s-net: sqc4082
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| Systre crystallographic geometry file (.cgd) |
Links to this net in other databases
| topcryst |
Topological data
| Vertices per primitive translational unit | 8 |
| Edges per primitive translational unit | 22 |
| Transitivity (vertex,edge) | (2,7) |
| Vertex degrees | {4,7} |
| Vertex coordination sequence | [(4, 13, 36, 73, 119, 174, 239, 314, 399, 494), (7, 22, 47, 82, 127, 182, 247, 322, 407, 502)] |
| Wells’ vertex symbol | [3.4^3.6^2, 3^2.4^10.5^4.6^5] |
| Systre key | (3, 1, 1, -1, 0, 0, 1, 2, 0, 0, 0, 1, 2, 0, 1, 0, 1, 3, -1, 0, 0, 1, 3, 0, 0, 0, 1, 4, 0, 0, 0, 2, 2, -1, 0, 0, 2, 5, -1, 0, 0, 2, 5, 0, 0, 0, 2, 6, 0, 0, 0, 3, 5, 0, 1, 0, 3, 7, 0, 0, 0, 4, 4, -1, 0, 0, 4, 6, 0, 0, 0, 4, 6, 0, 1, 0, 4, 7, -1, 0, 1, 4, 7, 0, 0, 1, 5, 8, 0, 0, 0, 6, 6, -1, 0, 0, 6, 8, -1, 0, 1, 6, 8, 0, 0, 1, 7, 8, 0, 1, 0) |
Geometric data
Systre equilibrium placement (barycentric embedding) maximising unit cell volume
Spacegroup: Pmmm
Parameters:
| a | b | c | alpha | beta | gamma |
|---|---|---|---|---|---|
| 1.14013 | 3.42023 | 2.54805 | 90.0 | 90.0 | 90.0 |
Vertex positions:
| X-pos | Y-pos | Z-pos |
|---|---|---|
| 0 | 0.16667 | 0.4 |
| 0.5 | 0.33333 | 0.3 |
Edge end points:
Systre coordinates favouring equal edge-lengths
Spacegroup: Pmmm
Parameters:
| a | b | c | alpha | beta | gamma |
|---|---|---|---|---|---|
| 1.00005 | 3.73195 | 2.00017 | 90.0 | 90.0 | 90.0 |
Vertex positions:
| X-pos | Y-pos | Z-pos |
|---|---|---|
| 0 | 0.13398 | 0.25006 |
| 0.5 | 0.36602 | 0.25 |
Edge end points:
