANTITY
eurjchem-1364	113	3	116.794 kcal	QUANTITY
eurjchem-1364	114	1	3.1.2.2	DATE
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eurjchem-1364	116	1	7	CARDINAL
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eurjchem-1364	121	2	c1‐c9a	NORP
eurjchem-1364	122	1	158.812 kcal	QUANTITY
eurjchem-1364	122	2	97.717 kcal	QUANTITY
eurjchem-1364	123	1	174	CARDINAL
eurjchem-1364	123	2	7	CARDINAL
eurjchem-1364	123	3	2	CARDINAL
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eurjchem-1364	123	5	166‐175	CARDINAL
eurjchem-1364	123	6	19	CARDINAL
eurjchem-1364	123	7	ea	CARDINAL
eurjchem-1364	123	8	163.197 kcal	QUANTITY
eurjchem-1364	123	9	117.324 kcal	QUANTITY
eurjchem-1364	123	10	20	CARDINAL
eurjchem-1364	124	1	3.6 å	CARDINAL
eurjchem-1364	125	1	3.1.2.4	CARDINAL
eurjchem-1364	126	1	2.5	CARDINAL
eurjchem-1364	128	1	two	CARDINAL
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eurjchem-1364	129	2	156.976 kcal	QUANTITY
eurjchem-1364	129	3	226.887 kcal	QUANTITY
eurjchem-1364	132	1	3.2	CARDINAL
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eurjchem-1364	133	2	116‐117 kcal	QUANTITY
eurjchem-1364	135	1	3.2.1	CARDINAL
eurjchem-1364	135	2	the (s	ORG
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eurjchem-1364	137	1	one	CARDINAL
eurjchem-1364	137	2	1	CARDINAL
eurjchem-1364	138	1	1	CARDINAL
eurjchem-1364	138	2	ea	CARDINAL
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eurjchem-1364	139	1	163.197	CARDINAL
eurjchem-1364	139	2	117.324	CARDINAL
eurjchem-1364	139	3	164.667	CARDINAL
eurjchem-1364	139	4	165.643	CARDINAL
eurjchem-1364	139	5	117.432	CARDINAL
eurjchem-1364	139	6	161.244 4.8 115.539	MONEY
eurjchem-1364	140	1	5	CARDINAL
eurjchem-1364	141	1	~117.0 kcal	FAC
eurjchem-1364	143	1	2	CARDINAL
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eurjchem-1364	143	3	2	CARDINAL
eurjchem-1364	143	4	2016	CARDINAL
eurjchem-1364	144	1	166‐175 175	CARDINAL
eurjchem-1364	144	2	2	CARDINAL
eurjchem-1364	144	3	ea	CARDINAL
eurjchem-1364	144	4	ea	CARDINAL
eurjchem-1364	145	1	ea	CARDINAL
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eurjchem-1364	145	3	3.7	CARDINAL
eurjchem-1364	145	4	4.4 161.270	CARDINAL
eurjchem-1364	145	5	4.1 156.703	CARDINAL
eurjchem-1364	145	6	4.2	CARDINAL
eurjchem-1364	146	1	c‐c	ORG
eurjchem-1364	147	1	ch2	ORG
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eurjchem-1364	152	1	1	CARDINAL
eurjchem-1364	153	1	m.; hadi	PERSON
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eurjchem-1364	159	2	6(2	CARDINAL
eurjchem-1364	159	3	165‐173	CARDINAL
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eurjchem-1364	162	3	113‐124	DATE
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eurjchem-1364	165	2	8	DATE
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eurjchem-1364	169	2	6(3	CARDINAL
