DSA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C21 | doub | 1.41Å | 1.42Å | Aromatic |
| C20 | C25 | sing | 1.40Å | 1.41Å | Aromatic |
| C20 | C19 | sing | 1.42Å | 1.45Å | Aromatic |
| C21 | C22 | sing | 1.39Å | 1.41Å | Aromatic |
| C21 | N17 | sing | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.41Å | Aromatic |
| C22 | O22 | sing | 1.36Å | 1.38Å | |
| C23 | C24 | sing | 1.40Å | 1.41Å | Aromatic |
| C23 | O23 | sing | 1.36Å | 1.38Å | |
| C24 | C25 | doub | 1.38Å | 1.41Å | Aromatic |
| C24 | O24 | sing | 1.36Å | 1.39Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C18 | C19 | doub | 1.36Å | 1.40Å | Aromatic |
| C18 | C16 | sing | 1.47Å | 1.47Å | |
| C18 | N17 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.07Å | |
| C16 | N12 | sing | 1.35Å | 1.40Å | |
| C16 | O16 | doub | 1.22Å | 1.23Å | |
| C6 | C7 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C5 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | O6 | sing | 1.36Å | 1.37Å | |
| C7 | C8 | doub | 1.40Å | 1.42Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | N12 | sing | 1.40Å | 1.39Å | |
| C11 | C10 | sing | 1.54Å | 1.53Å | |
| C11 | N12 | sing | 1.46Å | 1.49Å | |
| C11 | H111 | sing | 1.09Å | 1.09Å | |
| C11 | H112 | sing | 1.09Å | 1.09Å | |
| C10 | C13 | sing | 1.53Å | 1.55Å | |
| C10 | C9 | sing | 1.51Å | 1.49Å | |
| C10 | H10 | sing | 1.09Å | 1.09Å | |
| C13 | H131 | sing | 1.09Å | 1.09Å | |
| C13 | H132 | sing | 1.09Å | 1.08Å | |
| C13 | H133 | sing | 1.09Å | 1.12Å | |
| C9 | C4 | doub | 1.40Å | 1.39Å | Aromatic |
| C26 | O22 | sing | 1.43Å | 1.42Å | |
| C26 | H261 | sing | 1.09Å | 1.09Å | |
| C26 | H262 | sing | 1.09Å | 1.09Å | |
| C26 | H263 | sing | 1.09Å | 1.09Å | |
| C27 | O23 | sing | 1.43Å | 1.41Å | |
| C27 | H271 | sing | 1.09Å | 1.09Å | |
| C27 | H272 | sing | 1.09Å | 1.09Å | |
| C27 | H273 | sing | 1.09Å | 1.09Å | |
| C5 | C4 | sing | 1.41Å | 1.42Å | Aromatic |
| C5 | N1 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | C3 | sing | 1.42Å | 1.46Å | Aromatic |
| C3 | C2 | doub | 1.36Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | C14 | sing | 1.47Å | 1.46Å | |
| C2 | N1 | sing | 1.38Å | 1.38Å | Aromatic |
| C14 | O15 | sing | 1.35Å | 1.39Å | |
| C14 | O14 | doub | 1.22Å | 1.23Å | |
| C28 | O24 | sing | 1.43Å | 1.42Å | |
| C28 | H281 | sing | 1.09Å | 1.09Å | |
| C28 | H282 | sing | 1.09Å | 1.09Å | |
| C28 | H283 | sing | 1.09Å | 1.09Å | |
| C15 | O15 | sing | 1.45Å | 1.42Å | |
| C15 | H151 | sing | 1.09Å | 1.09Å | |
| C15 | H152 | sing | 1.09Å | 1.09Å | |
| C15 | H153 | sing | 1.09Å | 1.09Å | |
| N17 | H17 | sing | 0.97Å | 1.01Å | |
| N1 | H1 | sing | 0.97Å | 1.01Å | |
| O6 | H6 | sing | 0.97Å | 0.96Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C25 | 117.8° | 119.9° |
| C21 | C20 | C19 | 107.8° | 107.0° |
| C20 | C21 | C22 | 122.0° | 119.6° |
| C20 | C21 | N17 | 106.3° | 107.4° |
| C25 | C20 | C19 | 134.4° | 133.1° |
| C20 | C25 | C24 | 120.9° | 119.8° |
| C20 | C25 | H25 | 118.0° | 120.1° |
| C20 | C19 | C18 | 106.5° | 107.8° |
| C20 | C19 | H19 | 126.7° | 126.2° |
| C22 | C21 | N17 | 131.7° | 133.0° |
| C21 | C22 | C23 | 118.7° | 119.9° |
| C21 | C22 | O22 | 118.4° | 120.0° |
| C21 | N17 | C18 | 111.4° | 108.7° |
| C21 | N17 | H17 | 127.0° | 125.7° |
| C23 | C22 | O22 | 122.9° | 120.1° |
| C22 | C23 | C24 | 120.4° | 120.5° |
| C22 | C23 | O23 | 120.1° | 119.8° |
| C22 | O22 | C26 | 116.0° | 106.8° |
| C24 | C23 | O23 | 119.5° | 119.7° |
| C23 | C24 | C25 | 120.0° | 120.4° |
| C23 | C24 | O24 | 116.2° | 119.8° |
| C23 | O23 | C27 | 115.3° | 106.8° |
| C25 | C24 | O24 | 123.8° | 119.8° |
| C24 | C25 | H25 | 121.1° | 120.1° |
| C24 | O24 | C28 | 118.1° | 106.8° |
| C19 | C18 | C16 | 132.2° | 125.5° |
| C19 | C18 | N17 | 107.9° | 109.1° |
| C18 | C19 | H19 | 126.7° | 126.1° |
| C16 | C18 | N17 | 119.9° | 125.4° |
| C18 | C16 | N12 | 124.8° | 120.0° |
| C18 | C16 | O16 | 117.6° | 120.0° |
| C18 | N17 | H17 | 121.5° | 125.6° |
| N12 | C16 | O16 | 117.6° | 120.0° |
| C16 | N12 | C8 | 129.4° | 125.0° |
| C16 | N12 | C11 | 122.3° | 125.0° |
| C7 | C6 | C5 | 119.0° | 120.1° |
| C7 | C6 | O6 | 122.2° | 119.9° |
| C6 | C7 | C8 | 119.3° | 121.0° |
| C6 | C7 | H7 | 119.0° | 119.5° |
| C5 | C6 | O6 | 118.6° | 120.0° |
| C6 | C5 | C4 | 120.3° | 119.3° |
| C6 | C5 | N1 | 132.1° | 133.3° |
| C6 | O6 | H6 | 112.6° | 106.8° |
| C8 | C7 | H7 | 121.8° | 119.6° |
| C7 | C8 | C9 | 121.8° | 119.4° |
| C7 | C8 | N12 | 130.5° | 128.9° |
| C9 | C8 | N12 | 107.6° | 111.7° |
| C8 | C9 | C10 | 116.9° | 108.7° |
| C8 | C9 | C4 | 119.1° | 120.3° |
| C8 | N12 | C11 | 108.0° | 110.0° |
| C10 | C11 | N12 | 110.0° | 105.0° |
| C10 | C11 | H111 | 109.5° | 110.3° |
| C10 | C11 | H112 | 106.9° | 110.3° |
| C11 | C10 | C13 | 112.8° | 110.4° |
| C11 | C10 | C9 | 97.2° | 104.6° |
| C11 | C10 | H10 | 113.5° | 110.4° |
| N12 | C11 | H111 | 110.6° | 110.3° |
| N12 | C11 | H112 | 108.2° | 110.3° |
| H111 | C11 | H112 | 111.5° | 110.4° |
| C13 | C10 | C9 | 104.5° | 110.5° |
| C13 | C10 | H10 | 113.4° | 110.3° |
| C10 | C13 | H131 | 108.9° | 109.5° |
| C10 | C13 | H132 | 106.2° | 109.5° |
| C10 | C13 | H133 | 110.9° | 109.5° |
| C9 | C10 | H10 | 114.0° | 110.4° |
| C10 | C9 | C4 | 124.0° | 131.0° |
| H131 | C13 | H132 | 109.6° | 109.5° |
| H131 | C13 | H133 | 87.1° | 109.5° |
| H132 | C13 | H133 | 131.2° | 109.4° |
| C9 | C4 | C5 | 120.2° | 119.9° |
| C9 | C4 | C3 | 133.1° | 133.2° |
| O22 | C26 | H261 | 108.7° | 109.5° |
| O22 | C26 | H262 | 111.0° | 109.5° |
| O22 | C26 | H263 | 110.1° | 109.5° |
| H261 | C26 | H262 | 108.5° | 109.5° |
| H261 | C26 | H263 | 108.8° | 109.5° |
| H262 | C26 | H263 | 109.6° | 109.5° |
| O23 | C27 | H271 | 108.9° | 109.5° |
| O23 | C27 | H272 | 110.3° | 109.5° |
| O23 | C27 | H273 | 110.2° | 109.5° |
| H271 | C27 | H272 | 108.9° | 109.4° |
| H271 | C27 | H273 | 108.9° | 109.5° |
| H272 | C27 | H273 | 109.5° | 109.4° |
| C4 | C5 | N1 | 107.6° | 107.4° |
| C5 | C4 | C3 | 106.7° | 107.0° |
| C5 | N1 | C2 | 110.1° | 108.7° |
| C5 | N1 | H1 | 127.0° | 125.6° |
| C4 | C3 | C2 | 106.6° | 107.7° |
| C4 | C3 | H3 | 129.8° | 126.1° |
| C2 | C3 | H3 | 123.6° | 126.2° |
| C3 | C2 | C14 | 127.1° | 125.4° |
| C3 | C2 | N1 | 109.0° | 109.1° |
| C14 | C2 | N1 | 123.9° | 125.5° |
| C2 | C14 | O15 | 115.4° | 120.0° |
| C2 | C14 | O14 | 123.9° | 120.0° |
| C2 | N1 | H1 | 122.9° | 125.7° |
| O15 | C14 | O14 | 120.7° | 120.0° |
| C14 | O15 | C15 | 117.5° | 120.0° |
| O24 | C28 | H281 | 110.8° | 109.4° |
| O24 | C28 | H282 | 110.4° | 109.5° |
| O24 | C28 | H283 | 108.7° | 109.4° |
| H281 | C28 | H282 | 110.0° | 109.5° |
| H281 | C28 | H283 | 108.2° | 109.5° |
| H282 | C28 | H283 | 108.7° | 109.5° |
| O15 | C15 | H151 | 108.9° | 109.5° |
| O15 | C15 | H152 | 110.3° | 109.4° |
| O15 | C15 | H153 | 110.4° | 109.5° |
| H151 | C15 | H152 | 108.7° | 109.5° |
| H151 | C15 | H153 | 108.8° | 109.5° |
| H152 | C15 | H153 | 109.8° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C25 | C19 | 177.8° | 179.8° |
| C20 | C21 | C22 | N17 | 177.3° | 179.9° |
| C20 | C21 | C22 | C23 | 0.5° | 0.1° |
| C20 | C21 | C22 | O22 | 179.1° | 180.0° |
| C21 | C20 | C25 | C24 | 0.2° | 0.0° |
| C21 | C20 | C25 | H25 | 179.2° | 180.0° |
| C21 | C20 | C19 | C18 | 3.8° | 0.3° |
| C20 | C21 | N17 | C18 | 0.3° | 0.0° |
| C21 | C20 | C19 | H19 | 179.5° | 180.0° |
| C20 | C21 | N17 | H17 | 178.5° | 180.0° |
| C25 | C20 | C21 | C22 | 1.8° | 0.1° |
| C25 | C20 | C21 | N17 | 176.1° | 180.0° |
| C20 | C25 | C24 | C23 | 3.5° | 0.0° |
| C20 | C25 | C24 | H25 | 178.9° | 179.9° |
| C20 | C25 | C24 | O24 | 177.1° | 180.0° |
| C25 | C20 | C19 | C18 | 174.1° | 179.9° |
| C25 | C20 | C19 | H19 | 2.6° | 0.2° |
| C19 | C20 | C21 | C22 | 179.9° | 179.8° |
| C19 | C20 | C21 | N17 | 2.2° | 0.2° |
| C19 | C20 | C25 | C24 | 177.5° | 179.7° |
| C19 | C20 | C25 | H25 | 1.4° | 0.2° |
| C20 | C19 | C18 | H19 | 176.7° | 179.7° |
| C20 | C19 | C18 | C16 | 175.0° | 179.9° |
| C20 | C19 | C18 | N17 | 3.9° | 0.3° |
| C21 | C22 | C23 | O22 | 179.5° | 179.9° |
| C21 | C22 | C23 | C24 | 2.8° | 0.1° |
| C21 | C22 | C23 | O23 | 175.4° | 179.9° |
| C22 | C21 | N17 | C18 | 177.4° | 179.9° |
| C21 | C22 | O22 | C26 | 112.5° | 85.0° |
| C22 | C21 | N17 | H17 | 0.9° | 0.0° |
| N17 | C21 | C22 | C23 | 176.8° | 180.0° |
| N17 | C21 | C22 | O22 | 3.6° | 0.1° |
| C21 | N17 | C18 | C19 | 2.7° | 0.2° |
| C21 | N17 | C18 | C16 | 176.4° | 180.0° |
| C21 | N17 | C18 | H17 | 178.4° | 180.0° |
| C22 | C23 | C24 | O23 | 178.3° | 180.0° |
| C22 | C23 | C24 | C25 | 4.8° | 0.0° |
| C22 | C23 | C24 | O24 | 175.7° | 180.0° |
| C23 | C22 | O22 | C26 | 67.9° | 94.9° |
| C22 | C23 | O23 | C27 | 84.1° | 94.8° |
| O22 | C22 | C23 | C24 | 177.6° | 180.0° |
| O22 | C22 | C23 | O23 | 4.1° | 0.0° |
| C22 | O22 | C26 | H261 | 174.6° | 175.0° |
| C22 | O22 | C26 | H262 | 66.1° | 55.0° |
| C22 | O22 | C26 | H263 | 55.5° | 65.0° |
| C23 | C24 | C25 | O24 | 179.4° | 179.9° |
| C23 | C24 | C25 | H25 | 177.6° | 180.0° |
| C24 | C23 | O23 | C27 | 94.2° | 85.2° |
| C23 | C24 | O24 | C28 | 165.8° | 180.0° |
| O23 | C23 | C24 | C25 | 173.4° | 179.9° |
| O23 | C23 | C24 | O24 | 6.0° | 0.0° |
| C23 | O23 | C27 | H271 | 179.6° | 175.1° |
| C23 | O23 | C27 | H272 | 60.9° | 64.9° |
| C23 | O23 | C27 | H273 | 60.1° | 55.0° |
| C25 | C24 | O24 | C28 | 14.8° | 0.0° |
| O24 | C24 | C25 | H25 | 1.8° | 0.1° |
| C24 | O24 | C28 | H281 | 66.8° | 180.0° |
| C24 | O24 | C28 | H282 | 55.3° | 60.0° |
| C24 | O24 | C28 | H283 | 174.4° | 60.0° |
| C19 | C18 | C16 | N17 | 178.8° | 179.8° |
| C19 | C18 | C16 | N12 | 6.8° | 174.5° |
| C19 | C18 | C16 | O16 | 173.1° | 5.6° |
| C19 | C18 | N17 | H17 | 178.9° | 179.8° |
| C16 | C18 | C19 | H19 | 1.7° | 0.2° |
| C18 | C16 | N12 | O16 | 179.9° | 179.9° |
| C18 | C16 | N12 | C8 | 175.4° | 175.1° |
| C18 | C16 | N12 | C11 | 11.3° | 4.9° |
| C16 | C18 | N17 | H17 | 2.0° | 0.0° |
| N17 | C18 | C19 | H19 | 179.4° | 180.0° |
| N17 | C18 | C16 | N12 | 174.4° | 5.7° |
| N17 | C18 | C16 | O16 | 5.7° | 174.2° |
| C16 | N12 | C8 | C7 | 9.8° | 0.1° |
| C16 | N12 | C8 | C9 | 169.7° | 180.0° |
| C16 | N12 | C8 | C11 | 174.0° | 180.0° |
| C16 | N12 | C11 | C10 | 171.3° | 180.0° |
| C16 | N12 | C11 | H111 | 50.2° | 61.2° |
| C16 | N12 | C11 | H112 | 72.2° | 61.2° |
| O16 | C16 | N12 | C8 | 4.5° | 5.0° |
| O16 | C16 | N12 | C11 | 168.8° | 175.0° |
| C7 | C6 | C5 | O6 | 176.1° | 180.0° |
| C6 | C7 | C8 | H7 | 178.5° | 179.9° |
| C6 | C7 | C8 | C9 | 0.8° | 0.0° |
| C6 | C7 | C8 | N12 | 179.8° | 180.0° |
| C7 | C6 | C5 | C4 | 4.0° | 0.0° |
| C7 | C6 | C5 | N1 | 177.5° | 180.0° |
| C7 | C6 | O6 | H6 | 0.7° | 90.0° |
| C5 | C6 | C7 | C8 | 4.9° | 0.0° |
| C5 | C6 | C7 | H7 | 176.6° | 179.9° |
| C6 | C5 | C4 | C9 | 1.0° | 0.0° |
| C6 | C5 | C4 | N1 | 178.8° | 180.0° |
| C6 | C5 | C4 | C3 | 180.0° | 179.7° |
| C6 | C5 | N1 | C2 | 179.5° | 179.9° |
| C6 | C5 | N1 | H1 | 0.7° | 0.0° |
| C5 | C6 | O6 | H6 | 176.7° | 90.1° |
| O6 | C6 | C7 | C8 | 179.1° | 180.0° |
| O6 | C6 | C7 | H7 | 0.6° | 0.1° |
| O6 | C6 | C5 | C4 | 179.8° | 180.0° |
| O6 | C6 | C5 | N1 | 1.4° | 0.0° |
| C7 | C8 | C9 | N12 | 179.5° | 180.0° |
| C7 | C8 | N12 | C11 | 176.2° | 179.9° |
| C7 | C8 | C9 | C10 | 176.2° | 180.0° |
| C7 | C8 | C9 | C4 | 4.3° | 0.0° |
| H7 | C7 | C8 | C9 | 179.3° | 180.0° |
| H7 | C7 | C8 | N12 | 1.4° | 0.1° |
| C8 | C9 | C10 | C11 | 2.1° | 0.0° |
| C9 | C8 | N12 | C11 | 4.4° | 0.0° |
| C8 | C9 | C10 | C13 | 113.8° | 118.8° |
| C8 | C9 | C10 | C4 | 179.5° | 180.0° |
| C8 | C9 | C10 | H10 | 121.9° | 118.8° |
| C8 | C9 | C4 | C5 | 5.1° | 0.0° |
| C8 | C9 | C4 | C3 | 176.2° | 179.7° |
| C8 | N12 | C11 | C10 | 3.2° | 0.0° |
| C8 | N12 | C11 | H111 | 124.3° | 118.8° |
| C8 | N12 | C11 | H112 | 113.2° | 118.8° |
| N12 | C8 | C9 | C10 | 4.3° | 0.0° |
| N12 | C8 | C9 | C4 | 175.2° | 180.0° |
| C10 | C11 | N12 | H111 | 121.1° | 118.8° |
| C10 | C11 | N12 | H112 | 116.4° | 118.9° |
| C10 | C11 | H111 | H112 | 118.1° | 122.2° |
| C11 | C10 | C13 | C9 | 104.4° | 115.3° |
| C11 | C10 | C13 | H10 | 130.8° | 122.3° |
| C11 | C10 | C9 | H10 | 119.8° | 118.8° |
| C11 | C10 | C13 | H131 | 39.6° | 61.4° |
| C11 | C10 | C13 | H132 | 157.5° | 178.6° |
| C11 | C10 | C13 | H133 | 54.7° | 58.6° |
| C11 | C10 | C9 | C4 | 177.4° | 180.0° |
| N12 | C11 | H111 | H112 | 120.5° | 122.3° |
| N12 | C11 | C10 | C13 | 109.8° | 118.9° |
| N12 | C11 | C10 | C9 | 0.7° | 0.0° |
| N12 | C11 | C10 | H10 | 119.4° | 118.8° |
| H111 | C11 | C10 | C13 | 128.4° | 0.1° |
| H111 | C11 | C10 | C9 | 122.5° | 118.9° |
| H111 | C11 | C10 | H10 | 2.3° | 122.3° |
| H112 | C11 | C10 | C13 | 7.4° | 122.2° |
| H112 | C11 | C10 | C9 | 116.5° | 118.9° |
| H112 | C11 | C10 | H10 | 123.3° | 0.1° |
| C13 | C10 | C9 | H10 | 124.3° | 122.4° |
| C10 | C13 | H131 | H132 | 115.8° | 120.1° |
| C10 | C13 | H131 | H133 | 111.2° | 120.0° |
| C10 | C13 | H132 | H133 | 138.6° | 120.0° |
| C13 | C10 | C9 | C4 | 66.7° | 61.2° |
| C9 | C10 | C13 | H131 | 64.9° | 176.7° |
| C9 | C10 | C13 | H132 | 53.1° | 63.3° |
| C9 | C10 | C13 | H133 | 159.1° | 56.7° |
| C10 | C9 | C4 | C5 | 175.4° | 180.0° |
| C10 | C9 | C4 | C3 | 3.3° | 0.3° |
| H10 | C10 | C13 | H131 | 170.4° | 60.9° |
| H10 | C10 | C13 | H132 | 71.7° | 59.1° |
| H10 | C10 | C13 | H133 | 76.1° | 179.1° |
| H10 | C10 | C9 | C4 | 57.6° | 61.2° |
| H131 | C13 | H132 | H133 | 103.9° | 120.0° |
| C9 | C4 | C5 | C3 | 179.0° | 179.7° |
| C9 | C4 | C5 | N1 | 177.8° | 180.0° |
| C9 | C4 | C3 | C2 | 177.7° | 179.9° |
| C9 | C4 | C3 | H3 | 0.9° | 0.0° |
| O22 | C26 | H261 | H262 | 120.8° | 120.0° |
| O22 | C26 | H261 | H263 | 119.9° | 120.0° |
| O22 | C26 | H262 | H263 | 121.9° | 120.0° |
| H261 | C26 | H262 | H263 | 118.7° | 120.0° |
| O23 | C27 | H271 | H272 | 120.4° | 120.0° |
| O23 | C27 | H271 | H273 | 120.3° | 120.1° |
| O23 | C27 | H272 | H273 | 121.5° | 120.0° |
| H271 | C27 | H272 | H273 | 119.0° | 120.0° |
| C5 | C4 | C3 | C2 | 1.1° | 0.4° |
| C5 | C4 | C3 | H3 | 179.7° | 179.7° |
| C4 | C5 | N1 | C2 | 0.9° | 0.1° |
| C4 | C5 | N1 | H1 | 179.3° | 180.0° |
| N1 | C5 | C4 | C3 | 1.2° | 0.3° |
| C5 | N1 | C2 | C3 | 0.2° | 0.2° |
| C5 | N1 | C2 | C14 | 179.9° | 180.0° |
| C5 | N1 | C2 | H1 | 179.8° | 179.9° |
| C4 | C3 | C2 | H3 | 178.7° | 179.9° |
| C4 | C3 | C2 | C14 | 179.1° | 179.8° |
| C4 | C3 | C2 | N1 | 0.6° | 0.4° |
| C3 | C2 | C14 | N1 | 179.6° | 179.8° |
| C3 | C2 | C14 | O15 | 7.2° | 179.7° |
| C3 | C2 | C14 | O14 | 173.2° | 0.2° |
| C3 | C2 | N1 | H1 | 180.0° | 179.7° |
| H3 | C3 | C2 | C14 | 0.4° | 0.1° |
| H3 | C3 | C2 | N1 | 179.3° | 179.8° |
| C2 | C14 | O15 | O14 | 179.7° | 179.9° |
| C2 | C14 | O15 | C15 | 173.6° | 180.0° |
| C14 | C2 | N1 | H1 | 0.3° | 0.1° |
| N1 | C2 | C14 | O15 | 173.2° | 0.1° |
| N1 | C2 | C14 | O14 | 6.4° | 180.0° |
| C14 | O15 | C15 | H151 | 178.5° | 180.0° |
| C14 | O15 | C15 | H152 | 59.3° | 59.9° |
| C14 | O15 | C15 | H153 | 62.2° | 60.0° |
| O14 | C14 | O15 | C15 | 6.1° | 0.0° |
| O24 | C28 | H281 | H282 | 122.3° | 120.0° |
| O24 | C28 | H281 | H283 | 119.0° | 119.9° |
| O24 | C28 | H282 | H283 | 119.1° | 120.0° |
| H281 | C28 | H282 | H283 | 118.3° | 120.0° |
| O15 | C15 | H151 | H152 | 120.2° | 120.0° |
| O15 | C15 | H151 | H153 | 120.3° | 120.0° |
| O15 | C15 | H152 | H153 | 121.9° | 119.9° |
| H151 | C15 | H152 | H153 | 118.8° | 120.0° |
