Table 7. DCDHQ: final results of the global optimization by FIDEL-GO (stage RE2).

Rank	Model	Space group	Z		R wp (%)	V/Z (Å3 mol−1)	a (Å)	b (Å)	c (Å)	α (°)	β (°)	γ (°)
1	B2		2	0.9879	17.070	418.88	4.118	12.991	16.668	70.22	88.68	86.95
2	A4		1	0.9875	18.114	375.90	3.702	6.586	15.696	86.82	88.54	79.68
3			2	0.9873	18.074	405.89	6.487	7.973	15.934	80.70	86.58	88.39
4	B1		2	0.9872	18.031	413.22	4.062	13.016	16.696	109.33	92.95	95.18
5			2	0.9872	17.077	391.81	6.121	8.175	16.208	103.66	94.70	92.61
6			2	0.9872	20.831	391.79	3.851	13.003	16.704	109.27	93.78	94.36
7			2	0.9871	17.055	404.26	7.272	7.759	15.679	89.25	88.75	66.08
8	C1	P21/c	2	0.9870	15.872	418.65	6.494	4.097	31.531	90	93.52	90
9			1	0.9868	17.956	417.35	4.103	6.486	15.799	86.91	83.81	88.96
10	A3		1	0.9867	17.981	421.88	4.152	6.577	15.698	86.69	88.45	80.38
11	A2		1	0.9867	18.127	382.63	3.770	6.601	15.677	92.86	90.44	100.88
12			1	0.9867	19.585	380.40	3.741	6.641	15.710	86.72	88.74	77.51
13			2	0.9866	18.870	405.08	6.973	7.715	15.823	93.02	95.13	106.50
14	A1		1	0.9865	17.955	380.17	3.747	6.572	15.683	92.79	90.29	99.71
15			2	0.9864	18.645	373.15	6.923	6.988	16.000	83.32	80.55	78.87
16	A5		1	0.9863	18.300	410.34	4.037	6.483	15.788	92.84	96.02	91.02