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Net topology

rug

Ingested production record from rcsr+mofplus. Per-field provenance in field_sources.

JSON · mfpx

48 vertices and 96 edges in the unit cell. 34 of them leave the cell and continue into a neighbouring one; those are drawn in the accent colour and end at a hollow node. Squares are vertices of coordination 5 or more, circles of 4 or fewer. Drag to rotate, or focus the figure and use the arrow keys.

Crystallographic description

Spacegroup
not recorded
Cell lengths
a = 2.8872 Å, b = 2.8941 Å, c = 8.4447 Å
Cell angles
α = 94.72°, β = 95.27°, γ = 91.63°
Atoms in cell
48
Transitivity pqrs
not recorded
Catenated
no
No, on the MOF+ name heuristic: that source marks a catenated net by a -c in its name, which the legacy client filters on, and this is that marker read back. A name heuristic, not a computed property of the topology, and not a measurement either source made.

Canonical key

Systre key
3 1 2 0 0 0 1 3 0 0 0 1 4 0 0 0 1 5 0 0 0 2 3 1 0 0 2 6 0 0 0 2 7 0 0 0 3 8 0 0 0 3 9 0 0 0 4 9 1 0 0 4 10 0 0 0 4 11 0 0 0 5 7 0 0 0 5 12 0 0 0 5 13 0 0 0 6 14 0 0 0 6 15 0 0 0 6 16 0 0 0 7 13 1 0 0 7 17 0 0 0 8 14 -1 0 0 8 15 0 0 0 8 18 0 0 0 9 10 0 0 0 9 19 0 0 0 10 20 0 0 0 10 21 0 0 0 11 12 0 0 0 11 22 0 0 0 11 23 0 0 0 12 24 0 0 0 12 25 0 0 0 13 20 0 1 0 13 26 0 0 0 14 27 0 0 0 14 28 0 0 0 15 29 0 0 0 15 30 0 0 0 16 17 0 0 0 16 31 0 0 0 16 32 0 0 0 17 19 1 1 0 17 20 0 1 0 18 19 0 0 0 18 31 -1 -1 0 18 32 0 -1 0 19 20 0 0 0 21 22 -1 0 0 21 23 0 0 0 21 26 0 -1 0 22 33 0 0 0 22 34 0 0 0 23 35 0 0 0 23 36 0 0 0 24 26 1 0 0 24 33 0 1 0 24 34 0 0 0 25 26 0 0 0 25 35 0 1 0 25 36 0 0 0 27 29 0 0 0 27 31 0 -1 0 27 37 0 0 0 28 30 1 0 0 28 31 0 0 0 28 38 0 0 0 29 32 0 -1 0 29 39 0 0 0 30 32 0 0 0 30 40 0 0 0 33 35 0 0 0 33 41 0 0 0 34 36 1 0 0 34 42 0 0 0 35 43 0 0 0 36 44 0 0 0 37 38 0 -1 0 37 45 0 0 0 37 46 0 0 0 38 46 0 0 0 38 47 0 0 0 39 40 0 -1 0 39 45 0 0 0 39 48 0 0 0 40 47 -1 0 0 40 48 0 0 0 41 42 0 0 0 41 45 0 0 1 41 48 0 0 1 42 45 0 1 1 42 46 0 0 1 43 44 0 0 0 43 47 -1 -1 1 43 48 0 0 1 44 46 -1 0 1 44 47 -1 0 1
(rcsr)The canonical Systre key, copied verbatim from the local RCSR Systre archive of 2019-06-01. It is not computed here and cannot be: no Gavrog/Systre toolchain runs on this machine, so nothing on this site derives, extends, repairs or verifies a key. The checksum served beside it is the one the archive itself carries, copied from the same block, so that this copy can be checked against the upstream file; no checksum is computed or verified here.
Checksum
3491ab9cea46ffefb1969ec0ed4cc417 (rcsr)

Vertices

The mapping of coordination sequences onto vertex classes that the source supplied was checked against a walk over the periodic topology of the net itself, one walk per vertex class, and agreed. The sequences are the values the source supplied; the walk settled nothing but which class each one describes.

Not corroborated. The coordination sequences beside these symbols carry a corroboration of their own, stated under coordination_sequences; the vertex symbols carry none. A vertex symbol names the shortest ring at each angle of a vertex, no ring perception runs anywhere in this project, and so there is nothing here that could reproduce one: these strings are served on the word of the source alone. What was checked is their shape — a d-coordinated vertex has d(d-1)/2 angles and a whole symbol names a ring at each, and a string that lists fewer is flagged rather than served as a symbol. A string that passes that count can still be wrong in its rings, and nothing here says otherwise.

