Bethanechol Chloride			28May04
	A2
Source	46-1964		Poor data with Z2Th = -0.075 and 3 impurity lines (lines 1, 2 & 4) - i.e. both the first 2, and 3 out of the first 4!
UPPW	11-1b		Thus there are only 17 valid lines in the 20 provided - happily including all the strongest 16.
Z2Th provided	0 (raw)		The manual tests used the strongest 16 lines with I>2, so only TP, TR, DV (& KL) could be run.
I/Imax>5%	No		An EP dataset extended to 20 lines was used for IT, FJ, TR (again), KL and DV (again).
									CPU clock
	Score		Highest	Figure of Merit				Time	(Athlon)
	Default	Manual	SolnRank	Type	Value	"I20"	V	sec	GHz	Comments
TAUP (to orth)	[0]	na	-	-	-	-	-	0,6	1,3	Default correctly found no solutions at high
DICVOL91 (to hex)	[0]	na	-	-	-	-	-	0,7	1,3	symmetry, but this is unreliable due to impurities.
ITO12	-1	-1	-	-	-	-	-	<0.5	1,3	Manual vs EP20 on XP2000+
FJZN	-1	-1	-	-	-	-	-	0,3	1,3	Manual vs EP20 on XP2000+ (0.2 sec)
TREOR90	-1	+1	1	"M20"	14	16	1030,08	<1	1,66	Time is for manual vs 16 strongest on XP2000+
KOHL	-1	0	?10	"M20"	13,4	16+	1029,9	c.30	1,66	Manual vs EP20 on XP2000+ (halted on error)
DICVOL91 (orth/mon)	(-1)	-1	-	-	-	-	-	229,1	1,66	Manual vs 16 strongest
DICVOL91 (combined)	(-1)	-1	-	-	-	-	-	229,7	1,66	Manual vs 16 strongest
LZON	(-1)	(-1)	-	-	-	-	-	-	-	See D2
Mmap	na	(-1)	-	-	-	-	-	-	-	See D2
Hmap	na	(-1)	-	-	-	-	-	-	-	See D2
McMaille	-1	(-1)	-	-	-	-	-	-	-	See D2
LOSH	na	(-1)	-	-	-	-	-	-	-	(KOHL basis set used in D2 not available here)
TAUP (mon)	na	+1	1	"M20"	14,28	16	1029,92	5,87	1,66	Solutions 1-5 (D2Th=0.05, nspuri=1, Vmax=1200)
TAUP (combined)	(-1)	+1	1	"M20"	14,28	16	1029,92	5,87	1,66
Crysfire (summary)	-1	+1