id	sid	eid	entity	type
ecletica-1308	1	1	original article	ORG
ecletica-1308	2	1	47	CARDINAL
ecletica-1308	4	1	2022	CARDINAL
ecletica-1308	4	2	39	CARDINAL
ecletica-1308	4	3	eclética química	PERSON
ecletica-1308	5	1	47	CARDINAL
ecletica-1308	5	2	3	CARDINAL
ecletica-1308	5	3	2022	CARDINAL
ecletica-1308	5	4	39	CARDINAL
ecletica-1308	5	5	1678-4618	CARDINAL
ecletica-1308	5	6	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	5	7	dft	ORG
ecletica-1308	6	1	ntui1	PERSON
ecletica-1308	6	2	vincent ndem osabor2	PERSON
ecletica-1308	6	3	peter amba neji1	PERSON
ecletica-1308	6	4	michael akomaye	PERSON
ecletica-1308	6	5	akpe2	NORP
ecletica-1308	6	6	john akwagiobe agwupuye2	PERSON
ecletica-1308	7	1	stephen adie adalikwu3	PERSON
ecletica-1308	7	2	emmanuel gber2	PERSON
ecletica-1308	7	3	andrew2	PERSON
ecletica-1308	7	4	ugbaja2 1	FAC
ecletica-1308	7	5	cross river university of technology	ORG
ecletica-1308	7	6	calabar	GPE
ecletica-1308	7	7	nigeria	GPE
ecletica-1308	8	1	2	CARDINAL
ecletica-1308	8	2	university of calabar-nigeria	ORG
ecletica-1308	8	3	calabar	GPE
ecletica-1308	8	4	nigeria	GPE
ecletica-1308	9	1	3	CARDINAL
ecletica-1308	10	1	john akwagiobe agwupuye	PERSON
ecletica-1308	10	2	november 09, 2021	DATE
ecletica-1308	10	3	may 07	DATE
ecletica-1308	10	4	2022	CARDINAL
ecletica-1308	10	5	july 01	DATE
ecletica-1308	10	6	2022	CARDINAL
ecletica-1308	10	7	1	CARDINAL
ecletica-1308	10	8	dft 2.	ORG
ecletica-1308	10	9	3	CARDINAL
ecletica-1308	11	1	ddt 4	PERSON
ecletica-1308	11	2	gc	ORG
ecletica-1308	13	1	04	CARDINAL
ecletica-1308	14	1	-0.064e	ORG
ecletica-1308	14	2	-0.063e	PERSON
ecletica-1308	15	1	1121.92	CARDINAL
ecletica-1308	15	2	mol–1	PERSON
ecletica-1308	15	3	32.21	CARDINAL
ecletica-1308	15	4	kj	ORG
ecletica-1308	15	5	mol–1	PERSON
ecletica-1308	17	1	https://orcid.org/0000-0002-1798-1058	GPE
ecletica-1308	18	1	40	CARDINAL
ecletica-1308	18	2	eclética química journal	PERSON
ecletica-1308	18	3	47	CARDINAL
ecletica-1308	18	4	3	CARDINAL
ecletica-1308	18	5	2022	CARDINAL
ecletica-1308	18	6	39	CARDINAL
ecletica-1308	18	7	1678-4618	CARDINAL
ecletica-1308	18	8	10.26850/1678-4618eqj.v47.3.2022.p39-52 1	CARDINAL
ecletica-1308	19	1	dft	ORG
ecletica-1308	19	2	41	CARDINAL
ecletica-1308	19	3	41	CARDINAL
ecletica-1308	20	1	al.	GPE
ecletica-1308	20	2	2018	DATE
ecletica-1308	20	3	miao et al.	PERSON
ecletica-1308	20	4	2020	DATE
ecletica-1308	21	1	half	CARDINAL
ecletica-1308	22	1	kowenje	NORP
ecletica-1308	22	2	2013	DATE
ecletica-1308	22	3	2017	DATE
ecletica-1308	23	1	r. zhang et al	PERSON
ecletica-1308	23	2	2021	CARDINAL
ecletica-1308	23	3	2	CARDINAL
ecletica-1308	23	4	2	CARDINAL
ecletica-1308	23	5	dft	ORG
ecletica-1308	24	1	2	CARDINAL
ecletica-1308	24	2	3	CARDINAL
ecletica-1308	24	3	3	CARDINAL
ecletica-1308	24	4	4	CARDINAL
ecletica-1308	24	5	dicofol	PERSON
ecletica-1308	26	1	2020	DATE
ecletica-1308	26	2	311++g(d	CARDINAL
ecletica-1308	26	3	4′-ddt	CARDINAL
ecletica-1308	27	1	dft	ORG
ecletica-1308	27	2	becke-86	DATE
ecletica-1308	27	3	2020	DATE
ecletica-1308	28	1	dft	ORG
ecletica-1308	31	1	three	CARDINAL
ecletica-1308	32	1	2	CARDINAL
ecletica-1308	32	2	2.1	CARDINAL
ecletica-1308	32	3	kbr	PERSON
ecletica-1308	32	4	4000-650	CARDINAL
ecletica-1308	32	5	630	CARDINAL
ecletica-1308	32	6	8	CARDINAL
ecletica-1308	34	1	2.2	CARDINAL
ecletica-1308	35	1	1	CARDINAL
ecletica-1308	36	1	1978	DATE
ecletica-1308	37	1	lee	PERSON
ecletica-1308	37	2	yang parr’s	PERSON
ecletica-1308	37	3	lee et al.	PERSON
ecletica-1308	37	4	1988	DATE
ecletica-1308	37	5	2016	DATE
ecletica-1308	37	6	al.	GPE
ecletica-1308	37	7	2009	DATE
ecletica-1308	38	1	2001	DATE
ecletica-1308	39	1	3.1	CARDINAL
ecletica-1308	40	1	631+g(d	CARDINAL
ecletica-1308	41	1	multiwfn 3.7 dev	ORG
ecletica-1308	41	2	chen	PERSON
ecletica-1308	41	3	2012	DATE
ecletica-1308	43	1	1.9.3	CARDINAL
ecletica-1308	43	2	humphrey et al.	PERSON
ecletica-1308	43	3	1996	DATE