One row per distinct vertex. The coordination sequence counts how many vertices lie at each topological distance; the vertex symbol names the shortest ring at each angle of the vertex. The two columns do not carry the same warrant: which of them was corroborated, and which was not, is stated above the table.
# Coordination Site symmetry Vertex symbol Coordination sequence
0 4 —5.5.5.5.5.64 12 25 43 67 102 138 182 237 300
1 4 —5.5.5.5.5.64 12 25 43 67 102 138 182 237 300
2 4 —4.5.5.5.6.64 11 24 44 68 98 144 188 244 310
3 4 —4.5.5.5.6.64 11 24 44 68 98 144 188 244 310
4 4 —4.5.5.5.6.64 11 24 42 67 102 140 187 240 311
5 4 —4.5.5.5.6.64 11 24 42 67 102 140 187 240 311
6 4 —5.5.5.5.5.64 12 25 43 70 101 140 184 238 296
7 4 —5.5.5.5.5.64 12 25 43 70 101 140 184 238 296
8 4 —5.5.5.5.6.64 12 23 43 70 101 138 187 248 301
9 4 —5.5.5.5.6.64 12 23 43 70 101 138 187 248 301
10 4 —5.5.5.5.6.64 12 23 43 70 101 138 187 247 300
11 4 —5.5.5.5.6.64 12 23 43 70 101 138 187 247 300
12 4 —5.5.5.5.5.64 12 24 43 68 102 135 188 238 293
13 4 —5.5.5.5.5.64 12 24 43 68 102 135 188 238 293
14 4 —5.5.5.5.5.64 12 24 43 68 102 135 188 238 294
15 4 —5.5.5.5.5.64 12 24 43 68 102 135 188 238 294
16 4 —5.5.5.5.6.64 12 23 43 70 102 141 192 248 300
17 4 —5.5.5.5.6.64 12 23 43 70 102 141 192 248 300
18 4 —4.5.5.5.6.64 11 24 44 68 97 145 186 240 308
19 4 —4.5.5.5.6.64 11 24 44 68 97 145 186 240 308
20 4 —5.5.5.5.6.64 12 26 46 70 106 144 186 242 304
21 4 —5.5.5.5.6.64 12 26 46 70 106 144 186 242 304
22 4 —5.5.5.5.5.64 12 24 43 70 101 140 186 235 299
23 4 —5.5.5.5.5.64 12 24 43 70 101 140 186 235 299
24 4 —4.5.5.5.6.64 11 24 42 67 101 139 189 244 310
25 4 —4.5.5.5.6.64 11 24 42 67 101 139 189 244 310
26 4 —4.5.5.5.6.64 11 24 42 67 102 140 188 240 313
27 4 —4.5.5.5.6.64 11 24 42 67 102 140 188 240 313
28 4 —5.5.5.5.5.64 12 25 43 70 101 140 184 238 296
29 4 —5.5.5.5.5.64 12 25 43 70 101 140 184 238 296
30 4 —4.5.5.5.6.64 11 24 44 68 97 145 186 243 308
31 4 —4.5.5.5.6.64 11 24 44 68 97 145 186 243 308
32 4 —5.5.5.5.6.64 12 23 43 70 102 140 192 250 300
33 4 —5.5.5.5.6.64 12 23 43 70 102 140 192 250 300
34 4 —5.5.5.5.5.54 12 24 40 70 96 136 182 234 288
35 4 —5.5.5.5.5.54 12 24 40 70 96 136 182 234 288
36 4 —4.5.5.5.6.64 11 24 42 67 101 139 190 244 311
37 4 —4.5.5.5.6.64 11 24 42 67 101 139 190 244 311
38 4 —5.5.5.5.5.64 12 24 43 70 101 140 186 235 299
39 4 —5.5.5.5.5.64 12 24 43 70 101 140 186 235 299
40 4 —5.5.5.5.5.64 12 25 43 69 101 143 185 238 304
41 4 —5.5.5.5.5.64 12 25 43 69 101 143 185 238 304
42 4 —4.5.5.5.6.64 11 24 44 68 98 143 188 244 308
43 4 —4.5.5.5.6.64 11 24 44 68 98 143 188 244 308
44 4 —5.5.5.5.5.64 12 25 43 67 102 138 182 237 299
45 4 —5.5.5.5.5.64 12 25 43 67 102 138 182 237 299
46 4 —5.5.5.5.5.64 12 25 43 69 101 143 185 238 304
47 4 —5.5.5.5.5.64 12 25 43 69 101 143 185 238 304

Provenance

Source
rcsr+mofplus — reconciled from both, field by field
Identifier at the source
rug
Retrieved
2026-09-09
Licence
CC BY 4.0 — verified from MOF++ project decision, CONTEXT §6 (Licensing): MOF+ is this group's own service, so nets retrieved from it are the project's own data to license, and the project licenses its data CC BY 4.0. No third-party grant is claimed..
Published
yes

Position in the collection

RCSR index
1673 (derived) Derived by this site, not published by RCSR: the 1-based position of the symbol in the ascending ASCII-lexicographic ordering of the 2930 symbols in the RCSR Systre archive of 2019-06-01. RCSR does not number its nets; this is our ordering of their symbols and nothing more.
Complexity rank
1840 The order the ingest processed this net in, simplest first. A different number from the RCSR index above, meaning a different thing.