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| Systre crystallographic geometry file (.cgd) |
| topcryst |
| Vertices per primitive translational unit | 14 |
| Edges per primitive translational unit | 29 |
| Transitivity (vertex,edge) | (6,7) |
| Vertex degrees | {3,4,4,6,4,4} |
| Vertex coordination sequence | [(3, 7, 18, 47, 65, 84, 107, 169, 192, 244), (4, 9, 26, 37, 72, 90, 120, 145, 218, 245), (4, 13, 21, 40, 56, 99, 120, 174, 197, 257), (6, 11, 24, 34, 64, 83, 136, 160, 220, 237), (4, 7, 18, 29, 56, 76, 134, 158, 210, 230), (4, 10, 14, 35, 48, 80, 110, 196, 206, 224)] |
| Wells’ vertex symbol | [4.7^2, 4.7^4.8, 4^3.7^2.8, 4^7.6^4.7^2.8^2, 4^5.6, 4^6] |
| Systre key | (3, 1, 2, 0, 0, 0, 1, 2, 1, 0, 0, 1, 3, 0, 0, 0, 1, 3, 1, 0, 0, 1, 4, 0, 0, 0, 1, 5, 0, 0, 0, 2, 6, 0, 0, 0, 2, 7, 0, 0, 0, 3, 6, 0, 1, 0, 3, 8, 0, 0, 0, 4, 7, 0, 0, 0, 4, 8, 0, 0, 0, 4, 9, 0, 0, 0, 5, 7, 1, 0, 0, 5, 8, 1, 0, 0, 5, 9, 0, 0, 0, 6, 10, 0, 0, 0, 6, 11, 0, 0, 0, 7, 12, 0, 0, 0, 8, 13, 0, 0, 0, 9, 12, 0, 0, 0, 9, 12, 1, 0, 0, 9, 13, 0, 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) |
Spacegroup: Pmmm
Parameters:
| a | b | c | alpha | beta | gamma |
|---|---|---|---|---|---|
| 5.36162 | 1.91951 | 3.93282 | 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 | 0.5 | 0.5 |
| 0.5 | 0 | 0.42857 |
| 0.5 | 0.25 | 0.5 |
Edge end points:
Spacegroup: Pmmm
Parameters:
| a | b | c | alpha | beta | gamma |
|---|---|---|---|---|---|
| 4.75799 | 1.72341 | 2.72541 | 90.0 | 90.0 | 90.0 |
Vertex positions:
| X-pos | Y-pos | Z-pos |
|---|---|---|
| 0 | 0.20988 | 0 |
| 0.19594 | 0 | 0 |
| 0.30487 | 0 | 0.3138 |
| 0.30603 | 0.5 | 0.5 |
| 0.5 | 0 | 0.1775 |
| 0.5 | 0.27667 | 0.5 |
Edge end points: