5D0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C29 | sing | 1.53Å | 1.52Å | |
| C30 | C31 | sing | 1.53Å | 1.52Å | |
| C29 | N24 | sing | 1.47Å | 1.45Å | |
| C26 | N22 | sing | 1.46Å | 1.45Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C31 | N25 | sing | 1.46Å | 1.46Å | |
| N22 | C21 | doub | 1.29Å | 1.26Å | |
| N24 | C20 | sing | 1.38Å | 1.33Å | |
| N25 | C20 | doub | 1.29Å | 1.26Å | |
| C27 | C28 | sing | 1.53Å | 1.53Å | |
| C20 | C11 | sing | 1.48Å | 1.50Å | |
| C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C11 | doub | 1.40Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
| C21 | C17 | sing | 1.48Å | 1.50Å | |
| C21 | N23 | sing | 1.38Å | 1.33Å | |
| C9 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | C16 | doub | 1.40Å | 1.39Å | Aromatic |
| C28 | N23 | sing | 1.47Å | 1.45Å | |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C13 | sing | 1.39Å | 1.40Å | Aromatic |
| C8 | O6 | sing | 1.36Å | 1.37Å | |
| C14 | O7 | sing | 1.36Å | 1.37Å | |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C1 | O7 | sing | 1.43Å | 1.43Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| O6 | C5 | sing | 1.43Å | 1.43Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| C13 | H10 | sing | 1.08Å | 1.08Å | |
| C15 | H11 | sing | 1.08Å | 1.08Å | |
| C16 | H12 | sing | 1.08Å | 1.08Å | |
| C19 | H13 | sing | 1.08Å | 1.08Å | |
| N23 | H15 | sing | 0.97Å | 1.00Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C30 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.09Å | 1.10Å | |
| C31 | H21 | sing | 1.09Å | 1.10Å | |
| C31 | H22 | sing | 1.09Å | 1.10Å | |
| C4 | H23 | sing | 1.09Å | 1.10Å | |
| C4 | H24 | sing | 1.09Å | 1.10Å | |
| C5 | H25 | sing | 1.09Å | 1.10Å | |
| C5 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.08Å | 1.08Å | |
| N24 | H30 | sing | 0.97Å | 1.00Å | |
| C26 | H31 | sing | 1.09Å | 1.10Å | |
| C26 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C28 | H34 | sing | 1.09Å | 1.10Å | |
| C29 | H35 | sing | 1.09Å | 1.10Å | |
| C29 | H36 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C29 | C30 | C31 | 109.4° | 108.6° |
| C30 | C29 | N24 | 111.6° | 107.4° |
| C29 | C30 | H19 | 109.5° | 109.6° |
| C29 | C30 | H20 | 109.5° | 109.6° |
| C30 | C29 | H35 | 109.0° | 109.9° |
| C30 | C29 | H36 | 108.9° | 109.9° |
| C30 | C31 | N25 | 103.6° | 110.6° |
| C31 | C30 | H19 | 109.5° | 109.6° |
| C31 | C30 | H20 | 109.5° | 109.5° |
| C30 | C31 | H21 | 110.9° | 109.3° |
| C30 | C31 | H22 | 110.9° | 109.3° |
| C29 | N24 | C20 | 122.2° | 118.7° |
| C29 | N24 | H30 | 118.9° | 120.6° |
| N24 | C29 | H35 | 108.9° | 109.7° |
| N24 | C29 | H36 | 108.9° | 110.0° |
| N22 | C26 | C27 | 105.5° | 110.6° |
| C26 | N22 | C21 | 126.9° | 123.8° |
| N22 | C26 | H31 | 110.5° | 109.3° |
| N22 | C26 | H32 | 110.4° | 109.3° |
| C26 | C27 | C28 | 112.3° | 108.6° |
| C26 | C27 | H17 | 108.7° | 109.7° |
| C26 | C27 | H18 | 108.8° | 109.6° |
| C27 | C26 | H31 | 110.4° | 109.2° |
| C27 | C26 | H32 | 110.5° | 109.2° |
| C31 | N25 | C20 | 126.9° | 123.7° |
| N25 | C31 | H21 | 110.9° | 109.2° |
| N25 | C31 | H22 | 110.9° | 109.2° |
| N22 | C21 | C17 | 120.0° | 118.9° |
| N22 | C21 | N23 | 119.4° | 122.3° |
| N24 | C20 | N25 | 119.5° | 122.3° |
| N24 | C20 | C11 | 119.7° | 118.9° |
| C20 | N24 | H30 | 118.9° | 120.7° |
| N25 | C20 | C11 | 120.8° | 118.9° |
| C27 | C28 | N23 | 113.5° | 107.4° |
| C28 | C27 | H17 | 108.7° | 109.6° |
| C28 | C27 | H18 | 108.8° | 109.6° |
| C27 | C28 | H33 | 108.4° | 109.9° |
| C27 | C28 | H34 | 108.4° | 109.9° |
| C20 | C11 | C10 | 118.8° | 120.1° |
| C20 | C11 | C12 | 121.5° | 120.1° |
| C19 | C18 | C17 | 120.5° | 119.9° |
| C18 | C19 | C14 | 119.7° | 120.1° |
| C18 | C19 | H13 | 120.2° | 120.0° |
| C19 | C18 | H27 | 119.7° | 120.1° |
| C18 | C17 | C21 | 120.2° | 120.1° |
| C18 | C17 | C16 | 119.8° | 119.8° |
| C17 | C18 | H27 | 119.8° | 120.0° |
| C11 | C10 | C9 | 120.8° | 120.0° |
| C10 | C11 | C12 | 119.7° | 119.8° |
| C11 | C10 | H8 | 119.6° | 120.0° |
| C10 | C9 | C8 | 119.7° | 120.0° |
| C10 | C9 | H7 | 120.1° | 120.0° |
| C9 | C10 | H8 | 119.6° | 120.0° |
| C19 | C14 | O7 | 120.7° | 119.9° |
| C19 | C14 | C15 | 119.7° | 120.2° |
| C14 | C19 | H13 | 120.1° | 119.9° |
| C11 | C12 | C13 | 119.7° | 119.9° |
| C11 | C12 | H9 | 120.2° | 120.0° |
| C17 | C21 | N23 | 120.5° | 118.8° |
| C21 | C17 | C16 | 120.0° | 120.1° |
| C21 | N23 | C28 | 121.3° | 118.7° |
| C21 | N23 | H15 | 119.3° | 120.7° |
| C9 | C8 | C13 | 119.9° | 120.2° |
| C9 | C8 | O6 | 118.5° | 119.9° |
| C8 | C9 | H7 | 120.2° | 119.9° |
| C17 | C16 | C15 | 119.6° | 119.9° |
| C17 | C16 | H12 | 120.2° | 120.1° |
| C28 | N23 | H15 | 119.4° | 120.7° |
| N23 | C28 | H33 | 108.5° | 110.0° |
| N23 | C28 | H34 | 108.4° | 109.7° |
| C12 | C13 | C8 | 120.2° | 120.0° |
| C13 | C12 | H9 | 120.1° | 120.1° |
| C12 | C13 | H10 | 119.9° | 119.9° |
| C13 | C8 | O6 | 121.6° | 119.9° |
| C8 | C13 | H10 | 119.9° | 120.0° |
| C8 | O6 | C5 | 122.1° | 117.0° |
| O7 | C14 | C15 | 119.6° | 119.9° |
| C14 | O7 | C1 | 121.2° | 117.0° |
| C14 | C15 | C16 | 120.7° | 120.0° |
| C14 | C15 | H11 | 119.6° | 120.0° |
| C2 | C3 | C4 | 111.8° | 109.5° |
| C3 | C2 | C1 | 112.0° | 109.5° |
| C3 | C2 | H3 | 108.8° | 109.5° |
| C3 | C2 | H4 | 108.8° | 109.4° |
| C2 | C3 | H5 | 108.9° | 109.5° |
| C2 | C3 | H6 | 108.9° | 109.4° |
| C3 | C4 | C5 | 111.2° | 109.5° |
| C4 | C3 | H5 | 108.9° | 109.5° |
| C4 | C3 | H6 | 108.9° | 109.5° |
| C3 | C4 | H23 | 109.0° | 109.5° |
| C3 | C4 | H24 | 109.1° | 109.4° |
| O7 | C1 | C2 | 108.9° | 109.5° |
| O7 | C1 | H1 | 109.6° | 109.5° |
| O7 | C1 | H2 | 109.6° | 109.4° |
| C2 | C1 | H1 | 109.6° | 109.5° |
| C2 | C1 | H2 | 109.6° | 109.5° |
| C1 | C2 | H3 | 108.8° | 109.5° |
| C1 | C2 | H4 | 108.8° | 109.5° |
| O6 | C5 | C4 | 109.3° | 109.5° |
| O6 | C5 | H25 | 109.5° | 109.5° |
| O6 | C5 | H26 | 109.5° | 109.5° |
| C5 | C4 | H23 | 109.0° | 109.5° |
| C5 | C4 | H24 | 109.0° | 109.5° |
| C4 | C5 | H25 | 109.5° | 109.5° |
| C4 | C5 | H26 | 109.5° | 109.5° |
| C16 | C15 | H11 | 119.7° | 120.0° |
| C15 | C16 | H12 | 120.2° | 120.0° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H3 | C2 | H4 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H17 | C27 | H18 | 109.5° | 109.7° |
| H19 | C30 | H20 | 109.5° | 109.8° |
| H21 | C31 | H22 | 109.5° | 109.2° |
| H23 | C4 | H24 | 109.4° | 109.4° |
| H25 | C5 | H26 | 109.5° | 109.4° |
| H31 | C26 | H32 | 109.5° | 109.2° |
| H33 | C28 | H34 | 109.5° | 110.0° |
| H35 | C29 | H36 | 109.5° | 109.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C29 | C30 | C31 | H19 | 120.0° | 119.8° |
| C29 | C30 | C31 | H20 | 120.0° | 119.7° |
| C30 | C29 | N24 | H35 | 120.3° | 119.4° |
| C30 | C29 | N24 | H36 | 120.3° | 119.6° |
| C29 | C30 | C31 | N25 | 56.2° | 49.4° |
| C30 | C29 | N24 | C20 | 14.3° | 42.3° |
| C29 | C30 | H19 | H20 | 120.0° | 120.5° |
| C29 | C30 | C31 | H21 | 62.9° | 70.9° |
| C29 | C30 | C31 | H22 | 175.3° | 169.6° |
| C30 | C29 | N24 | H30 | 165.8° | 137.7° |
| C30 | C29 | H35 | H36 | 119.1° | 121.0° |
| C31 | C30 | C29 | N24 | 46.8° | 59.3° |
| C30 | C31 | N25 | H21 | 119.1° | 120.4° |
| C30 | C31 | N25 | H22 | 119.0° | 120.3° |
| C30 | C31 | N25 | C20 | 41.2° | 20.9° |
| C31 | C30 | H19 | H20 | 120.0° | 120.3° |
| C30 | C31 | H21 | H22 | 122.7° | 119.5° |
| C31 | C30 | C29 | H35 | 167.2° | 60.0° |
| C31 | C30 | C29 | H36 | 73.5° | 179.0° |
| C29 | N24 | C20 | H30 | 180.0° | 180.0° |
| C29 | N24 | C20 | N25 | 6.6° | 13.1° |
| C29 | N24 | C20 | C11 | 173.1° | 167.2° |
| N24 | C29 | C30 | H19 | 166.9° | 179.1° |
| N24 | C29 | C30 | H20 | 73.1° | 60.2° |
| N24 | C29 | H35 | H36 | 119.0° | 121.1° |
| N22 | C26 | C27 | H31 | 119.4° | 120.3° |
| N22 | C26 | C27 | H32 | 119.4° | 120.3° |
| N22 | C26 | C27 | C28 | 45.8° | 49.4° |
| C26 | N22 | C21 | C17 | 150.1° | 179.0° |
| C26 | N22 | C21 | N23 | 28.5° | 1.3° |
| N22 | C26 | C27 | H17 | 74.6° | 169.1° |
| N22 | C26 | C27 | H18 | 166.3° | 70.4° |
| N22 | C26 | H31 | H32 | 121.8° | 119.5° |
| C27 | C26 | N22 | C21 | 43.9° | 20.9° |
| C26 | C27 | C28 | H17 | 120.4° | 119.8° |
| C26 | C27 | C28 | H18 | 120.4° | 119.8° |
| C26 | C27 | C28 | N23 | 39.6° | 59.3° |
| C26 | C27 | H17 | H18 | 118.7° | 120.5° |
| C27 | C26 | H31 | H32 | 121.8° | 119.4° |
| C26 | C27 | C28 | H33 | 160.2° | 178.9° |
| C26 | C27 | C28 | H34 | 80.9° | 60.0° |
| C31 | N25 | C20 | N24 | 9.1° | 1.3° |
| C31 | N25 | C20 | C11 | 171.1° | 179.0° |
| N25 | C31 | C30 | H19 | 176.2° | 169.2° |
| N25 | C31 | C30 | H20 | 63.8° | 70.3° |
| N25 | C31 | H21 | H22 | 122.7° | 119.4° |
| N22 | C21 | C17 | C18 | 13.7° | 179.4° |
| N22 | C21 | C17 | N23 | 178.6° | 179.7° |
| N22 | C21 | C17 | C16 | 165.3° | 0.3° |
| N22 | C21 | N23 | C28 | 15.3° | 13.2° |
| N22 | C21 | N23 | H15 | 164.7° | 166.8° |
| C21 | N22 | C26 | H31 | 163.2° | 141.1° |
| C21 | N22 | C26 | H32 | 75.5° | 99.4° |
| N24 | C20 | N25 | C11 | 179.7° | 179.7° |
| N24 | C20 | C11 | C10 | 27.2° | 179.7° |
| N24 | C20 | C11 | C12 | 151.9° | 0.3° |
| C20 | N24 | C29 | H35 | 134.6° | 77.1° |
| C20 | N24 | C29 | H36 | 106.1° | 161.9° |
| N25 | C20 | C11 | C10 | 152.5° | 0.0° |
| N25 | C20 | C11 | C12 | 28.4° | 180.0° |
| C20 | N25 | C31 | H21 | 77.9° | 99.5° |
| C20 | N25 | C31 | H22 | 160.2° | 141.2° |
| N25 | C20 | N24 | H30 | 173.4° | 166.8° |
| C27 | C28 | N23 | C21 | 22.8° | 42.3° |
| C27 | C28 | N23 | H33 | 120.6° | 119.5° |
| C27 | C28 | N23 | H34 | 120.6° | 119.4° |
| C27 | C28 | N23 | H15 | 157.2° | 137.7° |
| C28 | C27 | H17 | H18 | 118.7° | 120.4° |
| C28 | C27 | C26 | H31 | 165.2° | 169.7° |
| C28 | C27 | C26 | H32 | 73.5° | 71.0° |
| C27 | C28 | H33 | H34 | 118.2° | 121.1° |
| C20 | C11 | C10 | C12 | 179.1° | 179.9° |
| C20 | C11 | C10 | C9 | 179.8° | 180.0° |
| C20 | C11 | C12 | C13 | 179.6° | 180.0° |
| C20 | C11 | C10 | H8 | 0.2° | 0.1° |
| C20 | C11 | C12 | H9 | 0.5° | 0.0° |
| C11 | C20 | N24 | H30 | 6.9° | 12.9° |
| C19 | C18 | C17 | H27 | 180.0° | 179.9° |
| C18 | C19 | C14 | H13 | 180.0° | 179.9° |
| C19 | C18 | C17 | C21 | 179.9° | 180.0° |
| C19 | C18 | C17 | C16 | 0.9° | 0.4° |
| C18 | C19 | C14 | O7 | 179.9° | 179.9° |
| C18 | C19 | C14 | C15 | 0.1° | 0.2° |
| C17 | C18 | C19 | C14 | 0.7° | 0.1° |
| C18 | C17 | C21 | C16 | 179.0° | 179.6° |
| C18 | C17 | C21 | N23 | 167.7° | 0.3° |
| C18 | C17 | C16 | C15 | 0.4° | 0.3° |
| C18 | C17 | C16 | H12 | 179.6° | 179.7° |
| C17 | C18 | C19 | H13 | 179.2° | 180.0° |
| C11 | C10 | C9 | H8 | 180.0° | 179.9° |
| C11 | C10 | C9 | C8 | 0.4° | 0.0° |
| C10 | C11 | C12 | C13 | 0.5° | 0.1° |
| C11 | C10 | C9 | H7 | 179.6° | 179.9° |
| C10 | C11 | C12 | H9 | 179.5° | 179.9° |
| C9 | C10 | C11 | C12 | 0.7° | 0.1° |
| C10 | C9 | C8 | H7 | 180.0° | 180.0° |
| C10 | C9 | C8 | C13 | 0.2° | 0.0° |
| C10 | C9 | C8 | O6 | 179.5° | 179.7° |
| C19 | C14 | O7 | C15 | 180.0° | 179.7° |
| C19 | C14 | O7 | C1 | 66.3° | 0.2° |
| C19 | C14 | C15 | C16 | 0.4° | 0.3° |
| C19 | C14 | C15 | H11 | 179.7° | 179.8° |
| C14 | C19 | C18 | H27 | 179.3° | 180.0° |
| C11 | C12 | C13 | H9 | 180.0° | 180.0° |
| C11 | C12 | C13 | C8 | 0.1° | 0.0° |
| C12 | C11 | C10 | H8 | 179.2° | 180.0° |
| C11 | C12 | C13 | H10 | 179.9° | 179.8° |
| C17 | C21 | N23 | C28 | 163.3° | 167.2° |
| C21 | C17 | C16 | C15 | 179.5° | 180.0° |
| C21 | C17 | C16 | H12 | 0.6° | 0.1° |
| C17 | C21 | N23 | H15 | 16.7° | 12.9° |
| C21 | C17 | C18 | H27 | 0.1° | 0.0° |
| N23 | C21 | C17 | C16 | 13.2° | 180.0° |
| C21 | N23 | C28 | H15 | 180.0° | 180.0° |
| C21 | N23 | C28 | H33 | 143.4° | 161.8° |
| C21 | N23 | C28 | H34 | 97.8° | 77.1° |
| C9 | C8 | C13 | C12 | 0.5° | 0.0° |
| C9 | C8 | C13 | O6 | 179.2° | 179.7° |
| C9 | C8 | O6 | C5 | 134.6° | 0.3° |
| C8 | C9 | C10 | H8 | 179.6° | 180.0° |
| C9 | C8 | C13 | H10 | 179.5° | 179.7° |
| C17 | C16 | C15 | C14 | 0.2° | 0.0° |
| C17 | C16 | C15 | H12 | 180.0° | 179.9° |
| C17 | C16 | C15 | H11 | 179.8° | 179.9° |
| C16 | C17 | C18 | H27 | 179.1° | 179.7° |
| N23 | C28 | C27 | H17 | 80.8° | 179.2° |
| N23 | C28 | C27 | H18 | 160.1° | 60.4° |
| N23 | C28 | H33 | H34 | 118.2° | 120.9° |
| C12 | C13 | C8 | H10 | 180.0° | 179.7° |
| C12 | C13 | C8 | O6 | 179.7° | 179.7° |
| C13 | C8 | O6 | C5 | 46.2° | 180.0° |
| C13 | C8 | C9 | H7 | 179.8° | 180.0° |
| C8 | C13 | C12 | H9 | 179.9° | 180.0° |
| C8 | O6 | C5 | C4 | 178.2° | 180.0° |
| O6 | C8 | C9 | H7 | 0.6° | 0.3° |
| O6 | C8 | C13 | H10 | 0.3° | 0.0° |
| C8 | O6 | C5 | H25 | 61.8° | 59.9° |
| C8 | O6 | C5 | H26 | 58.2° | 60.0° |
| C14 | O7 | C1 | C2 | 175.5° | 180.0° |
| O7 | C14 | C15 | C16 | 179.6° | 180.0° |
| C14 | O7 | C1 | H1 | 64.6° | 60.0° |
| C14 | O7 | C1 | H2 | 55.6° | 60.0° |
| O7 | C14 | C15 | H11 | 0.4° | 0.1° |
| O7 | C14 | C19 | H13 | 0.1° | 0.0° |
| C15 | C14 | O7 | C1 | 113.7° | 179.9° |
| C14 | C15 | C16 | H11 | 180.0° | 179.9° |
| C14 | C15 | C16 | H12 | 179.8° | 179.9° |
| C15 | C14 | C19 | H13 | 179.9° | 179.7° |
| C2 | C3 | C4 | H5 | 120.3° | 120.0° |
| C2 | C3 | C4 | H6 | 120.3° | 120.0° |
| C3 | C2 | C1 | O7 | 169.7° | 180.0° |
| C3 | C2 | C1 | H3 | 120.4° | 120.0° |
| C3 | C2 | C1 | H4 | 120.4° | 120.0° |
| C2 | C3 | C4 | C5 | 158.7° | 180.0° |
| C3 | C2 | C1 | H1 | 70.3° | 60.0° |
| C3 | C2 | C1 | H2 | 49.8° | 60.0° |
| C3 | C2 | H3 | H4 | 118.8° | 120.0° |
| C2 | C3 | H5 | H6 | 118.9° | 120.0° |
| C2 | C3 | C4 | H23 | 81.0° | 60.0° |
| C2 | C3 | C4 | H24 | 38.5° | 60.0° |
| C4 | C3 | C2 | C1 | 94.4° | 180.0° |
| C3 | C4 | C5 | O6 | 100.2° | 180.0° |
| C3 | C4 | C5 | H23 | 120.3° | 120.0° |
| C3 | C4 | C5 | H24 | 120.3° | 120.0° |
| C4 | C3 | C2 | H3 | 26.0° | 60.0° |
| C4 | C3 | C2 | H4 | 145.2° | 60.0° |
| C4 | C3 | H5 | H6 | 118.9° | 120.0° |
| C3 | C4 | H23 | H24 | 119.2° | 119.9° |
| C3 | C4 | C5 | H25 | 139.8° | 59.9° |
| C3 | C4 | C5 | H26 | 19.7° | 60.0° |
| O7 | C1 | C2 | H1 | 119.9° | 120.0° |
| O7 | C1 | C2 | H2 | 119.9° | 119.9° |
| O7 | C1 | H1 | H2 | 120.3° | 120.0° |
| O7 | C1 | C2 | H3 | 69.9° | 60.1° |
| O7 | C1 | C2 | H4 | 49.4° | 60.0° |
| C2 | C1 | H1 | H2 | 120.2° | 120.0° |
| C1 | C2 | H3 | H4 | 118.9° | 120.0° |
| C1 | C2 | C3 | H5 | 25.9° | 60.0° |
| C1 | C2 | C3 | H6 | 145.2° | 60.0° |
| O6 | C5 | C4 | H25 | 120.0° | 120.1° |
| O6 | C5 | C4 | H26 | 120.0° | 120.0° |
| O6 | C5 | C4 | H23 | 139.5° | 59.9° |
| O6 | C5 | C4 | H24 | 20.1° | 60.0° |
| O6 | C5 | H25 | H26 | 120.1° | 120.0° |
| C5 | C4 | C3 | H5 | 38.4° | 60.0° |
| C5 | C4 | C3 | H6 | 80.9° | 60.0° |
| C5 | C4 | H23 | H24 | 119.2° | 120.0° |
| C4 | C5 | H25 | H26 | 120.1° | 119.9° |
| H1 | C1 | C2 | H3 | 50.0° | 60.0° |
| H1 | C1 | C2 | H4 | 169.3° | 180.0° |
| H2 | C1 | C2 | H3 | 170.2° | NaN° |
| H2 | C1 | C2 | H4 | 70.6° | 60.0° |
| H3 | C2 | C3 | H5 | 146.3° | 180.0° |
| H3 | C2 | C3 | H6 | 94.4° | 60.0° |
| H4 | C2 | C3 | H5 | 94.5° | 60.0° |
| H4 | C2 | C3 | H6 | 24.9° | NaN° |
| H5 | C3 | C4 | H23 | 158.7° | 180.0° |
| H5 | C3 | C4 | H24 | 81.9° | 60.0° |
| H6 | C3 | C4 | H23 | 39.3° | 60.0° |
| H6 | C3 | C4 | H24 | 158.8° | 179.9° |
| H7 | C9 | C10 | H8 | 0.4° | 0.0° |
| H9 | C12 | C13 | H10 | 0.1° | 0.2° |
| H11 | C15 | C16 | H12 | 0.2° | 0.0° |
| H13 | C19 | C18 | H27 | 0.7° | 0.0° |
| H15 | N23 | C28 | H33 | 36.6° | 18.2° |
| H15 | N23 | C28 | H34 | 82.2° | 102.9° |
| H17 | C27 | C26 | H31 | 44.8° | 70.6° |
| H17 | C27 | C26 | H32 | 166.1° | 48.8° |
| H17 | C27 | C28 | H33 | 39.8° | 61.3° |
| H17 | C27 | C28 | H34 | 158.6° | 59.8° |
| H18 | C27 | C26 | H31 | 74.3° | 49.9° |
| H18 | C27 | C26 | H32 | 46.9° | 169.3° |
| H18 | C27 | C28 | H33 | 79.3° | 59.1° |
| H18 | C27 | C28 | H34 | 39.5° | 179.7° |
| H19 | C30 | C31 | H21 | 57.2° | 48.8° |
| H19 | C30 | C31 | H22 | 64.7° | 70.6° |
| H19 | C30 | C29 | H35 | 72.8° | 59.8° |
| H19 | C30 | C29 | H36 | 46.5° | 61.2° |
| H20 | C30 | C31 | H21 | 177.1° | 169.4° |
| H20 | C30 | C31 | H22 | 55.3° | 49.9° |
| H20 | C30 | C29 | H35 | 47.2° | 179.6° |
| H20 | C30 | C29 | H36 | 166.6° | 59.4° |
| H23 | C4 | C5 | H25 | 19.5° | 180.0° |
| H23 | C4 | C5 | H26 | 100.5° | 60.1° |
| H24 | C4 | C5 | H25 | 99.9° | 60.1° |
| H24 | C4 | C5 | H26 | 140.0° | 180.0° |
| H30 | N24 | C29 | H35 | 45.4° | 102.9° |
| H30 | N24 | C29 | H36 | 73.9° | 18.1° |