ecletica-1308	44	1	https://revista.iq.unesp.br/index.php/ecletica https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p39-52 original	ORG
ecletica-1308	44	2	41	CARDINAL
ecletica-1308	44	3	eclética química journal	PERSON
ecletica-1308	44	4	47	DATE
ecletica-1308	44	5	2	CARDINAL
ecletica-1308	44	6	2022	CARDINAL
ecletica-1308	44	7	39	CARDINAL
ecletica-1308	44	8	1678-4618	CARDINAL
ecletica-1308	44	9	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	44	10	1	CARDINAL
ecletica-1308	46	1	1.9.3	CARDINAL
ecletica-1308	47	1	3	CARDINAL
ecletica-1308	47	2	3.1	CARDINAL
ecletica-1308	47	3	3.1.1	CARDINAL
ecletica-1308	48	1	al.	PERSON
ecletica-1308	48	2	2021a	DATE
ecletica-1308	49	1	36	CARDINAL
ecletica-1308	49	2	102	CARDINAL
ecletica-1308	50	1	102	CARDINAL
ecletica-1308	50	2	35	CARDINAL
ecletica-1308	50	3	34	CARDINAL
ecletica-1308	50	4	33	CARDINAL
ecletica-1308	51	1	dft	ORG
ecletica-1308	51	2	dft	ORG
ecletica-1308	52	1	dft	ORG
ecletica-1308	53	1	less than one	CARDINAL
ecletica-1308	53	2	0.96	CARDINAL
ecletica-1308	54	1	the dftb3lyp/6-311++g(d	ORG
ecletica-1308	58	1	3500–3200	CARDINAL
ecletica-1308	58	2	2013	DATE
ecletica-1308	59	1	1640–1560 cm–1	MONEY
ecletica-1308	59	2	2013	DATE
ecletica-1308	60	1	3451	DATE
ecletica-1308	60	2	3358	CARDINAL
ecletica-1308	61	1	1640	CARDINAL
ecletica-1308	62	1	3516	DATE
ecletica-1308	62	2	3417	DATE
ecletica-1308	62	3	rnh2	NORP
ecletica-1308	62	4	1628	CARDINAL
ecletica-1308	62	5	n-h	ORG
ecletica-1308	62	6	b3lyp/631++g(d	GPE
ecletica-1308	64	1	1	CARDINAL
ecletica-1308	65	1	https://revista.iq.unesp.br/index.php/ecletica https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p39-52 https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p53-54 https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p53-54 original	ORG
ecletica-1308	65	2	42	CARDINAL
ecletica-1308	65	3	eclética química journal	PERSON
ecletica-1308	65	4	47	CARDINAL
ecletica-1308	65	5	3	CARDINAL
ecletica-1308	65	6	2022	CARDINAL
ecletica-1308	65	7	39	CARDINAL
ecletica-1308	65	8	1678-4618	CARDINAL
ecletica-1308	65	9	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	65	10	1	CARDINAL
ecletica-1308	67	1	𝑰𝑰𝑹	ORG
ecletica-1308	67	2	1 3239 3235	CARDINAL
ecletica-1308	67	3	2.10	CARDINAL
ecletica-1308	67	4	2 800 869 801 100.22	QUANTITY
ecletica-1308	67	5	6 3229	CARDINAL
ecletica-1308	67	6	3100	CARDINAL
ecletica-1308	67	7	7 3220 3091 6.28	DATE
ecletica-1308	67	8	8	CARDINAL
ecletica-1308	67	9	9	CARDINAL
ecletica-1308	67	10	37.66	CARDINAL
ecletica-1308	67	11	𝑣𝑎𝑠𝑦ch(88	GPE
ecletica-1308	67	12	10	CARDINAL
ecletica-1308	67	13	11	CARDINAL
ecletica-1308	67	14	12	CARDINAL
ecletica-1308	67	15	5.87	CARDINAL
ecletica-1308	67	16	13 3180	DATE
ecletica-1308	67	17	17.90	CARDINAL
ecletica-1308	67	18	14 2214 2316	DATE
ecletica-1308	67	19	124.98	TIME
ecletica-1308	67	20	18 1655	CARDINAL
ecletica-1308	67	21	1589 2.85	CARDINAL
ecletica-1308	67	22	19	CARDINAL
ecletica-1308	67	23	1571 1.61	CARDINAL
ecletica-1308	67	24	20	CARDINAL
ecletica-1308	67	25	21	CARDINAL
ecletica-1308	67	26	35.87	CARDINAL
ecletica-1308	67	27	cc(12)+𝛽′ hcc(29	ORG
ecletica-1308	67	28	22	CARDINAL
ecletica-1308	67	29	1497 283.54	CARDINAL
ecletica-1308	67	30	23	CARDINAL
ecletica-1308	67	31	1472 15.54	DATE
ecletica-1308	67	32	𝛽hcc(52)+𝛽ccc(11)	DATE
ecletica-1308	67	33	31	CARDINAL
ecletica-1308	67	34	1311 1311	DATE
ecletica-1308	67	35	32	CARDINAL
ecletica-1308	67	36	33	CARDINAL
ecletica-1308	67	37	37	CARDINAL
ecletica-1308	67	38	49.48	MONEY
ecletica-1308	67	39	38	CARDINAL
ecletica-1308	67	40	39	CARDINAL
ecletica-1308	67	41	hcc(84	DATE
ecletica-1308	67	42	45	CARDINAL
ecletica-1308	67	43	3.47	CARDINAL
ecletica-1308	67	44	46	CARDINAL
ecletica-1308	67	45	991 0.15	CARDINAL
ecletica-1308	67	46	47 1015 974	DATE
ecletica-1308	67	47	49	CARDINAL
ecletica-1308	67	48	0.06	CARDINAL
ecletica-1308	67	49	53	CARDINAL
ecletica-1308	67	50	902 3.85	CARDINAL
ecletica-1308	67	51	64	CARDINAL
ecletica-1308	67	52	65	CARDINAL
ecletica-1308	67	53	66	CARDINAL