eurjchem-1364	169	3	261‐269	CARDINAL
eurjchem-1364	170	1	7	CARDINAL
eurjchem-1364	171	1	dewar	ORG
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eurjchem-1364	177	5	449‐457	DATE
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eurjchem-1364	180	1	11	CARDINAL
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eurjchem-1364	201	1	1999	DATE
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eurjchem-1364	214	2	6	DATE
eurjchem-1364	214	3	4377‐4384	DATE
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eurjchem-1364	218	4	1997	DATE
eurjchem-1364	219	1	21	CARDINAL
eurjchem-1364	219	2	roothaan	GPE
eurjchem-1364	219	3	c. c. j. rev	PERSON
eurjchem-1364	219	4	mod	PERSON
eurjchem-1364	220	1	phys	PERSON
eurjchem-1364	221	1	1951	DATE
eurjchem-1364	221	2	23	DATE
eurjchem-1364	222	1	22	CARDINAL
eurjchem-1364	223	1	kohn	PERSON
eurjchem-1364	223	2	w.	PERSON
eurjchem-1364	223	3	l. j. phys	PERSON
eurjchem-1364	225	1	1965	DATE
eurjchem-1364	225	2	140	CARDINAL
eurjchem-1364	225	3	1133‐1138	DATE
eurjchem-1364	226	1	23	CARDINAL
eurjchem-1364	227	1	hohenberg	PERSON
eurjchem-1364	227	2	kohn	PERSON
eurjchem-1364	227	3	w. phys	PERSON
eurjchem-1364	229	1	1964	DATE
eurjchem-1364	229	2	136	CARDINAL
eurjchem-1364	229	3	864‐871	CARDINAL
eurjchem-1364	230	1	24	CARDINAL
eurjchem-1364	231	1	a. d. phys	PERSON
eurjchem-1364	233	1	1988	DATE
eurjchem-1364	233	2	38	DATE
eurjchem-1364	233	3	3098‐3001	DATE
eurjchem-1364	234	1	25	CARDINAL
eurjchem-1364	235	1	lee	PERSON
eurjchem-1364	235	2	c.; yang	PERSON
eurjchem-1364	235	3	w.; parr	PERSON
eurjchem-1364	235	4	r. g. phys	PERSON
eurjchem-1364	237	1	1988	DATE
eurjchem-1364	237	2	37	DATE
eurjchem-1364	238	1	26	CARDINAL
eurjchem-1364	238	2	m. j.	PERSON
eurjchem-1364	238	3	g. w.	PERSON
eurjchem-1364	238	4	schlegel	ORG
eurjchem-1364	238	5	h. b.	PERSON
eurjchem-1364	238	6	scuseria	GPE
eurjchem-1364	238	7	g. e.	PERSON
eurjchem-1364	238	8	robb	PERSON
eurjchem-1364	238	9	m. a. .	PERSON
eurjchem-1364	238	10	cheeseman	PERSON
eurjchem-1364	238	11	j. r.	PERSON
eurjchem-1364	238	12	montgomery, jr.	ORG
eurjchem-1364	238	13	j. a.	PERSON
eurjchem-1364	238	14	vreven	ORG
eurjchem-1364	238	15	kudin	ORG
eurjchem-1364	238	16	k. n.	PERSON
eurjchem-1364	238	17	j. c.	PERSON
eurjchem-1364	238	18	millam	PERSON
eurjchem-1364	238	19	j. m.	PERSON
eurjchem-1364	238	20	s. s.	PERSON
eurjchem-1364	238	21	tomasi	PERSON
eurjchem-1364	238	22	j.	PERSON
eurjchem-1364	238	23	barone	GPE
eurjchem-1364	238	24	mennucci	PERSON
eurjchem-1364	238	25	b.	PERSON
eurjchem-1364	238	26	cossi	GPE
eurjchem-1364	238	27	m.; scalmani	PERSON
eurjchem-1364	238	28	g.	PERSON
eurjchem-1364	238	29	rega	PERSON
eurjchem-1364	238	30	petersson	GPE
eurjchem-1364	238	31	g. a.	PERSON
eurjchem-1364	238	32	nakatsuji, h.	ORG
