| ↓ ID ✕ | PBC ✕ | atom_E ✕ | ads_E ✕ |
|---|---|---|---|
| 1 | TTT | -1.117 | -1.889 |
| 2 | TTT | 0.002 | -0.007 |
| 3 | TTT | -0.299 | -2.868 |
| 4 | TTT | -0.039 | -4.044 |
| 5 | TTT | -0.349 | -5.643 |
| 6 | TTT | -1.248 | -4.895 |
| 7 | TTT | -3.124 | -2.390 |
| 8 | TTT | -1.533 | -3.329 |
| 9 | TTT | -0.424 | -3.208 |
| 10 | TTT | -0.013 | -0.009 |
| 11 | TTT | -0.225 | -2.363 |
| 12 | TTT | -0.004 | -2.441 |
| 13 | TTT | -0.295 | -4.253 |
| 14 | TTT | -0.830 | -5.051 |
| 15 | TTT | -1.888 | -4.079 |
| 16 | TTT | -0.945 | -3.898 |
| 17 | TTT | -0.243 | -2.562 |
| 18 | TTT | -0.025 | -0.005 |
| 19 | TTT | -1.117 | -2.247 |
| 20 | TTT | 0.002 | -0.007 |
| 21 | TTT | -0.299 | -2.541 |
| 22 | TTT | -0.039 | -2.713 |
| 23 | TTT | -0.349 | -4.341 |
| 24 | TTT | -1.248 | -4.185 |
| 25 | TTT | -3.124 | -2.172 |