ecletica-1308	67	54	67	CARDINAL
ecletica-1308	67	55	𝛽ccc(84	DATE
ecletica-1308	67	56	73	CARDINAL
ecletica-1308	67	57	81	CARDINAL
ecletica-1308	67	58	404 1.41	QUANTITY
ecletica-1308	67	59	82	CARDINAL
ecletica-1308	67	60	419 402 6.33	QUANTITY
ecletica-1308	67	61	89	CARDINAL
ecletica-1308	67	62	263 7.34	CARDINAL
ecletica-1308	67	63	96	CARDINAL
ecletica-1308	67	64	115	CARDINAL
ecletica-1308	67	65	110 0.83	CARDINAL
ecletica-1308	67	66	97	CARDINAL
ecletica-1308	67	67	80 2.98	CARDINAL
ecletica-1308	67	68	98	CARDINAL
ecletica-1308	67	69	4.58	CARDINAL
ecletica-1308	67	70	99	CARDINAL
ecletica-1308	69	1	630	CARDINAL
ecletica-1308	69	2	6.0	CARDINAL
ecletica-1308	70	1	https://revista.iq.unesp.br/index.php/ecletica https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p39-52 original	ORG
ecletica-1308	70	2	43	CARDINAL
ecletica-1308	70	3	eclética química journal	PERSON
ecletica-1308	70	4	47	DATE
ecletica-1308	70	5	2	CARDINAL
ecletica-1308	70	6	2022	CARDINAL
ecletica-1308	70	7	39	CARDINAL
ecletica-1308	70	8	1678-4618	CARDINAL
ecletica-1308	70	9	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	70	10	3300–3000	CARDINAL
ecletica-1308	70	11	2022	CARDINAL
ecletica-1308	71	1	3239	CARDINAL
ecletica-1308	71	2	3106	CARDINAL
ecletica-1308	73	1	1625–1400	CARDINAL
ecletica-1308	73	2	2017	DATE
ecletica-1308	74	1	1607	DATE
ecletica-1308	74	2	1506	CARDINAL
ecletica-1308	74	3	1297	CARDINAL
ecletica-1308	75	1	999	CARDINAL
ecletica-1308	75	2	665	CARDINAL
ecletica-1308	75	3	saminathan et al	PERSON
ecletica-1308	76	1	2021	CARDINAL
ecletica-1308	77	1	731	CARDINAL
ecletica-1308	77	2	690	CARDINAL
ecletica-1308	78	1	1602	CARDINAL
ecletica-1308	78	2	1411	CARDINAL
ecletica-1308	78	3	1286	CARDINAL
ecletica-1308	78	4	1190	CARDINAL
ecletica-1308	78	5	763	CARDINAL
ecletica-1308	78	6	688	CARDINAL
ecletica-1308	80	1	esi	ORG
ecletica-1308	81	1	42.0	CARDINAL
ecletica-1308	81	2	125.0	CARDINAL
ecletica-1308	81	3	81.0	CARDINAL
ecletica-1308	81	4	152.0	CARDINAL
ecletica-1308	81	5	170.0	CARDINAL
ecletica-1308	82	1	53.0	CARDINAL
ecletica-1308	82	2	68.0	CARDINAL
ecletica-1308	82	3	97.0	CARDINAL
ecletica-1308	82	4	108.0	CARDINAL
ecletica-1308	82	5	137.0	CARDINAL
ecletica-1308	83	1	3.2	CARDINAL
ecletica-1308	83	2	two	CARDINAL
ecletica-1308	83	3	quantum	ORG
ecletica-1308	84	1	al.	PERSON
ecletica-1308	84	2	2021b	DATE
ecletica-1308	86	1	two	CARDINAL
ecletica-1308	87	1	2020	DATE
ecletica-1308	90	1	2	CARDINAL
ecletica-1308	90	2	c14	ORG
ecletica-1308	90	3	13.10	CARDINAL
ecletica-1308	90	4	10.84	CARDINAL
ecletica-1308	90	5	12.75	CARDINAL
ecletica-1308	90	6	11.43%	PERCENT
ecletica-1308	91	1	cl25	PRODUCT
ecletica-1308	91	2	cl24	ORG
ecletica-1308	91	3	cl26	FAC
ecletica-1308	92	1	the homo-lumo	ORG
ecletica-1308	93	1	1	CARDINAL
ecletica-1308	93	2	2	CARDINAL
ecletica-1308	94	1	1	CARDINAL
ecletica-1308	94	2	2839.87	CARDINAL
ecletica-1308	94	3	2 dipole moment	QUANTITY
ecletica-1308	94	4	1.04	CARDINAL
ecletica-1308	94	5	6.71	CARDINAL
ecletica-1308	94	6	1.48	CARDINAL
ecletica-1308	94	7	5.23	CARDINAL
ecletica-1308	94	8	6	CARDINAL
ecletica-1308	94	9	7.12	CARDINAL
ecletica-1308	94	10	7 elumo+1	DATE
ecletica-1308	94	11	0.89	CARDINAL
ecletica-1308	95	1	6.23	CARDINAL
ecletica-1308	95	2	9	CARDINAL
ecletica-1308	95	3	η	ORG
ecletica-1308	95	4	2.62 11	CARDINAL
ecletica-1308	95	5	0.19 13	CARDINAL
ecletica-1308	95	6	4.09	CARDINAL
ecletica-1308	96	1	3.3	CARDINAL
ecletica-1308	96	2	al.	PERSON
ecletica-1308	96	3	2021b	DATE
ecletica-1308	97	1	https://revista.iq.unesp.br/index.php/ecletica https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p39-52 https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p53-54 original article	ORG
ecletica-1308	97	2	44	CARDINAL
ecletica-1308	97	3	eclética química	PERSON
ecletica-1308	98	1	47	CARDINAL
ecletica-1308	98	2	3	CARDINAL
ecletica-1308	98	3	2022	CARDINAL
ecletica-1308	98	4	39	CARDINAL
ecletica-1308	98	5	1678-4618	CARDINAL
ecletica-1308	98	6	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	99	1	2014	DATE
ecletica-1308	100	1	second	ORDINAL
ecletica-1308	101	1	non-lewis	ORG
ecletica-1308	101	2	1	CARDINAL
ecletica-1308	101	3	2012	DATE
ecletica-1308	101	4	enudi et al.	GPE
ecletica-1308	101	5	2021	CARDINAL
ecletica-1308	102	1	1	CARDINAL
ecletica-1308	102	2	f(i	GPE
ecletica-1308	104	1	al.	PERSON
ecletica-1308	104	2	2021c	DATE
ecletica-1308	105	1	3	CARDINAL
ecletica-1308	105	2	1122	CARDINAL
ecletica-1308	105	3	mol–1	PERSON
ecletica-1308	105	4	32	CARDINAL
ecletica-1308	105	5	3	CARDINAL
ecletica-1308	105	6	second	ORDINAL
ecletica-1308	107	1	1	CARDINAL
ecletica-1308	107	2	268.21 0.01	MONEY
ecletica-1308	107	3	0.094 2 π*c9	QUANTITY
ecletica-1308	107	4	255.27 0.01	CARDINAL
ecletica-1308	107	5	3	CARDINAL
ecletica-1308	107	6	c21 π*c15	ORG
ecletica-1308	107	7	218.48	CARDINAL
ecletica-1308	107	8	0.01	MONEY
ecletica-1308	107	9	184.74	CARDINAL
ecletica-1308	107	10	21.57	CARDINAL
ecletica-1308	107	11	0.069 6	CARDINAL
ecletica-1308	107	12	π*c15	ORG
ecletica-1308	107	13	20.49 0.27	CARDINAL
ecletica-1308	107	14	c21 π*c15	ORG
ecletica-1308	107	15	19.58	CARDINAL
ecletica-1308	107	16	18.99	CARDINAL
ecletica-1308	107	17	12.28	CARDINAL
ecletica-1308	107	18	πpc26 𝜎c1	PERSON
ecletica-1308	108	1	3.1	CARDINAL
ecletica-1308	109	1	3.4	CARDINAL
ecletica-1308	110	1	al.	PERSON
ecletica-1308	110	2	2021a	DATE
ecletica-1308	112	1	2	CARDINAL
ecletica-1308	112	2	-0.063e	PERSON
ecletica-1308	114	1	2	CARDINAL
ecletica-1308	117	1	https://revista.iq.unesp.br/index.php/ecletica https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p39-52 original	ORG
ecletica-1308	117	2	45	CARDINAL
ecletica-1308	117	3	eclética química journal	PERSON
ecletica-1308	117	4	47	CARDINAL
ecletica-1308	117	5	3	CARDINAL
ecletica-1308	117	6	2022	CARDINAL
ecletica-1308	117	7	39	CARDINAL
ecletica-1308	117	8	1678-4618	CARDINAL
ecletica-1308	117	9	10.26850/1678-4618eqj.v47.3.2022.p39-52 3.5	CARDINAL
ecletica-1308	118	1	4	CARDINAL
ecletica-1308	118	2	5	DATE
ecletica-1308	119	1	5.34	CARDINAL
ecletica-1308	119	2	5.37	CARDINAL
ecletica-1308	119	3	232	CARDINAL
ecletica-1308	119	4	230	CARDINAL
ecletica-1308	120	1	21.39%	PERCENT
ecletica-1308	120	2	89	CARDINAL
ecletica-1308	120	3	lumo+2	DATE
ecletica-1308	120	4	91	CARDINAL
ecletica-1308	122	1	4	CARDINAL
ecletica-1308	123	1	ev λ(nm	PERSON
ecletica-1308	123	2	0.0104 89 →91	MONEY
ecletica-1308	123	3	21.39%	PERCENT
ecletica-1308	124	1	86	CARDINAL
ecletica-1308	124	2	11.49%	PERCENT
ecletica-1308	124	3	89	CARDINAL
ecletica-1308	124	4	10.05%	PERCENT
ecletica-1308	124	5	5.3601	CARDINAL
ecletica-1308	124	6	231.31	MONEY
ecletica-1308	124	7	20.00%	PERCENT
ecletica-1308	125	1	89	CARDINAL
ecletica-1308	125	2	17.02%	PERCENT
ecletica-1308	125	3	89	CARDINAL
ecletica-1308	125	4	10.88%	PERCENT
ecletica-1308	125	5	5.6127 220.90	MONEY
ecletica-1308	125	6	71.58%	PERCENT
ecletica-1308	126	1	89	CARDINAL
ecletica-1308	126	2	5.40%	PERCENT
ecletica-1308	126	3	88	CARDINAL
ecletica-1308	126	4	3.15%	PERCENT
ecletica-1308	126	5	s0→s4	ORG
ecletica-1308	126	6	45.09%	PERCENT
ecletica-1308	127	1	89	CARDINAL
ecletica-1308	127	2	11.36%	PERCENT
ecletica-1308	127	3	89	CARDINAL
ecletica-1308	127	4	11.03%	PERCENT
ecletica-1308	127	5	0.0537 89 →91	MONEY
ecletica-1308	127	6	26.72%	PERCENT
ecletica-1308	128	1	85	CARDINAL
ecletica-1308	128	2	14.31%	PERCENT
ecletica-1308	128	3	89	CARDINAL
ecletica-1308	128	4	10.08%	PERCENT
ecletica-1308	128	5	dft/b3lyp/6311+g(d	ORG
ecletica-1308	129	1	0.0207	CARDINAL
ecletica-1308	130	1	12.66	CARDINAL
ecletica-1308	130	2	12.93%	PERCENT
ecletica-1308	131	1	fifth	ORDINAL
ecletica-1308	131	2	first	ORDINAL
ecletica-1308	132	1	5	CARDINAL
ecletica-1308	133	1	ev λ(nm	PERSON
ecletica-1308	133	2	230.75 0.0207 89 →91	MONEY
ecletica-1308	133	3	13.18%	PERCENT
ecletica-1308	134	1	π → π*	ORG
ecletica-1308	134	2	89	CARDINAL
ecletica-1308	134	3	12.66%	PERCENT
ecletica-1308	134	4	89	CARDINAL
ecletica-1308	134	5	12.93%	PERCENT
ecletica-1308	135	1	5.3794 230.48	MONEY
ecletica-1308	135	2	100.46%	PERCENT
ecletica-1308	135	3	89	CARDINAL
ecletica-1308	135	4	16.56%	PERCENT
ecletica-1308	135	5	88	CARDINAL
ecletica-1308	135	6	9.31%	PERCENT
ecletica-1308	135	7	5.5677 222.69	MONEY
ecletica-1308	135	8	70.20%	PERCENT
ecletica-1308	136	1	88	CARDINAL
ecletica-1308	136	2	4.00%	PERCENT
ecletica-1308	136	3	89	CARDINAL
ecletica-1308	136	4	3.71%	PERCENT
ecletica-1308	136	5	s0→s4	ORG
ecletica-1308	136	6	5.9995	MONEY
ecletica-1308	136	7	47.5859	CARDINAL
ecletica-1308	137	1	89	CARDINAL
ecletica-1308	137	2	10.30%	PERCENT
ecletica-1308	137	3	88	CARDINAL
ecletica-1308	137	4	6.76%	PERCENT
ecletica-1308	137	5	0.1008 89 →92	MONEY
ecletica-1308	137	6	44.37%	PERCENT
ecletica-1308	138	1	89	CARDINAL
ecletica-1308	138	2	10.82%	PERCENT
ecletica-1308	138	3	89	CARDINAL
ecletica-1308	138	4	5.35%	PERCENT
ecletica-1308	138	5	multiwfn	ORG
ecletica-1308	139	1	https://revista.iq.unesp.br/index.php/ecletica https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p39-52 original	ORG
ecletica-1308	139	2	46	CARDINAL
ecletica-1308	139	3	eclética química	PERSON
ecletica-1308	139	4	47	CARDINAL
ecletica-1308	139	5	3	CARDINAL
ecletica-1308	139	6	2022	CARDINAL
ecletica-1308	139	7	39	CARDINAL
ecletica-1308	139	8	1678-4618	CARDINAL
ecletica-1308	139	9	10.26850/1678-4618eqj.v47.3.2022.p39-52 3.6	CARDINAL
ecletica-1308	142	1	3	CARDINAL
ecletica-1308	142	2	3.7	CARDINAL
ecletica-1308	144	1	multiwfn	PERSON
ecletica-1308	145	1	4	CARDINAL
ecletica-1308	145	2	liu et al.	PERSON
ecletica-1308	145	3	2020	DATE
ecletica-1308	146	1	3	CARDINAL
ecletica-1308	149	1	1.9.3	CARDINAL
ecletica-1308	150	1	4	CARDINAL
ecletica-1308	152	1	https://revista.iq.unesp.br/index.php/ecletica https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p39-52 original	ORG
ecletica-1308	152	2	47	CARDINAL
ecletica-1308	152	3	eclética química	PERSON
ecletica-1308	152	4	47	CARDINAL
ecletica-1308	152	5	3	CARDINAL
ecletica-1308	152	6	2022	CARDINAL
ecletica-1308	152	7	39	CARDINAL
ecletica-1308	152	8	1678-4618	CARDINAL
ecletica-1308	152	9	10.26850/1678-4618eqj.v47.3.2022.p39-52 3.8	CARDINAL
ecletica-1308	153	1	2010	DATE
ecletica-1308	155	1	y. zhang	PERSON
ecletica-1308	155	2	wang	PERSON
ecletica-1308	155	3	2017	DATE
ecletica-1308	156	1	𝜋 −	PERSON
ecletica-1308	156	2	prasad	NORP
ecletica-1308	156	3	ulrich	GPE
ecletica-1308	156	4	2012	DATE
ecletica-1308	157	1	taylor	PERSON
ecletica-1308	158	1	2	CARDINAL
ecletica-1308	159	1	+ 𝑎𝑖𝑗𝐸𝑗	MONEY
ecletica-1308	161	1	+ 1 3	DATE
ecletica-1308	162	1	𝛾𝑖𝑗𝑘𝑙𝐸𝑗𝐸𝑘𝐸𝑙 +	GPE
ecletica-1308	162	2	𝐸𝑖	PERSON
ecletica-1308	162	3	zero	CARDINAL
ecletica-1308	162	4	𝛼𝑖𝑗	CARDINAL
ecletica-1308	162	5	first	ORDINAL
ecletica-1308	162	6	second	ORDINAL
ecletica-1308	163	1	3	CARDINAL
ecletica-1308	163	2	4	CARDINAL
ecletica-1308	163	3	2 +	CARDINAL
ecletica-1308	163	4	2	CARDINAL
ecletica-1308	163	5	3	CARDINAL
ecletica-1308	163	6	𝛼𝑥𝑥+𝛼𝑦𝑦+𝛼𝑧𝑧 3 (	ORG
ecletica-1308	163	7	4	CARDINAL
ecletica-1308	164	1	2	CARDINAL
ecletica-1308	164	2	1 2⁄	CARDINAL
ecletica-1308	166	1	2	CARDINAL
ecletica-1308	167	1	− 𝛼𝑥𝑥)2	PERSON
ecletica-1308	167	2	1 2⁄	CARDINAL
ecletica-1308	167	3	5	CARDINAL
ecletica-1308	167	4	first	ORDINAL
ecletica-1308	167	5	3rd	ORDINAL
ecletica-1308	167	6	3	CARDINAL
ecletica-1308	168	1	first	ORDINAL
ecletica-1308	168	2	6	CARDINAL
ecletica-1308	168	3	2 + 𝛽2	MONEY
ecletica-1308	168	4	2	CARDINAL
ecletica-1308	168	5	6	CARDINAL
ecletica-1308	168	6	1 3 ∑	CARDINAL
ecletica-1308	168	7	3	CARDINAL
ecletica-1308	168	8	z.	PERSON
ecletica-1308	168	9	2007	DATE
ecletica-1308	169	1	6	CARDINAL
ecletica-1308	169	2	311 + g(d	QUANTITY
ecletica-1308	170	1	6	CARDINAL
ecletica-1308	170	2	6	CARDINAL
ecletica-1308	171	1	first	ORDINAL
ecletica-1308	171	2	311+g(d	CARDINAL
ecletica-1308	172	1	0.355	CARDINAL
ecletica-1308	172	2	0.204	CARDINAL
ecletica-1308	172	3	0.002	CARDINAL
ecletica-1308	172	4	0.410	CARDINAL
