| Li | −0.108117 | 2.207140 | 0.407782 |
| C | 3.809128 | 0.795021 | 0.168986 |
| C | 2.422832 | 0.788320 | 0.165361 |
| C | 1.693700 | −0.388898 | −0.095454 |
| C | 2.441717 | −1.557299 | −0.349199 |
| C | 3.827594 | −1.562122 | −0.349000 |
| C | 4.514158 | −0.378474 | −0.088096 |
| H | 4.347077 | 1.716309 | 0.372584 |
| O | 1.745173 | 1.984038 | 0.432620 |
| H | 2.398490 | 2.669674 | 0.624534 |
| H | 1.903220 | −2.476370 | −0.551158 |
| H | 4.369076 | −2.477677 | −0.549124 |
| H | 5.597102 | −0.360518 | −0.082364 |
| C | 0.242817 | −0.527305 | −0.130940 |
| H | −0.104567 | −1.546850 | −0.313774 |
| C | −3.905992 | −1.250689 | 0.648640 |
| C | −2.534489 | −1.013055 | 0.666218 |
| C | −2.014242 | 0.104830 | 0.002777 |
| C | −2.880585 | 0.989700 | −0.651060 |
| C | −4.249211 | 0.739706 | −0.672097 |
| C | −4.764811 | −0.380882 | −0.022028 |
| H | −4.305387 | −2.111268 | 1.171992 |
| H | −1.878229 | −1.671388 | 1.223788 |
| H | −2.478241 | 1.845659 | −1.185427 |
| H | −4.911374 | 1.417135 | −1.197782 |
| H | −5.831249 | −0.570344 | −0.030469 |
| N | −0.622663 | 0.416970 | 0.009749 |