| N | −0.961444 | −3.788063 | −4.511231 |
| O | −1.874927 | −4.135456 | −5.237541 |
| N | 0.553258 | −0.882956 | −0.866028 |
| O | 0.742598 | 0.316015 | −0.847540 |
| O | −4.681832 | −0.585788 | −1.215905 |
| O | 1.212620 | −1.733679 | −0.293067 |
| O | 0.183544 | −4.202496 | −4.554013 |
| H | −3.325312 | −2.602840 | −4.068170 |
| H | 0.732389 | −2.758442 | −2.705299 |
| N | −2.689827 | 1.335506 | −0.843361 |
| O | −3.094725 | 1.997201 | 0.072601 |
| O | −2.692834 | 1.589966 | −2.027186 |
| H | −2.426752 | −2.251295 | 3.151900 |
| N | −1.119312 | −0.070805 | 4.209929 |
| O | −0.573665 | 0.983806 | 4.432210 |
| O | −1.348838 | −0.973428 | 5.008398 |