{"name":"fcw-z","uri":"https://mofpp.ramabile.casa/net/fcw-z","type":"net","published":true,"provenance":{"source":"mofplus","source_id":"fcw-z","retrieved":"2026-09-09T00:10:45.615627","licence_source":"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.","source_citation":null,"field_sources":{"catenated":"computed:mofpp.periodicity-v1 (mofplus-deposit)","cella":"mofplus","cellalpha":"mofplus","cellb":"mofplus","cellbeta":"mofplus","cellc":"mofplus","cellgamma":"mofplus","cs":"mofplus","edges":"mofplus","natoms":"mofplus","source_id":"mofplus","vertices":"mofplus","vs":"mofplus","vs_corroboration":"corroborated: 192 of 192 vertex rows agree with mofpp.rings v2 (mofplus-deposit).","licence":"mofpp-project-decision (CONTEXT §6)","topofile":"mofplus","retrieved_utc":"2026-09-09T00:10:45.615627+00:00","name_match":"single-source","cs_corroboration":"checked: one walk over the net's own periodic topology per vertex class, matched against the sequences the source supplied (0 class(es) disagreed). The coordination sequences are the source's own, byte for byte. Only the question of which vertex class each one describes was settled here, by walking the periodic net from one atom of each class (services.topology.coordination_sequence) and matching that walk against the sequences the source supplied. No sequence was computed into the record, extended, repaired, or replaced by a walked one; a supplied sequence that matches no class is withheld, not corrected.","spacegroup":"computed:systre-19.6.0 (mofplus-deposit)","spacegroup_number":"computed:systre-19.6.0 (mofplus-deposit)","p":"computed:systre-19.6.0 (mofplus-deposit)","q":"computed:systre-19.6.0 (mofplus-deposit)","catenated_name_heuristic":"No; agrees with the computed value","cs_row_check":"corroborated: 192 of 192 vertex rows agree with mofpp.invariants v2 (mofplus-deposit), compared on the stored length.","vertex_symmetry":"computed:mofpp.site_symmetry-v1 (spglib-2.7.0, mofplus-deposit)","vertex_site_symmetry":"The site symmetry on each vertex row is the point group of the operations of the net's ideal space group that leave that vertex where it is — its Wyckoff position in the net's maximum-symmetry embedding. It is a property of the net, not of any material built on it, and it is what says whether a four-coordinated vertex is tetrahedral (-43m) or square-planar (4/mmm) — a distinction the coordination number cannot make. Computed in Pn-3m, setting 2, by mofpp.site_symmetry v1 with spglib 2.7.0, from the embedding Systre 19.6.0 computed on the mofplus-deposit. spglib determined the same space group from those coordinates independently, which is a check of two different computations against each other rather than a restatement."}},"ordering":{"rcsr_index":null,"rcsr_index_provenance":null,"rcsr_index_absence":"outside-archive","rcsr_index_note":"No RCSR index: the name fcw-z is not one of the 2930 symbols in the RCSR Systre archive of 2019-06-01, so this net has no position in that ordering and is listed after every net that does.","complexity_rank":2338,"complexity_basis":{"level":3,"level_name":"cell_contents","fields":{"natoms":192,"edge_count":480},"tie_break":{"symbol":"fcw-z"},"key":[3,192,480,"fcw-z"],"unkeyed":false}},"spacegroup":"Pn-3m","spacegroup_number":224,"plane_group":null,"plane_group_number":null,"transitivity":{"p":1,"q":3,"r":null,"s":null},"cell":[5.9143,5.9143,5.9143,90.0,90.0,90.0],"natoms":192,"catenated":false,"catenated_note":"No, computed from the graph of the net itself rather than read off its name: mofpp.periodicity v1 finds a single copy, so it is not interpenetrated on the MOF+ deposit, the graph of the uploaded topology file. Interpenetration is counted here as the number of separate copies of the net that share one repeat unit, so this is a measurement of the topology and not a marker in a string.","licence":"CC-BY-4.0","coordination_sequences":{"state":"corroborated","note":"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.","provenance":"mofplus","corroboration":"checked: one walk over the net's own periodic topology per vertex class, matched against the sequences the source supplied (0 class(es) disagreed). The coordination sequences are the source's own, byte for byte. Only the question of which vertex class each one describes was settled here, by walking the periodic net from one atom of each class (services.topology.coordination_sequence) and matching that walk against the sequences the source supplied. No sequence was computed into the record, extended, repaired, or replaced by a walked one; a supplied sequence that matches no class is withheld, not corrected.","topology_mismatch":null,"class_mapping":null,"unresolved":null,"vertex_symbols":{"state":"corroborated","note":"The symbols below are the values the source supplied, and they have been checked: the same symbol was recomputed from the graph of the net itself and agrees with every stored string that could be compared. How many rows that was, and which were left out because they are not symbols, is served under computed_check.","superseded":null,"superseded_rows":{},"superseded_decision":null,"corroboration":"Corroborated: 192 of 192 stored symbols were recomputed from the topology of the net itself and agree, entry for entry. A vertex symbol of this collection names the shortest cycle at each angle of a vertex, and mofpp.rings v2 (mofplus-deposit) walks those cycles on the deposit graph. The strings shown are still the values the source supplied; what was checked is that they are the values this net has.","computed_check":{"state":"corroborated","decided":false,"agree":192,"disagree":0,"compared":192,"excluded":0,"disagreements":[],"note":"Corroborated: 192 of 192 stored symbols were recomputed from the topology of the net itself and agree, entry for entry. A vertex symbol of this collection names the shortest cycle at each angle of a vertex, and mofpp.rings v2 (mofplus-deposit) walks those cycles on the deposit graph. The strings shown are still the values the source supplied; what was checked is that they are the values this net has.","tool":"mofpp.rings v2 (mofplus-deposit)","analysed":true},"provenance":"mofplus","stored":192,"shape_checked":192,"truncated":[],"placeholder":[],"incomplete":[],"flagged":{},"absence_reason":"not recorded: no vertex symbol is stored for this vertex."},"site_symmetry":{"recorded":192,"vertices":192,"provenance":"computed:mofpp.site_symmetry-v1 (spglib-2.7.0, mofplus-deposit)","note":"The site symmetry on each vertex row is the point group of the operations of the net's ideal space group that leave that vertex where it is — its Wyckoff position in the net's maximum-symmetry embedding. It is a property of the net, not of any material built on it, and it is what says whether a four-coordinated vertex is tetrahedral (-43m) or square-planar (4/mmm) — a distinction the coordination number cannot make. Computed in Pn-3m, setting 2, by mofpp.site_symmetry v1 with spglib 2.7.0, from the embedding Systre 19.6.0 computed on the mofplus-deposit. spglib determined the same space group from those coordinates independently, which is a check of two different computations against each other rather than a restatement.","absence":null}},"vertex_symbols":{"state":"corroborated","note":"The symbols below are the values the source supplied, and they have been checked: the same symbol was recomputed from the graph of the net itself and agrees with every stored string that could be compared. How many rows that was, and which were left out because they are not symbols, is served under computed_check.","superseded":null,"superseded_rows":{},"superseded_decision":null,"corroboration":"Corroborated: 192 of 192 stored symbols were recomputed from the topology of the net itself and agree, entry for entry. A vertex symbol of this collection names the shortest cycle at each angle of a vertex, and mofpp.rings v2 (mofplus-deposit) walks those cycles on the deposit graph. The strings shown are still the values the source supplied; what was checked is that they are the values this net has.","computed_check":{"state":"corroborated","decided":false,"agree":192,"disagree":0,"compared":192,"excluded":0,"disagreements":[],"note":"Corroborated: 192 of 192 stored symbols were recomputed from the topology of the net itself and agree, entry for entry. A vertex symbol of this collection names the shortest cycle at each angle of a vertex, and mofpp.rings v2 (mofplus-deposit) walks those cycles on the deposit graph. The strings shown are still the values the source supplied; what was checked is that they are the values this net has.","tool":"mofpp.rings v2 (mofplus-deposit)","analysed":true},"provenance":"mofplus","stored":192,"shape_checked":192,"truncated":[],"placeholder":[],"incomplete":[],"flagged":{},"absence_reason":"not recorded: no vertex symbol is stored for this vertex."},"systre":{"key":null,"checksum":null,"provenance":null,"checksum_provenance":null,"absence":"outside-archive","note":"No canonical key is recorded on this record from either source, and this field stays empty because it holds archive text and nothing else. A key was nonetheless computed here: Systre 19.6.0 was run on the MOF+ deposit, the graph of the uploaded topology file and derived one from the graph of the net itself. It is served under topology.symmetry, with the graph it was computed from and the version that computed it, rather than written into this field — a computed key is not the archive text, and serving it here would say the archive states something it does not.","computed_absence":null,"computed":{"key":"3 1 2 0 0 0 1 3 0 0 0 1 4 0 0 0 1 5 0 0 0 1 6 0 0 0 2 7 0 0 0 2 8 0 0 0 2 9 0 0 0 2 10 0 0 0 3 4 0 0 0 3 5 0 0 0 3 11 0 0 0 3 12 0 0 0 4 6 0 0 0 4 12 0 0 0 4 13 0 0 0 5 6 0 0 0 5 12 0 0 0 5 14 0 0 0 6 12 0 0 0 6 15 0 0 0 7 8 0 0 0 7 9 0 0 0 7 16 0 0 0 7 17 0 0 0 8 10 0 0 0 8 17 0 0 0 8 18 0 0 0 9 10 0 0 0 9 17 0 0 0 9 19 0 0 0 10 17 0 0 0 10 20 0 0 0 11 16 0 1 0 11 20 1 0 0 11 21 0 0 0 11 22 0 0 0 12 17 0 0 1 13 18 0 -1 1 13 19 -1 0 0 13 23 0 0 0 13 24 0 0 0 14 18 1 0 1 14 19 0 1 0 14 23 1 1 0 14 24 1 1 0 15 16 -1 0 1 15 20 0 -1 1 15 21 -1 -1 1 15 22 -1 -1 1 16 21 0 -1 0 16 22 0 -1 0 18 23 0 1 -1 18 24 0 1 -1 19 23 1 0 0 19 24 1 0 0 20 21 -1 0 0 20 22 -1 0 0 21 24 1 0 0 22 23 1 2 -1","basis":"mofplus-deposit","basis_note":"the MOF+ deposit, the graph of the uploaded topology file","matches_archive":null,"matches_archive_reason":"This record carries no archive key, so the computed key has nothing to be compared with. This is not a disagreement, and for a net the archive does not list it is the expected state.","rcsr_identification":null,"describes_one_net":true,"scope":"Systre found one connected net in the repeat unit, so the group, the kinds of node and edge, and the key below describe that net.","tool":"systre","tool_version":"19.6.0 sha256:0d272e98a1a21669bc67a809b95c014ba2a2fb39a6fd2147039201216ab0d48d options:--systreKey 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Every entry carries the tool, its version and input_checksum, the checksum of the graph that was actually analysed, so that a result computed from the graph this record holds now can be told from one computed before it changed. Nothing here rebuilds a graph to check that, so no entry below is claimed to be current.","periodicity":{"mofplus-deposit":{"basis":"mofplus-deposit","basis_note":"the MOF+ deposit, the graph of the uploaded topology file","status":"ok","reason":null,"tool":"mofpp.periodicity","tool_version":"1","input_checksum":"sha256:1d178c7a61561c18a10f0e71323a10c75116cbeae324dfb77496e043fbbfba8a","seconds":0.0030777599895372987,"computed":"2026-09-11T17:18:34.280914","dimension":3,"periodicity":3,"connected":true,"interpenetration":1,"catenated":false,"undetermined_reason":null,"component_count":1}},"symmetry":{"mofplus-deposit":{"basis":"mofplus-deposit","basis_note":"the MOF+ deposit, the graph of the uploaded topology file","status":"ok","reason":null,"tool":"systre","tool_version":"19.6.0 sha256:0d272e98a1a21669bc67a809b95c014ba2a2fb39a6fd2147039201216ab0d48d options:--systreKey wrapper:2","input_checksum":"sha256:1d178c7a61561c18a10f0e71323a10c75116cbeae324dfb77496e043fbbfba8a","seconds":8.55,"computed":"2026-09-11T23:47:22.565669","connected":true,"component_count":1,"describes_one_net":true,"scope":"Systre found one connected net in the repeat unit, so the group, the kinds of node and edge, and the key below describe that net.","dimension":3,"multiplicity":1,"point_group_order":48,"node_kinds":1,"edge_kinds":3,"repeat_unit_factor":8,"repeat_unit_accurate":false,"space_group":"Pn-3m","space_group_setting":"second origin choice","space_group_number":224,"plane_group_number":null,"td10":1366,"degrees_of_freedom":2,"rcsr_identification":null,"systre_key":"3 1 2 0 0 0 1 3 0 0 0 1 4 0 0 0 1 5 0 0 0 1 6 0 0 0 2 7 0 0 0 2 8 0 0 0 2 9 0 0 0 2 10 0 0 0 3 4 0 0 0 3 5 0 0 0 3 11 0 0 0 3 12 0 0 0 4 6 0 0 0 4 12 0 0 0 4 13 0 0 0 5 6 0 0 0 5 12 0 0 0 5 14 0 0 0 6 12 0 0 0 6 15 0 0 0 7 8 0 0 0 7 9 0 0 0 7 16 0 0 0 7 17 0 0 0 8 10 0 0 0 8 17 0 0 0 8 18 0 0 0 9 10 0 0 0 9 17 0 0 0 9 19 0 0 0 10 17 0 0 0 10 20 0 0 0 11 16 0 1 0 11 20 1 0 0 11 21 0 0 0 11 22 0 0 0 12 17 0 0 1 13 18 0 -1 1 13 19 -1 0 0 13 23 0 0 0 13 24 0 0 0 14 18 1 0 1 14 19 0 1 0 14 23 1 1 0 14 24 1 1 0 15 16 -1 0 1 15 20 0 -1 1 15 21 -1 -1 1 15 22 -1 -1 1 16 21 0 -1 0 16 22 0 -1 0 18 23 0 1 -1 18 24 0 1 -1 19 23 1 0 0 19 24 1 0 0 20 21 -1 0 0 20 22 -1 0 0 21 24 1 0 0 22 23 1 2 -1","warnings":["not identified: new to Systre's archives and to this run"],"key_matches_archive":null,"key_matches_archive_reason":"This record carries no archive key, so the computed key has nothing to be compared with. This is not a disagreement, and for a net the archive does not list it is the expected state.","components":null}},"invariants":{"mofplus-deposit":{"basis":"mofplus-deposit","basis_note":"the MOF+ deposit, the graph of the uploaded topology file","status":"ok","reason":null,"tool":"mofpp.invariants","tool_version":"2","input_checksum":"sha256:1d178c7a61561c18a10f0e71323a10c75116cbeae324dfb77496e043fbbfba8a","seconds":2.4743191049201414,"computed":"2026-09-11T17:18:34.282649","shells":10,"td10":1366.0,"td10_reason":null,"genus":37,"genus_reason":null,"repeat_unit_factor":8,"repeat_unit_factor_source":"Systre on the deposit (19.6.0 sha256:0d272e98a1a21669bc67a809b95c014ba2a2fb39a6fd2147039201216ab0d48d options:--systreKey wrapper:1)"}},"rings":{"mofplus-deposit":{"basis":"mofplus-deposit","basis_note":"the MOF+ deposit, the graph of the uploaded topology file","status":"ok","reason":null,"tool":"mofpp.rings","tool_version":"2","input_checksum":"sha256:1d178c7a61561c18a10f0e71323a10c75116cbeae324dfb77496e043fbbfba8a","seconds":0.5142628900939599,"computed":"2026-09-11T23:11:13.434087","max_ring":40,"net_point_symbol":"(3^4.4^2.8^2.9^2)","net_point_symbol_reason":null,"classes":[{"vertices":[0,1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67,68,69,70,71,72,73,74,75,76,77,78,79,80,81,82,83,84,85,86,87,88,89,90,91,92,93,94,95,96,97,98,99,100,101,102,103,104,105,106,107,108,109,110,111,112,113,114,115,116,117,118,119,120,121,122,123,124,125,126,127,128,129,130,131,132,133,134,135,136,137,138,139,140,141,142,143,144,145,146,147,148,149,150,151,152,153,154,155,156,157,158,159,160,161,162,163,164,165,166,167,168,169,170,171,172,173,174,175,176,177,178,179,180,181,182,183,184,185,186,187,188,189,190,191],"cycle_symbol":"3.3.3.3.4(3).4(3).8.8.9.9","vertex_symbol":"3.3.3.3.4.4.8.8.12(4).12(4)","point_symbol":"3^4.4^2.8^2.9^2","coordination_sequence":[5,9,22,39,77,120,169,247,306,371],"capped":false,"reason":null}],"capped":false}},"checks":{"name_match":"single-source","name_match_reason":null,"vs_corroboration":"corroborated: 192 of 192 vertex rows agree with mofpp.rings v2 (mofplus-deposit).","vs_corroboration_superseded":null,"vs_topology_mismatch":null,"cs_row_check":"corroborated: 192 of 192 vertex rows agree with mofpp.invariants v2 (mofplus-deposit), compared on the stored length.","catenated_name_heuristic":"No; agrees with the computed value","spacegroup_handedness":null,"rcsr_identification":null,"conflicts":{}}},"curation":[],"citation":{"text":"MOF++ contributors (2026). fcw-z [net]. MOF++ dataset release unreleased. Record: https://mofpp.ramabile.casa/net/fcw-z","record_uri":"https://mofpp.ramabile.casa/net/fcw-z","dataset_doi":null,"dataset_version":"unreleased","licence":{"id":"CC-BY-4.0","name":"Creative Commons Attribution 4.0 International","url":"https://creativecommons.org/licenses/by/4.0/","short":"CC BY 4.0","open":true}},"relations":{"derived_from":[],"derives":[]}}