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| Systre crystallographic geometry file (.cgd) |
| topcryst |
| Vertices per primitive translational unit | 16 |
| Edges per primitive translational unit | 31 |
| Transitivity (vertex,edge) | (6,8) |
| Vertex degrees | {3,4,4,4,4,4} |
| Vertex coordination sequence | [(3, 7, 18, 35, 53, 68, 83, 113, 154, 189), (4, 9, 18, 33, 52, 72, 92, 113, 146, 195), (4, 9, 17, 28, 44, 69, 98, 126, 155, 185), (4, 9, 16, 26, 42, 64, 92, 127, 162, 190), (4, 7, 12, 23, 38, 62, 96, 128, 154, 178), (4, 7, 11, 22, 38, 55, 83, 128, 171, 191)] |
| Wells’ vertex symbol | [4.8^2, 4.8^5, 4^3.8^3, 4^3.6.8^2, 4^5.6, 4^5.6] |
| 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, 3, 8, 0, 0, 0, 4, 7, 0, 1, 0, 4, 9, 0, 0, 0, 5, 8, 0, 0, 0, 5, 9, 0, 0, 0, 5, 10, 0, 0, 0, 6, 8, 1, 0, 0, 6, 9, 1, 0, 0, 6, 11, 0, 0, 0, 7, 12, 0, 0, 0, 7, 13, 0, 0, 0, 8, 14, 0, 0, 0, 9, 15, 0, 0, 0, 10, 11, 0, 0, 0, 10, 14, 0, 0, 0, 10, 15, 0, 0, 0, 11, 14, 1, 0, 0, 11, 15, 1, 0, 0, 12, 13, 1, 0, 0, 12, 16, 0, 0, 0, 13, 16, 0, 0, 0, 14, 16, 0, 0, 1, 15, 16, 0, 1, 1) |
Spacegroup: Pmmm
Parameters:
| a | b | c | alpha | beta | gamma |
|---|---|---|---|---|---|
| 5.70755 | 2.79059 | 4.18824 | 90.0 | 90.0 | 90.0 |
Vertex positions:
| X-pos | Y-pos | Z-pos |
|---|---|---|
| 0 | 0.25 | 0 |
| 0.19231 | 0 | 0 |
| 0.38462 | 0 | 0.35714 |
| 0.42308 | 0.22222 | 0.5 |
| 0.5 | 0 | 0.42857 |
| 0.5 | 0.11111 | 0.5 |
Edge end points:
Spacegroup: Pmmm
Parameters:
| a | b | c | alpha | beta | gamma |
|---|---|---|---|---|---|
| 4.65388 | 2.28554 | 3.18795 | 90.0 | 90.0 | 90.0 |
Vertex positions:
| X-pos | Y-pos | Z-pos |
|---|---|---|
| 0 | 0.28122 | 0 |
| 0.16462 | 0 | 0 |
| 0.28514 | 0 | 0.2597 |
| 0.28515 | 0.28123 | 0.5 |
| 0.5 | 0 | 0.26307 |
| 0.5 | 0.28672 | 0.5 |
Edge end points: