43 dihe (D) Dihedral Angles

Packet Size - Variable

IDN Description
11 atom 1 label
12-14 atom 1 fractional coords x,y,z
15 atom 1 symop number
16 atom 1 packed cell translations for origin at 555
21 atom 2 label
22-24 atom 2 fractional coords x,y,z
25 atom 2 symop number
26 atom 2 packed cell translations for origin at 555
31 atom 3 label
32-34 atom 3 fractional coords x,y,z
35 atom 3 symop number
36 atom 3 packed cell translations for origin at 555
41 atom 4 label
42-44 atom 4 fractional coords x,y,z
45 atom 4 symop number
46 atom 4 packed cell translations for origin at 555
91 angle in degrees (calculated)
92 e.s.d. of angle (calculated)
93 angle in degrees (observed)
94 e.s.d. of angle (observed)
95 weight of restraint
101-112 atom 1 symmetry elements \(r_{11}r_{21}r_{31}r_{12}r_{22}r_{23}r_{31}r_{32}r_{33}t_{1}t_{2}t_{3}\)
201-212 atom 2 symmetry elements
301-312 atom 3 symmetry elements
401-412 atom 4 symmetry elements