s-net: sqc5514
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| Systre crystallographic geometry file (.cgd) |
Links to this net in other databases
| topcryst |
Topological data
| Vertices per primitive translational unit | 14 |
| Edges per primitive translational unit | 24 |
| Transitivity (vertex,edge) | (5,7) |
| Vertex degrees | {3,4,3,4,3} |
| Vertex coordination sequence | [(3, 8, 11, 24, 37, 55, 74, 101, 141, 160), (4, 8, 15, 24, 40, 58, 78, 103, 132, 163), (3, 8, 14, 24, 38, 58, 81, 98, 125, 156), (4, 7, 16, 28, 42, 61, 80, 98, 120, 163), (3, 7, 14, 27, 43, 58, 73, 101, 132, 149)] |
| Wells’ vertex symbol | [5^2.6, 4.5^2.6.8^2, 4.8^2, 4.8^4.10, 4.8^2] |
| 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, 4, 1, 0, 0, 2, 6, 0, 0, 0, 3, 7, 0, 0, 0, 4, 7, 0, 1, 0, 5, 6, -1, 0, 0, 5, 8, 0, 0, 0, 6, 9, 0, 0, 0, 7, 10, 0, 0, 0, 7, 11, 0, 0, 0, 8, 9, 0, 0, 0, 8, 12, 0, 0, 0, 8, 13, 0, 0, 0, 9, 12, 1, 0, 0, 9, 13, 1, 0, 0, 10, 11, 1, 0, 0, 10, 14, 0, 0, 0, 11, 14, 0, 0, 0, 12, 14, 0, 0, 1, 13, 14, 0, 1, 1) |
Geometric data
Systre equilibrium placement (barycentric embedding) maximising unit cell volume
Spacegroup: Pmmm
Parameters:
| a | b | c | alpha | beta | gamma |
|---|---|---|---|---|---|
| 3.56115 | 2.29159 | 5.44271 | 90.0 | 90.0 | 90.0 |
Vertex positions:
| X-pos | Y-pos | Z-pos |
|---|---|---|
| 0 | 0.38889 | 0 |
| 0 | 0.27778 | 0.14286 |
| 0.16667 | 0.5 | 0.21429 |
| 0.5 | 0.5 | 0.35714 |
| 0.5 | 0.25 | 0.5 |
Edge end points:
Systre coordinates favouring equal edge-lengths
Spacegroup: Pmmm
Parameters:
| a | b | c | alpha | beta | gamma |
|---|---|---|---|---|---|
| 3.10157 | 2.21658 | 5.37844 | 90.0 | 90.0 | 90.0 |
Vertex positions:
| X-pos | Y-pos | Z-pos |
|---|---|---|
| 0 | 0.27443 | 0 |
| 0 | 0.22557 | 0.18483 |
| 0.22118 | 0.5 | 0.25906 |
| 0.5 | 0.5 | 0.35243 |
| 0.5 | 0.22557 | 0.5 |
Edge end points:
