KTiI3
open	/cryst/compstru.html
type	stru1
type	stru2
type	stru1	173 13.535977 13.535977 6.646200 90.000000 90.000000 120.000000 7 Ti 1 2a 0.000000 0.000000 0.200000 Ti 1_2 2b 0.666667 0.333333 0.200000 Ti 1_3 2b 0.333333 0.666667 0.200000 K 1 6c 0.333334 0.000000 0.950000 I 1 6c 0.160000 0.000000 0.450000 I 1_2 6c 0.826667 0.333333 0.450000 I 1_3 6c 0.493333 0.666667 0.450000
type	stru2	173 13.536 13.536 6.6462 90.00 90.00 120.00 7 K 1 6c 0.005900 0.321000 0.907000 Ti 1 2a 0.000000 0.000000 0.604000 Ti 2 2b 0.666667 0.333333 0.772000 Ti 3 2b 0.666667 0.333333 0.273000 I 1 6c 0.158700 0.178800 0.852000 I 2 6c 0.481300 0.282700 0.016800 I 3 6c 0.856800 0.385800 0.515200
clickAndWait	submit
clickAndWait	name=lattmatch
verifyTextPresent	Transformation matrix (P, p): a,b,c ; 0,0,0.00147
verifyTextPresent	2a
verifyTextPresent	(0,0,z)
verifyTextPresent	Ti1
verifyTextPresent	(0.000000,0.000000,0.200000)
verifyTextPresent	Ti1
verifyTextPresent	(0.000000,0.000000,0.102533)
verifyTextPresent	2b
verifyTextPresent	(1/3,2/3,z)
verifyTextPresent	Ti1_2
verifyTextPresent	(0.666667,0.333333,0.200000)
verifyTextPresent	Ti3
verifyTextPresent	(0.666667,0.333333,0.271533)
verifyTextPresent	2b
verifyTextPresent	(1/3,2/3,z)
verifyTextPresent	Ti1_3
verifyTextPresent	(0.333333,0.666667,0.200000)
verifyTextPresent	Ti2
verifyTextPresent	6c
verifyTextPresent	(x,y,z)
verifyTextPresent	K1
verifyTextPresent	(0.333333,0.000000,0.950000)
verifyTextPresent	K1
verifyTextPresent	(0.315100,0.994100,0.905533)
verifyTextPresent	6c
verifyTextPresent	(x,y,z)
verifyTextPresent	I1
verifyTextPresent	(0.160000,0.000000,0.450000)
verifyTextPresent	I1
verifyTextPresent	(0.178800,0.020100,0.350533)
verifyTextPresent	6c
verifyTextPresent	(x,y,z)
verifyTextPresent	I1_2
verifyTextPresent	(0.826667,0.333333,0.450000)
verifyTextPresent	I3
verifyTextPresent	(0.856800,0.385800,0.513733)
verifyTextPresent	6c
verifyTextPresent	(x,y,z)
verifyTextPresent	I1_3
verifyTextPresent	(0.493333,0.666667,0.450000)
verifyTextPresent	I2
verifyTextPresent	0.6478
verifyTextPresent	0.4754
verifyTextPresent	0.4688
verifyTextPresent	0.3673
verifyTextPresent	0.7117
verifyTextPresent	0.7487
verifyTextPresent	0.7354
verifyTextPresent	arithmetic mean
verifyTextPresent	0.6188 Å
verifyTextPresent	measure of similarity
verifyTextPresent	0.052
verifyTextPresent	degree of lattice distortion
verifyTextPresent	0.0000
verifyTextPresent	maximum distance
verifyTextPresent	0.7487 Å
click	id=enlace
verifyTextPresent	(P, p)1: a,b,c ; 0,0,0
verifyTextPresent	(P, p)2: a,b,c ; 0,0,0.00147