ecletica-1308	172	5	171.175	CARDINAL
ecletica-1308	172	6	159.84	CARDINAL
ecletica-1308	172	7	0.811 αyz 2.334	QUANTITY
ecletica-1308	172	8	255.023	CARDINAL
ecletica-1308	172	9	88.786	CARDINAL
ecletica-1308	172	10	537.319	CARDINAL
ecletica-1308	172	11	26.884	CARDINAL
ecletica-1308	172	12	11.862	CARDINAL
ecletica-1308	172	13	65.056	CARDINAL
ecletica-1308	172	14	165.703	CARDINAL
ecletica-1308	172	15	2.624	CARDINAL
ecletica-1308	172	16	17.599	CARDINAL
ecletica-1308	172	17	1355.432	CARDINAL
ecletica-1308	172	18	355.432	CARDINAL
ecletica-1308	172	19	597.706	CARDINAL
ecletica-1308	172	20	311+g(d	CARDINAL
ecletica-1308	172	21	multiwfn	PERSON
ecletica-1308	173	1	3.9	CARDINAL
ecletica-1308	173	2	48	CARDINAL
ecletica-1308	173	3	eclética química	PERSON
ecletica-1308	174	1	47	CARDINAL
ecletica-1308	174	2	3	CARDINAL
ecletica-1308	174	3	2022	CARDINAL
ecletica-1308	174	4	39	CARDINAL
ecletica-1308	174	5	1678-4618	CARDINAL
ecletica-1308	174	6	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	174	7	1r5k	ORDINAL
ecletica-1308	174	8	1err	CARDINAL
ecletica-1308	174	9	2bj4	CARDINAL
ecletica-1308	174	10	3ert	CARDINAL
ecletica-1308	175	1	09	CARDINAL
ecletica-1308	175	2	2018	DATE
ecletica-1308	176	1	lu	ORG
ecletica-1308	176	2	2017	DATE
ecletica-1308	177	1	ghoshal	ORG
ecletica-1308	177	2	2008	DATE
ecletica-1308	183	1	2017	DATE
ecletica-1308	184	1	2d	DATE
ecletica-1308	184	2	3d	CARDINAL
ecletica-1308	185	1	34	CARDINAL
ecletica-1308	185	2	26	CARDINAL
ecletica-1308	185	3	25	CARDINAL
ecletica-1308	185	4	32	CARDINAL
ecletica-1308	185	5	1err	CARDINAL
ecletica-1308	185	6	1r5kddt	DATE
ecletica-1308	185	7	2bj4	CARDINAL
ecletica-1308	185	8	3ert	DATE
ecletica-1308	187	1	5a	CARDINAL
ecletica-1308	187	2	5b	CARDINAL
ecletica-1308	187	3	1err	CARDINAL
ecletica-1308	188	1	3d	CARDINAL
ecletica-1308	189	1	5b	CARDINAL
ecletica-1308	191	1	2019	DATE
ecletica-1308	192	1	yang et al.	PERSON
ecletica-1308	192	2	2010	DATE
ecletica-1308	193	1	1err	CARDINAL
ecletica-1308	193	2	1r5k	DATE
ecletica-1308	193	3	2bj4	CARDINAL
ecletica-1308	193	4	3ert	CARDINAL
ecletica-1308	193	5	first	ORDINAL
ecletica-1308	194	1	7	CARDINAL
ecletica-1308	194	2	7	CARDINAL
ecletica-1308	196	1	kj mol-1	ORG
ecletica-1308	196	2	1err	CARDINAL
ecletica-1308	196	3	33.9	CARDINAL
ecletica-1308	196	4	25.9	CARDINAL
ecletica-1308	196	5	25.1	CARDINAL
ecletica-1308	196	6	32.2	CARDINAL
ecletica-1308	197	1	https://revista.iq.unesp.br/index.php/ecletica https://doi.org/10.26850/1678-4618eqj.v47.3.2022.p39-52 original	ORG
ecletica-1308	197	2	49	CARDINAL
ecletica-1308	197	3	eclética química	PERSON
ecletica-1308	197	4	47	CARDINAL
ecletica-1308	197	5	3	CARDINAL
ecletica-1308	197	6	2022	CARDINAL
ecletica-1308	197	7	39	CARDINAL
ecletica-1308	197	8	1678-4618	CARDINAL
ecletica-1308	197	9	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	197	10	5	CARDINAL
ecletica-1308	197	11	3d	CARDINAL
ecletica-1308	198	1	4.	CARDINAL
ecletica-1308	198	2	gc	ORG
ecletica-1308	199	1	6	CARDINAL
ecletica-1308	202	1	50	CARDINAL
ecletica-1308	202	2	eclética química journal	PERSON
ecletica-1308	203	1	47	CARDINAL
ecletica-1308	203	2	3	CARDINAL
ecletica-1308	203	3	2022	CARDINAL
ecletica-1308	203	4	39	CARDINAL
ecletica-1308	203	5	1678-4618	CARDINAL
ecletica-1308	203	6	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	204	1	multiwfn	PERSON
ecletica-1308	204	2	c14	ORG
ecletica-1308	204	3	13.10	CARDINAL
ecletica-1308	204	4	10.84	CARDINAL
ecletica-1308	204	5	12.75	CARDINAL
ecletica-1308	204	6	11.43%	PERCENT
ecletica-1308	205	1	cl25	PRODUCT
ecletica-1308	205	2	cl24	ORG
ecletica-1308	205	3	cl26	FAC
ecletica-1308	206	1	1122	CARDINAL
ecletica-1308	206	2	32	CARDINAL
ecletica-1308	207	1	0.284	CARDINAL
ecletica-1308	207	2	0.064	CARDINAL
ecletica-1308	207	3	0.063e	CARDINAL
ecletica-1308	209	1	fifth	ORDINAL
ecletica-1308	209	2	s0→s1	ORG
ecletica-1308	211	1	n. ntui	PERSON
ecletica-1308	211	2	john a. agwupuye	PERSON
ecletica-1308	211	3	terkumbur e. gber	PERSON
