ML9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C14 | doub | 1.40Å | 1.43Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C16 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C18 | N17 | doub | 1.32Å | 1.38Å | Aromatic |
| C18 | C13 | sing | 1.39Å | 1.43Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C9 | C13 | sing | 1.48Å | 1.51Å | |
| C6 | C5 | doub | 1.40Å | 1.41Å | Aromatic |
| C5 | C4 | sing | 1.41Å | 1.41Å | Aromatic |
| C5 | C10 | sing | 1.41Å | 1.47Å | |
| C21 | C6 | sing | 1.51Å | 1.50Å | |
| N1 | C6 | sing | 1.32Å | 1.37Å | Aromatic |
| N3 | C4 | doub | 1.33Å | 1.37Å | Aromatic |
| C4 | N7 | sing | 1.37Å | 1.45Å | |
| N17 | C16 | sing | 1.32Å | 1.39Å | Aromatic |
| C16 | O19 | sing | 1.36Å | 1.40Å | |
| N12 | C2 | sing | 1.38Å | 1.39Å | |
| N1 | C2 | doub | 1.33Å | 1.35Å | Aromatic |
| C2 | N3 | sing | 1.32Å | 1.35Å | Aromatic |
| C10 | C9 | doub | 1.37Å | 1.34Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C9 | C8 | sing | 1.47Å | 1.52Å | |
| N7 | C8 | sing | 1.35Å | 1.43Å | |
| C8 | O11 | doub | 1.22Å | 1.24Å | |
| C23 | C22 | sing | 1.53Å | 1.57Å | |
| C23 | C24 | sing | 1.53Å | 1.53Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C22 | C27 | sing | 1.53Å | 1.57Å | |
| C27 | C26 | sing | 1.53Å | 1.54Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C24 | C25 | sing | 1.53Å | 1.55Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | C26 | sing | 1.53Å | 1.55Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| N7 | C22 | sing | 1.46Å | 1.52Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | O28 | sing | 1.43Å | 1.43Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C21 | H21B | sing | 1.09Å | 1.10Å | |
| C20 | O19 | sing | 1.43Å | 1.42Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C20 | H20B | sing | 1.09Å | 1.10Å | |
| O31 | C30 | sing | 1.43Å | 1.43Å | |
| C29 | C30 | sing | 1.53Å | 1.52Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| O28 | C29 | sing | 1.43Å | 1.43Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| N12 | HN12 | sing | 0.97Å | 1.00Å | |
| N12 | HN1A | sing | 0.97Å | 1.00Å | |
| O31 | HO31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C14 | C15 | 122.8° | 118.3° |
| C13 | C14 | H14 | 118.6° | 120.9° |
| C14 | C13 | C18 | 115.0° | 119.1° |
| C14 | C13 | C9 | 120.4° | 120.4° |
| C15 | C14 | H14 | 118.6° | 120.8° |
| C14 | C15 | C16 | 117.7° | 119.3° |
| C14 | C15 | H15 | 121.1° | 120.4° |
| C16 | C15 | H15 | 121.2° | 120.3° |
| C15 | C16 | N17 | 122.9° | 120.9° |
| C15 | C16 | O19 | 114.3° | 119.6° |
| N17 | C18 | C13 | 123.7° | 120.6° |
| N17 | C18 | H18 | 118.2° | 119.7° |
| C18 | N17 | C16 | 117.8° | 121.8° |
| C13 | C18 | H18 | 118.1° | 119.7° |
| C18 | C13 | C9 | 124.6° | 120.5° |
| C13 | C9 | C10 | 119.8° | 120.3° |
| C13 | C9 | C8 | 121.9° | 120.3° |
| C6 | C5 | C4 | 115.6° | 118.5° |
| C6 | C5 | C10 | 124.1° | 121.2° |
| C5 | C6 | C21 | 122.9° | 120.7° |
| C5 | C6 | N1 | 122.6° | 118.6° |
| C4 | C5 | C10 | 120.3° | 120.3° |
| C5 | C4 | N3 | 121.4° | 118.8° |
| C5 | C4 | N7 | 118.4° | 120.3° |
| C5 | C10 | C9 | 123.2° | 119.0° |
| C5 | C10 | H10 | 118.4° | 120.5° |
| C21 | C6 | N1 | 114.5° | 120.7° |
| C6 | C21 | H21 | 109.5° | 109.5° |
| C6 | C21 | H21A | 109.5° | 109.5° |
| C6 | C21 | H21B | 109.5° | 109.5° |
| C6 | N1 | C2 | 118.4° | 121.2° |
| N3 | C4 | N7 | 120.2° | 120.9° |
| C4 | N3 | C2 | 119.5° | 120.5° |
| C4 | N7 | C8 | 121.8° | 120.7° |
| C4 | N7 | C22 | 117.9° | 119.7° |
| N17 | C16 | O19 | 122.8° | 119.6° |
| C16 | O19 | C20 | 115.2° | 117.0° |
| N12 | C2 | N1 | 118.9° | 118.8° |
| N12 | C2 | N3 | 118.7° | 118.7° |
| C2 | N12 | HN12 | 109.5° | 120.0° |
| C2 | N12 | HN1A | 109.4° | 120.0° |
| N1 | C2 | N3 | 122.5° | 122.4° |
| C9 | C10 | H10 | 118.4° | 120.5° |
| C10 | C9 | C8 | 118.2° | 119.4° |
| C9 | C8 | N7 | 118.0° | 120.3° |
| C9 | C8 | O11 | 119.0° | 119.8° |
| N7 | C8 | O11 | 122.9° | 119.8° |
| C8 | N7 | C22 | 120.2° | 119.6° |
| C22 | C23 | C24 | 111.4° | 109.5° |
| C22 | C23 | H23 | 108.9° | 109.5° |
| C22 | C23 | H23A | 108.8° | 109.5° |
| C23 | C22 | C27 | 111.9° | 109.5° |
| C23 | C22 | N7 | 111.7° | 109.5° |
| C23 | C22 | H22 | 106.8° | 109.5° |
| C24 | C23 | H23 | 108.8° | 109.5° |
| C24 | C23 | H23A | 108.8° | 109.5° |
| C23 | C24 | C25 | 110.6° | 109.5° |
| C23 | C24 | H24 | 109.1° | 109.5° |
| C23 | C24 | H24A | 109.1° | 109.4° |
| H23 | C23 | H23A | 110.1° | 109.5° |
| C22 | C27 | C26 | 110.5° | 109.5° |
| C22 | C27 | H27 | 109.1° | 109.5° |
| C22 | C27 | H27A | 109.2° | 109.5° |
| C27 | C22 | N7 | 111.2° | 109.5° |
| C27 | C22 | H22 | 107.3° | 109.4° |
| C26 | C27 | H27 | 109.2° | 109.5° |
| C26 | C27 | H27A | 109.1° | 109.5° |
| C27 | C26 | C25 | 110.5° | 109.5° |
| C27 | C26 | H26 | 109.1° | 109.5° |
| C27 | C26 | H26A | 109.1° | 109.5° |
| H27 | C27 | H27A | 109.8° | 109.4° |
| C25 | C24 | H24 | 109.1° | 109.5° |
| C25 | C24 | H24A | 109.1° | 109.5° |
| C24 | C25 | C26 | 110.5° | 109.5° |
| C24 | C25 | O28 | 107.6° | 109.5° |
| C24 | C25 | H25 | 110.7° | 109.4° |
| H24 | C24 | H24A | 109.9° | 109.5° |
| C25 | C26 | H26 | 109.1° | 109.5° |
| C25 | C26 | H26A | 109.1° | 109.4° |
| C26 | C25 | O28 | 111.4° | 109.5° |
| C26 | C25 | H25 | 106.8° | 109.5° |
| H26 | C26 | H26A | 109.8° | 109.4° |
| N7 | C22 | H22 | 107.6° | 109.5° |
| O28 | C25 | H25 | 109.8° | 109.5° |
| C25 | O28 | C29 | 113.4° | 114.0° |
| H21 | C21 | H21A | 109.5° | 109.4° |
| H21 | C21 | H21B | 109.5° | 109.5° |
| H21A | C21 | H21B | 109.5° | 109.4° |
| O19 | C20 | H20 | 109.5° | 109.4° |
| O19 | C20 | H20A | 109.5° | 109.5° |
| O19 | C20 | H20B | 109.5° | 109.5° |
| H20 | C20 | H20A | 109.5° | 109.5° |
| H20 | C20 | H20B | 109.5° | 109.5° |
| H20A | C20 | H20B | 109.5° | 109.5° |
| O31 | C30 | C29 | 108.8° | 109.4° |
| O31 | C30 | H30 | 109.7° | 109.4° |
| O31 | C30 | H30A | 109.7° | 109.5° |
| C30 | O31 | HO31 | 109.5° | 114.0° |
| C29 | C30 | H30 | 109.7° | 109.5° |
| C29 | C30 | H30A | 109.7° | 109.5° |
| C30 | C29 | O28 | 107.8° | 109.4° |
| C30 | C29 | H29 | 110.0° | 109.4° |
| C30 | C29 | H29A | 110.0° | 109.5° |
| H30 | C30 | H30A | 109.3° | 109.5° |
| O28 | C29 | H29 | 110.0° | 109.5° |
| O28 | C29 | H29A | 110.0° | 109.5° |
| H29 | C29 | H29A | 108.9° | 109.5° |
| HN12 | N12 | HN1A | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C14 | C15 | H14 | 180.0° | 179.7° |
| C13 | C14 | C15 | C16 | 0.0° | 0.3° |
| C13 | C14 | C15 | H15 | 180.0° | 179.7° |
| C14 | C13 | C18 | N17 | 0.2° | 0.6° |
| C14 | C13 | C18 | C9 | 179.9° | 180.0° |
| C14 | C13 | C18 | H18 | 179.9° | 179.7° |
| C14 | C13 | C9 | C10 | 140.9° | 65.0° |
| C14 | C13 | C9 | C8 | 38.7° | 115.0° |
| C14 | C15 | C16 | H15 | 180.0° | 180.0° |
| C15 | C14 | C13 | C18 | 0.1° | 0.0° |
| C15 | C14 | C13 | C9 | 180.0° | 179.9° |
| C14 | C15 | C16 | N17 | 0.2° | 0.0° |
| C14 | C15 | C16 | O19 | 179.9° | 180.0° |
| H14 | C14 | C15 | C16 | 180.0° | 180.0° |
| H14 | C14 | C15 | H15 | 0.0° | 0.0° |
| H14 | C14 | C13 | C18 | 179.9° | 179.7° |
| H14 | C14 | C13 | C9 | 0.0° | 0.2° |
| C15 | C16 | N17 | C18 | 0.2° | 0.6° |
| C15 | C16 | N17 | O19 | 179.7° | 180.0° |
| C15 | C16 | O19 | C20 | 179.8° | 180.0° |
| H15 | C15 | C16 | N17 | 179.8° | 180.0° |
| H15 | C15 | C16 | O19 | 0.0° | 0.0° |
| N17 | C18 | C13 | H18 | 180.0° | 179.1° |
| N17 | C18 | C13 | C9 | 180.0° | 179.5° |
| C18 | N17 | C16 | O19 | 179.9° | 179.4° |
| C13 | C18 | N17 | C16 | 0.0° | 0.9° |
| C18 | C13 | C9 | C10 | 39.0° | 115.0° |
| C18 | C13 | C9 | C8 | 141.5° | 65.0° |
| H18 | C18 | C13 | C9 | 0.0° | 0.3° |
| H18 | C18 | N17 | C16 | 180.0° | 180.0° |
| C13 | C9 | C10 | C5 | 179.1° | 180.0° |
| C13 | C9 | C10 | C8 | 179.6° | 180.0° |
| C13 | C9 | C10 | H10 | 0.9° | 0.0° |
| C13 | C9 | C8 | N7 | 178.9° | 180.0° |
| C13 | C9 | C8 | O11 | 0.8° | 0.0° |
| C6 | C5 | C4 | C10 | 179.9° | 179.7° |
| C5 | C6 | C21 | N1 | 180.0° | 179.9° |
| C6 | C5 | C4 | N3 | 0.6° | 0.3° |
| C6 | C5 | C4 | N7 | 179.3° | 179.7° |
| C5 | C6 | N1 | C2 | 0.4° | 0.1° |
| C6 | C5 | C10 | C9 | 179.7° | 179.7° |
| C6 | C5 | C10 | H10 | 0.3° | 0.3° |
| C5 | C6 | C21 | H21 | 180.0° | 90.0° |
| C5 | C6 | C21 | H21A | 60.0° | 150.0° |
| C5 | C6 | C21 | H21B | 60.0° | 30.0° |
| C4 | C5 | C6 | C21 | 179.3° | 180.0° |
| C4 | C5 | C6 | N1 | 0.7° | 0.0° |
| C5 | C4 | N3 | N7 | 179.9° | 180.0° |
| C5 | C4 | N3 | C2 | 0.2° | 0.5° |
| C4 | C5 | C10 | C9 | 0.2° | 0.0° |
| C4 | C5 | C10 | H10 | 179.8° | 180.0° |
| C5 | C4 | N7 | C8 | 0.3° | 0.0° |
| C5 | C4 | N7 | C22 | 179.6° | 180.0° |
| C10 | C5 | C6 | C21 | 0.6° | 0.3° |
| C10 | C5 | C6 | N1 | 179.4° | 179.7° |
| C10 | C5 | C4 | N3 | 179.5° | 180.0° |
| C10 | C5 | C4 | N7 | 0.6° | 0.1° |
| C5 | C10 | C9 | H10 | 180.0° | 180.0° |
| C5 | C10 | C9 | C8 | 0.5° | 0.0° |
| C21 | C6 | N1 | C2 | 179.7° | 180.0° |
| C6 | C21 | H21 | H21A | 120.0° | 120.0° |
| C6 | C21 | H21 | H21B | 120.0° | 120.1° |
| C6 | C21 | H21A | H21B | 120.0° | 120.0° |
| C6 | N1 | C2 | N12 | 180.0° | 179.6° |
| C6 | N1 | C2 | N3 | 0.1° | 0.2° |
| N1 | C6 | C21 | H21 | 0.0° | 89.9° |
| N1 | C6 | C21 | H21A | 120.0° | 30.1° |
| N1 | C6 | C21 | H21B | 120.0° | 150.1° |
| C4 | N3 | C2 | N12 | 179.9° | 179.9° |
| C4 | N3 | C2 | N1 | 0.1° | 0.5° |
| N3 | C4 | N7 | C8 | 179.7° | 180.0° |
| N3 | C4 | N7 | C22 | 0.3° | 0.0° |
| N7 | C4 | N3 | C2 | 179.7° | 179.5° |
| C4 | N7 | C8 | C9 | 0.3° | 0.0° |
| C4 | N7 | C8 | C22 | 180.0° | 180.0° |
| C4 | N7 | C8 | O11 | 180.0° | 180.0° |
| C4 | N7 | C22 | C23 | 122.2° | 120.0° |
| C4 | N7 | C22 | C27 | 112.0° | 120.0° |
| C4 | N7 | C22 | H22 | 5.3° | 0.1° |
| N17 | C16 | O19 | C20 | 0.0° | 0.0° |
| C16 | O19 | C20 | H20 | 180.0° | 60.0° |
| C16 | O19 | C20 | H20A | 60.0° | 60.0° |
| C16 | O19 | C20 | H20B | 60.0° | 180.0° |
| N12 | C2 | N1 | N3 | 180.0° | 179.5° |
| C2 | N12 | HN12 | HN1A | 120.0° | 179.9° |
| N1 | C2 | N12 | HN12 | 0.0° | 179.5° |
| N1 | C2 | N12 | HN1A | 120.0° | 0.5° |
| N3 | C2 | N12 | HN12 | 180.0° | 0.1° |
| N3 | C2 | N12 | HN1A | 59.9° | 180.0° |
| C10 | C9 | C8 | N7 | 0.7° | 0.0° |
| C10 | C9 | C8 | O11 | 179.6° | 180.0° |
| H10 | C10 | C9 | C8 | 179.5° | 180.0° |
| C9 | C8 | N7 | O11 | 179.7° | 179.9° |
| C9 | C8 | N7 | C22 | 179.7° | 179.9° |
| C8 | N7 | C22 | C23 | 57.8° | 60.0° |
| C8 | N7 | C22 | C27 | 68.0° | 60.0° |
| C8 | N7 | C22 | H22 | 174.7° | 180.0° |
| O11 | C8 | N7 | C22 | 0.0° | 0.0° |
| C22 | C23 | C24 | H23 | 120.0° | 120.0° |
| C22 | C23 | C24 | H23A | 120.0° | 120.0° |
| C22 | C23 | H23 | H23A | 119.2° | 120.0° |
| C23 | C22 | C27 | N7 | 125.8° | 120.0° |
| C23 | C22 | C27 | H22 | 116.8° | 120.0° |
| C23 | C22 | C27 | C26 | 53.5° | 60.0° |
| C23 | C22 | C27 | H27 | 66.5° | 180.0° |
| C23 | C22 | C27 | H27A | 173.5° | 60.0° |
| C22 | C23 | C24 | C25 | 55.2° | 60.0° |
| C22 | C23 | C24 | H24 | 64.8° | 60.0° |
| C22 | C23 | C24 | H24A | 175.2° | 180.0° |
| C23 | C22 | N7 | H22 | 116.9° | 120.0° |
| C24 | C23 | H23 | H23A | 119.2° | 120.0° |
| C24 | C23 | C22 | C27 | 53.1° | 60.0° |
| C23 | C24 | C25 | H24 | 120.0° | 120.0° |
| C23 | C24 | C25 | H24A | 120.0° | 120.0° |
| C23 | C24 | H24 | H24A | 119.5° | 120.0° |
| C23 | C24 | C25 | C26 | 58.8° | 59.9° |
| C24 | C23 | C22 | N7 | 178.5° | 180.0° |
| C24 | C23 | C22 | H22 | 64.1° | 60.0° |
| C23 | C24 | C25 | O28 | 179.4° | 180.0° |
| C23 | C24 | C25 | H25 | 59.4° | 60.1° |
| H23 | C23 | C22 | C27 | 173.1° | 60.0° |
| H23 | C23 | C24 | C25 | 175.2° | 60.0° |
| H23 | C23 | C24 | H24 | 55.2° | NaN° |
| H23 | C23 | C24 | H24A | 64.8° | 60.0° |
| H23 | C23 | C22 | N7 | 61.4° | 60.0° |
| H23 | C23 | C22 | H22 | 55.9° | 180.0° |
| H23A | C23 | C22 | C27 | 66.9° | 180.0° |
| H23A | C23 | C24 | C25 | 64.8° | 180.0° |
| H23A | C23 | C24 | H24 | 175.2° | 60.0° |
| H23A | C23 | C24 | H24A | 55.1° | 60.0° |
| H23A | C23 | C22 | N7 | 58.5° | 60.0° |
| H23A | C23 | C22 | H22 | 175.9° | 60.0° |
| C22 | C27 | C26 | H27 | 120.0° | 120.0° |
| C22 | C27 | C26 | H27A | 120.0° | 120.0° |
| C22 | C27 | H27 | H27A | 119.6° | 120.0° |
| C22 | C27 | C26 | C25 | 56.8° | 60.0° |
| C22 | C27 | C26 | H26 | 176.8° | 180.0° |
| C22 | C27 | C26 | H26A | 63.2° | 60.0° |
| C27 | C22 | N7 | H22 | 117.3° | 119.9° |
| C26 | C27 | H27 | H27A | 119.6° | 120.0° |
| C27 | C26 | C25 | C24 | 59.7° | 59.9° |
| C27 | C26 | C25 | H26 | 120.0° | 120.1° |
| C27 | C26 | C25 | H26A | 120.0° | 120.0° |
| C27 | C26 | H26 | H26A | 119.6° | 120.0° |
| C26 | C27 | C22 | N7 | 179.3° | 180.0° |
| C26 | C27 | C22 | H22 | 63.3° | 60.0° |
| C27 | C26 | C25 | O28 | 179.4° | 180.0° |
| C27 | C26 | C25 | H25 | 60.7° | 60.0° |
| H27 | C27 | C26 | C25 | 63.2° | 180.0° |
| H27 | C27 | C26 | H26 | 56.8° | 59.9° |