eurjchem-1364	238	33	hada	ORG
eurjchem-1364	238	34	m.; ehara, m.; toyota	PERSON
eurjchem-1364	238	35	k.; fukuda	PERSON
eurjchem-1364	238	36	r.	NORP
eurjchem-1364	238	37	hasegawa	PERSON
eurjchem-1364	238	38	j.	PERSON
eurjchem-1364	238	39	nakajima	ORG
eurjchem-1364	238	40	t.	GPE
eurjchem-1364	238	41	honda	ORG
eurjchem-1364	238	42	kitao	PERSON
eurjchem-1364	238	43	nakai, h.; klene	ORG
eurjchem-1364	238	44	m.; li	PERSON
eurjchem-1364	238	45	x.	GPE
eurjchem-1364	238	46	knox	GPE
eurjchem-1364	238	47	j. e.	PERSON
eurjchem-1364	238	48	p. hratchian	PERSON
eurjchem-1364	238	49	j. b.	PERSON
eurjchem-1364	238	50	adamo	GPE
eurjchem-1364	238	51	j.; gomperts	PERSON
eurjchem-1364	238	52	r.	NORP
eurjchem-1364	238	53	stratmann, r. e.; yazyev	GPE
eurjchem-1364	238	54	austin	GPE
eurjchem-1364	238	55	a. j.	PERSON
eurjchem-1364	238	56	cammi	PERSON
eurjchem-1364	238	57	r.	NORP
eurjchem-1364	238	58	j. w.	PERSON
eurjchem-1364	238	59	ayala	GPE
eurjchem-1364	238	60	k.	PERSON
eurjchem-1364	238	61	voth	PERSON
eurjchem-1364	238	62	g. a.	PERSON
eurjchem-1364	238	63	salvador	GPE
eurjchem-1364	238	64	dannenberg	GPE
eurjchem-1364	238	65	j. j.	PERSON
eurjchem-1364	238	66	v. g.	PERSON
eurjchem-1364	238	67	daniels	GPE
eurjchem-1364	238	68	a. d.	PERSON
eurjchem-1364	238	69	m. c.	PERSON
eurjchem-1364	238	70	farkas	ORG
eurjchem-1364	238	71	malick	PERSON
eurjchem-1364	238	72	d. k.	PERSON
eurjchem-1364	238	73	rabuck, a. d.	PERSON
eurjchem-1364	238	74	k.	PERSON
eurjchem-1364	238	75	j. b.	PERSON
eurjchem-1364	238	76	j. v.	PERSON
eurjchem-1364	238	77	q.	PERSON
eurjchem-1364	238	78	baboul	GPE
eurjchem-1364	238	79	a. g.	PERSON
eurjchem-1364	238	80	clifford	ORG
eurjchem-1364	238	81	s.	PERSON
eurjchem-1364	238	82	j.; stefanov	PERSON
eurjchem-1364	238	83	b. b.	PERSON
eurjchem-1364	238	84	liu	PERSON
eurjchem-1364	238	85	a.; piskorz	PERSON
eurjchem-1364	238	86	i.	PERSON
eurjchem-1364	238	87	martin	PERSON
eurjchem-1364	238	88	r. l.	PERSON
eurjchem-1364	238	89	fox	ORG
eurjchem-1364	238	90	d. j.	PERSON
eurjchem-1364	238	91	keith	PERSON
eurjchem-1364	238	92	t.; al‐laham	PERSON
eurjchem-1364	238	93	m. a.	PERSON
eurjchem-1364	238	94	peng	PERSON
eurjchem-1364	238	95	c. y.	PERSON
eurjchem-1364	238	96	nanayakkara, a.	ORG
eurjchem-1364	238	97	m.; gill	PERSON
eurjchem-1364	238	98	m. w.	PERSON
eurjchem-1364	238	99	johnson	PERSON
eurjchem-1364	238	100	b.	PERSON
eurjchem-1364	238	101	chen	PERSON
eurjchem-1364	238	102	w.	PERSON
eurjchem-1364	238	103	wong	GPE
eurjchem-1364	238	104	m. w.	PERSON
eurjchem-1364	238	105	gonzalez	PERSON
eurjchem-1364	238	106	j. a. gaussian, inc.	PERSON
eurjchem-1364	238	107	pittsburgh	GPE
eurjchem-1364	238	108	pa	GPE
eurjchem-1364	238	109	2003	DATE
eurjchem-1364	239	1	27	CARDINAL
eurjchem-1364	240	1	iska	GPE
eurjchem-1364	240	2	bensheim	GPE