ecletica-1308	211	4	stephen a. adalikwu	PERSON
ecletica-1308	211	5	michael a. akpe	PERSON
ecletica-1308	211	6	john a. agwupuye	PERSON
ecletica-1308	211	7	tabe n. ntui	ORG
ecletica-1308	212	1	michael a. akpe	PERSON
ecletica-1308	212	2	bitrus h andrew	ORG
ecletica-1308	212	3	terkumbur e. gber	PERSON
ecletica-1308	212	4	john a. agwupuye	PERSON
ecletica-1308	212	5	john a. agwupuye	PERSON
ecletica-1308	212	6	tabe n. ntui	ORG
ecletica-1308	212	7	vincent n. osabor	PERSON
ecletica-1308	212	8	peter a. neji	PERSON
ecletica-1308	212	9	john a. agwupuye	PERSON
ecletica-1308	212	10	michael a. akpe	PERSON
ecletica-1308	212	11	stephen a. adalikwu	PERSON
ecletica-1308	213	1	terkumbur e. gber	PERSON
ecletica-1308	213	2	john a. agwupuye	PERSON
ecletica-1308	213	3	n. ntui	PERSON
ecletica-1308	213	4	vincent n. osabor	PERSON
ecletica-1308	213	5	peter a.	PERSON
ecletica-1308	213	6	john a. agwupuye	PERSON
ecletica-1308	213	7	terkumbur e. gber	PERSON
ecletica-1308	213	8	john a. agwupuye	PERSON
ecletica-1308	213	9	terkumbur e. gber	PERSON
ecletica-1308	213	10	john a. agwupuye	PERSON
ecletica-1308	213	11	usman dan fodio university	ORG
ecletica-1308	213	12	sokoto	GPE
ecletica-1308	213	13	nigeria	GPE
ecletica-1308	213	14	dft	ORG
ecletica-1308	213	15	multiwfn 3.7	ORG
ecletica-1308	215	1	tabe ntui	PERSON
ecletica-1308	215	2	peter	PERSON
ecletica-1308	216	1	j. a.	PERSON
ecletica-1308	216	2	louis, h.	ORG
ecletica-1308	216	3	enudi	LANGUAGE
ecletica-1308	216	4	o. c.	PERSON
ecletica-1308	216	5	edim	ORG
ecletica-1308	216	6	m. m.	PERSON
ecletica-1308	216	7	heteroatom	PERSON
ecletica-1308	216	8	doped cyclooctane	PERSON
ecletica-1308	219	1	2021a	DATE
ecletica-1308	219	2	275, 125239	DATE
ecletica-1308	220	1	https://doi.org/10.1016/j.matchemphys.2021.125239 agwupuye	PERSON
ecletica-1308	220	2	j. a.	PERSON
ecletica-1308	220	3	louis, h.	ORG
ecletica-1308	220	4	david	PERSON
ecletica-1308	220	5	ubana	GPE
ecletica-1308	220	6	e. i.	PERSON
ecletica-1308	221	1	j. mol.	PERSON
ecletica-1308	222	1	337	CARDINAL
ecletica-1308	222	2	116458	DATE
ecletica-1308	223	1	j. a.	PERSON
ecletica-1308	223	2	p. a.	PERSON
ecletica-1308	223	3	louis, h.	ORG
ecletica-1308	223	4	j. o.	PERSON
ecletica-1308	223	5	bisiong, e. a.	ORG
ecletica-1308	223	6	ntui	ORG
ecletica-1308	223	7	t. n.	ORG
ecletica-1308	225	1	2021c	DATE
ecletica-1308	225	2	7	CARDINAL
ecletica-1308	225	3	7	CARDINAL
ecletica-1308	226	1	s.	PERSON
ecletica-1308	226	2	s. j.	PERSON
ecletica-1308	226	3	šetrajčić	GPE
ecletica-1308	226	4	j. p.	PERSON
ecletica-1308	226	5	šetrajčić	GPE
ecletica-1308	226	6	i. j.	PERSON
ecletica-1308	226	7	https://doi.org/10.1016/j.matchemphys.2021.125239	GPE
ecletica-1308	226	8	https://doi.org/10.1016/j.matchemphys.2021.125239	GPE
ecletica-1308	226	9	https://doi.org/10.1016/j.matchemphys.2021.125239	GPE
ecletica-1308	226	10	https://doi.org/10.1016/j.molliq.2021.116458	PRODUCT
ecletica-1308	226	11	https://doi.org/10.1016/j.molliq.2021.116458	PRODUCT
ecletica-1308	226	12	https://doi.org/10.1016/j.molliq.2021.116458	PRODUCT
ecletica-1308	226	13	https://doi.org/10.1016/j.molliq.2021.116458	PRODUCT
ecletica-1308	226	14	51	CARDINAL
ecletica-1308	226	15	eclética química journal	PERSON
ecletica-1308	227	1	47	CARDINAL
ecletica-1308	227	2	3	CARDINAL
ecletica-1308	227	3	2022	CARDINAL
ecletica-1308	227	4	39	CARDINAL
ecletica-1308	227	5	1678-4618	CARDINAL
ecletica-1308	227	6	10.26850/1678-4618eqj.v47.3.2022.p39-52	CARDINAL
ecletica-1308	228	1	j. mol.	PERSON
ecletica-1308	229	1	2012	DATE
ecletica-1308	229	2	18	CARDINAL
ecletica-1308	229	3	9	CARDINAL
ecletica-1308	229	4	4491–4501	CARDINAL
ecletica-1308	230	1	barnes k.	PERSON
ecletica-1308	233	1	2019	DATE
ecletica-1308	234	1	2022	CARDINAL
ecletica-1308	235	1	bassey	PERSON
ecletica-1308	235	2	v. m.; apebende	PERSON
ecletica-1308	235	3	c. g.	PERSON
ecletica-1308	235	4	p. s.	PERSON
ecletica-1308	235	5	louis, h.	ORG
ecletica-1308	235	6	w.	PERSON
ecletica-1308	235	7	cheng	GPE
ecletica-1308	235	8	c. r.	PERSON
ecletica-1308	235	9	asogwa	GPE
ecletica-1308	235	10	f. c. vibrational characterization	PERSON
ecletica-1308	235	11	2acetyl-5-methylfuran	TIME
ecletica-1308	236	1	j. fluoresc	PERSON
ecletica-1308	236	2	2022	CARDINAL
ecletica-1308	236	3	32	CARDINAL
ecletica-1308	236	4	3	CARDINAL
ecletica-1308	236	5	1005	CARDINAL
ecletica-1308	236	6	1017	CARDINAL
ecletica-1308	237	1	https://doi.org/10.1007/s10895-022-02903-8 bhuvaneswari	PERSON
ecletica-1308	237	2	r.	NORP
ecletica-1308	237	3	nagarajan	GPE
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ecletica-1308	240	1	lett	PERSON
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ecletica-1308	241	2	757	CARDINAL
ecletica-1308	241	3	137895	DATE
ecletica-1308	242	1	https://doi.org/10.1016/j.cplett.2020.137895 buah-kwofie	PERSON
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ecletica-1308	244	2	621	CARDINAL
ecletica-1308	244	3	273–281	CARDINAL
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ecletica-1308	248	8	e. a.	PERSON
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ecletica-1308	249	1	dft	ORG
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ecletica-1308	251	3	7	CARDINAL
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ecletica-1308	252	6	g. e.	PERSON
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ecletica-1308	252	16	g. a.	PERSON
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ecletica-1308	253	7	a. f.	PERSON
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ecletica-1308	253	48	j. b.	PERSON
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ecletica-1308	253	67	a. d.	PERSON
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ecletica-1308	254	3	2009	DATE
ecletica-1308	255	1	glendening	PERSON
ecletica-1308	255	2	e. d.	PERSON
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ecletica-1308	271	3	126964	DATE
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ecletica-1308	279	2	1206	DATE
ecletica-1308	279	3	127755	DATE
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ecletica-1308	286	2	37	CARDINAL
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ecletica-1308	286	4	785–789	CARDINAL
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ecletica-1308	291	2	33	DATE
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ecletica-1308	300	1	https://nbo7.chem.wisc.edu/biblio_css.htm	PRODUCT
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ecletica-1308	310	2	1095	DATE
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ecletica-1308	337	1	2017	DATE
ecletica-1308	337	2	7	DATE
ecletica-1308	337	3	4	CARDINAL
ecletica-1308	338	1	https://doi.org/10.4172/21610398.1000259 yang	PERSON
ecletica-1308	338	2	w. h.	PERSON
ecletica-1308	338	3	wang	ORG
ecletica-1308	338	4	z. y.	PERSON
ecletica-1308	338	5	liu	PERSON
ecletica-1308	338	6	h. l.	PERSON
ecletica-1308	338	7	h. x.	PERSON
ecletica-1308	338	8	diphenyl	PERSON
ecletica-1308	341	1	2010	DATE
ecletica-1308	341	2	21	DATE
ecletica-1308	341	3	351–367	CARDINAL
ecletica-1308	342	1	y.-x	GPE
ecletica-1308	342	2	wang, y.-h.	PERSON
ecletica-1308	344	1	rsc adv.	PERSON
ecletica-1308	344	2	2017	DATE
ecletica-1308	344	3	7	DATE
ecletica-1308	344	4	71	CARDINAL
ecletica-1308	345	1	https://doi.org/10.1039/c7ra07551k zhang	PERSON
ecletica-1308	345	2	r.	NORP
ecletica-1308	345	3	li	PERSON
ecletica-1308	345	4	zhang, r.	ORG
ecletica-1308	345	5	shi	PERSON
ecletica-1308	345	6	x.	GPE
ecletica-1308	345	7	li	PERSON
ecletica-1308	345	8	q.	PERSON
ecletica-1308	345	9	wang	ORG
ecletica-1308	345	10	w. computational study	ORG
ecletica-1308	346	1	j. hazard	PERSON
ecletica-1308	347	1	2021	CARDINAL
ecletica-1308	347	2	414	CARDINAL
ecletica-1308	347	3	125457	DATE
ecletica-1308	351	1	https://doi.org/10.1021/cr900335q	LANGUAGE
ecletica-1308	352	1	https://doi.org/10.1039/c7ra07551k https://doi.org/10.1039/c7ra07551k https://doi.org/10.1039/c7ra07551k	TIME