| H27 | C27 | C26 | H26A | 176.8° | 60.0° |
| H27 | C27 | C22 | N7 | 59.3° | 60.0° |
| H27 | C27 | C22 | H22 | 176.7° | 60.0° |
| H27A | C27 | C26 | C25 | 176.8° | 60.1° |
| H27A | C27 | C26 | H26 | 63.2° | 60.0° |
| H27A | C27 | C26 | H26A | 56.8° | NaN° |
| H27A | C27 | C22 | N7 | 60.7° | 60.0° |
| H27A | C27 | C22 | H22 | 56.7° | 180.0° |
| C25 | C24 | H24 | H24A | 119.5° | 120.0° |
| C24 | C25 | C26 | O28 | 119.6° | 120.1° |
| C24 | C25 | C26 | H25 | 120.5° | 120.0° |
| C24 | C25 | C26 | H26 | 179.7° | 180.0° |
| C24 | C25 | C26 | H26A | 60.3° | 60.0° |
| C24 | C25 | O28 | H25 | 120.5° | 119.9° |
| C24 | C25 | O28 | C29 | 110.0° | 150.0° |
| H24 | C24 | C25 | C26 | 61.2° | 60.0° |
| H24 | C24 | C25 | O28 | 60.6° | 60.0° |
| H24 | C24 | C25 | H25 | 179.4° | 180.0° |
| H24A | C24 | C25 | C26 | 178.8° | 179.9° |
| H24A | C24 | C25 | O28 | 59.4° | 60.0° |
| H24A | C24 | C25 | H25 | 60.6° | 59.9° |
| C25 | C26 | H26 | H26A | 119.6° | 120.0° |
| C26 | C25 | O28 | H25 | 118.1° | 120.0° |
| C26 | C25 | O28 | C29 | 128.7° | 90.0° |
| H26 | C26 | C25 | O28 | 60.6° | 59.9° |
| H26 | C26 | C25 | H25 | 59.3° | 60.1° |
| H26A | C26 | C25 | O28 | 59.3° | 60.0° |
| H26A | C26 | C25 | H25 | 179.3° | 180.0° |
| C25 | O28 | C29 | C30 | 179.5° | 180.0° |
| C25 | O28 | C29 | H29 | 60.5° | 60.0° |
| C25 | O28 | C29 | H29A | 59.5° | 60.0° |
| H25 | C25 | O28 | C29 | 10.5° | 30.0° |
| H21 | C21 | H21A | H21B | 120.0° | 120.0° |
| O19 | C20 | H20 | H20A | 120.0° | 120.0° |
| O19 | C20 | H20 | H20B | 120.0° | 120.0° |
| O19 | C20 | H20A | H20B | 120.0° | 120.0° |
| H20 | C20 | H20A | H20B | 120.0° | 120.1° |
| O31 | C30 | C29 | H30 | 120.0° | 119.9° |
| O31 | C30 | C29 | H30A | 120.0° | 120.0° |
| O31 | C30 | H30 | H30A | 120.3° | 120.0° |
| O31 | C30 | C29 | O28 | 69.5° | 65.1° |
| O31 | C30 | C29 | H29 | 170.5° | 175.0° |
| O31 | C30 | C29 | H29A | 50.5° | 55.0° |
| C29 | C30 | H30 | H30A | 120.3° | 120.1° |
| C30 | C29 | O28 | H29 | 120.0° | 119.9° |
| C30 | C29 | O28 | H29A | 120.0° | 120.0° |
| C30 | C29 | H29 | H29A | 120.7° | 120.0° |
| C29 | C30 | O31 | HO31 | 180.0° | 180.0° |
| H30 | C30 | C29 | O28 | 50.5° | 175.0° |
| H30 | C30 | C29 | H29 | 69.5° | 55.1° |
| H30 | C30 | C29 | H29A | 170.5° | 64.9° |
| H30 | C30 | O31 | HO31 | 60.0° | 60.0° |
| H30A | C30 | C29 | O28 | 170.5° | 54.9° |
| H30A | C30 | C29 | H29 | 50.5° | 65.0° |
| H30A | C30 | C29 | H29A | 69.5° | 175.0° |
| H30A | C30 | O31 | HO31 | 60.0° | 60.0° |
| O28 | C29 | H29 | H29A | 120.6° | 120.0° |
