'using CIFtbx'
using_CIFtbx
'Terry O'Connell'
'Terry O"Connell'
293
1759(13)
8.75354
19.737(3)
293
1759(13)
8.7535355352431
19.737(3)
|
a
1.00(10)
8.64523
8.64523
a_again
1.00(10)
-.864523
-.864523
a_again
1.00(10)
-864523
-864523
ab
2.0(2)
17.29046
17.2905
ab_again
2.0(2)
-1.729046
-1.72905
ab_again
2.0(2)
-1729046
-172905E1
abc
3.0(3)
25.93569
25.9357
abc_again
3.0(3)
-2.593569
-2.59357
abc_again
3.0(3)
-2593569
-259357E1
abcd
4.0(4)
34.58092
34.5809
abcd_again
4.0(4)
-3.458092
-3.45809
abcd_again
4.0(4)
-3458092
-345809E1
abcde
5.0(5)
43.22615
43.2262
abcde_again
5.0(5)
-4.322615
-4.32262
abcde_again
5.0(5)
-4322615
-432262E1
abcdef
6.0(6)
51.87138
51.8714
abcdef_again
6.0(6)
-5.187138
-5.18714
abcdef_again
6.0(6)
-5187138
-518714E1
abcdefg
7.0(7)
60.51661
60.5166
abcdefg_again
7.0(7)
-6.051661
-6.05166
abcdefg_again
7.0(7)
-6051661
-605166E1
abcdefgh
8.0(8)
69.16184
69.1618
abcdefgh_again
8.0(8)
-6.916184
-6.91618
abcdefgh_again
8.0(8)
-6916184
-691618E1
abcdefghi
9.0(9)
77.80707
77.8071
abcdefghi_again
9.0(9)
-7.780707
-7.78071
abcdefghi_again
9.0(9)
-7780707
-778071E1
abcdefghij
10.0(10)
86.4523
86.4523
abcdefghij_again
10.0(10)
-8.64523
-8.64523
abcdefghij_again
10.0(10)
-8645230
-864523E1
a
1.00(10)
ab
2.0(2)
abc
3.0(3)
abcdefghijklmnopqrs
abcdefghijklmnopqrst
abcdefghijklmnopqrstu