0MP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C19 | sing | 1.51Å | 1.53Å | |
| C31 | C25 | sing | 1.53Å | 1.54Å | |
| N27 | C25 | sing | 1.46Å | 1.48Å | |
| N27 | C33 | sing | 1.35Å | 1.33Å | |
| C26 | O30 | sing | 1.43Å | 1.43Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C26 | C28 | sing | 1.53Å | 1.54Å | |
| C19 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| C35 | C33 | sing | 1.51Å | 1.54Å | |
| N29 | C28 | sing | 1.47Å | 1.47Å | |
| N29 | C11 | sing | 1.47Å | 1.47Å | |
| C22 | F32 | sing | 1.35Å | 1.35Å | |
| C22 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C33 | O34 | doub | 1.21Å | 1.23Å | |
| C13 | C11 | sing | 1.53Å | 1.54Å | |
| C13 | C1 | sing | 1.53Å | 1.54Å | |
| C11 | C6 | sing | 1.51Å | 1.54Å | |
| C24 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.54Å | 1.54Å | |
| C3 | C2 | sing | 1.54Å | 1.53Å | |
| C4 | C1 | sing | 1.53Å | 1.54Å | |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | O12 | sing | 1.42Å | 1.43Å | |
| C6 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.41Å | Aromatic |
| C7 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
| O12 | C5 | sing | 1.36Å | 1.37Å | |
| C5 | N10 | doub | 1.33Å | 1.35Å | Aromatic |
| C18 | C15 | sing | 1.53Å | 1.54Å | |
| C8 | C14 | sing | 1.51Å | 1.53Å | |
| C8 | C9 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| N10 | C9 | sing | 1.32Å | 1.33Å | Aromatic |
| C15 | C16 | sing | 1.53Å | 1.54Å | |
| C15 | C17 | sing | 1.53Å | 1.53Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C14 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C7 | H21 | sing | 1.08Å | 1.08Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| N29 | H23 | sing | 1.01Å | 1.00Å | |
| C28 | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| O30 | H28 | sing | 0.97Å | 0.95Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| N27 | H30 | sing | 0.97Å | 1.00Å | |
| C35 | H31 | sing | 1.09Å | 1.10Å | |
| C35 | H32 | sing | 1.09Å | 1.10Å | |
| C35 | H33 | sing | 1.09Å | 1.10Å | |
| C31 | H34 | sing | 1.09Å | 1.10Å | |
| C31 | H35 | sing | 1.09Å | 1.10Å | |
| C20 | H36 | sing | 1.08Å | 1.08Å | |
| C21 | H37 | sing | 1.08Å | 1.08Å | |
| C23 | H38 | sing | 1.08Å | 1.08Å | |
| C24 | H39 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C19 | 119.3° | 120.0° |
| C20 | C21 | C22 | 120.1° | 120.0° |
| C21 | C20 | H36 | 120.4° | 120.0° |
| C20 | C21 | H37 | 120.0° | 120.0° |
| C20 | C19 | C31 | 120.4° | 120.0° |
| C20 | C19 | C24 | 120.2° | 120.1° |
| C19 | C20 | H36 | 120.4° | 120.0° |
| C21 | C22 | F32 | 120.7° | 120.0° |
| C21 | C22 | C23 | 120.6° | 120.0° |
| C22 | C21 | H37 | 119.9° | 120.1° |
| C19 | C31 | C25 | 110.9° | 109.5° |
| C31 | C19 | C24 | 119.4° | 120.0° |
| C19 | C31 | H34 | 109.1° | 109.5° |
| C19 | C31 | H35 | 109.1° | 109.5° |
| C31 | C25 | N27 | 111.3° | 109.5° |
| C31 | C25 | C26 | 110.7° | 109.4° |
| C31 | C25 | H29 | 107.9° | 109.5° |
| C25 | C31 | H34 | 109.1° | 109.5° |
| C25 | C31 | H35 | 109.1° | 109.5° |
| C25 | N27 | C33 | 120.3° | 120.0° |
| N27 | C25 | C26 | 110.2° | 109.4° |
| N27 | C25 | H29 | 108.7° | 109.5° |
| C25 | N27 | H30 | 119.9° | 120.0° |
| N27 | C33 | C35 | 115.7° | 120.0° |
| N27 | C33 | O34 | 123.2° | 120.0° |
| C33 | N27 | H30 | 119.9° | 120.0° |
| O30 | C26 | C25 | 109.0° | 109.5° |
| O30 | C26 | C28 | 109.7° | 109.4° |
| O30 | C26 | H27 | 109.5° | 109.5° |
| C26 | O30 | H28 | 109.5° | 114.0° |
| C25 | C26 | C28 | 112.1° | 109.4° |
| C25 | C26 | H27 | 108.3° | 109.5° |
| C26 | C25 | H29 | 108.1° | 109.5° |
| C26 | C28 | N29 | 107.4° | 109.5° |
| C26 | C28 | H25 | 110.0° | 109.5° |
| C26 | C28 | H26 | 110.0° | 109.5° |
| C28 | C26 | H27 | 108.1° | 109.5° |
| C19 | C24 | C23 | 120.8° | 120.0° |
| C19 | C24 | H39 | 119.6° | 120.0° |
| C35 | C33 | O34 | 121.1° | 120.0° |
| C33 | C35 | H31 | 109.5° | 109.5° |
| C33 | C35 | H32 | 109.5° | 109.5° |
| C33 | C35 | H33 | 109.5° | 109.4° |
| C28 | N29 | C11 | 115.7° | 111.0° |
| C28 | N29 | H23 | 107.9° | 111.0° |
| N29 | C28 | H25 | 110.0° | 109.4° |
| N29 | C28 | H26 | 110.0° | 109.4° |
| N29 | C11 | C13 | 110.3° | 109.4° |
| N29 | C11 | C6 | 112.4° | 109.4° |
| N29 | C11 | H22 | 107.7° | 109.3° |
| C11 | N29 | H23 | 107.9° | 111.0° |
| F32 | C22 | C23 | 118.7° | 120.1° |
| C22 | C23 | C24 | 119.0° | 120.0° |
| C22 | C23 | H38 | 120.5° | 120.0° |
| C11 | C13 | C1 | 109.6° | 108.1° |
| C13 | C11 | C6 | 112.3° | 110.0° |
| C11 | C13 | H7 | 109.4° | 109.8° |
| C11 | C13 | H8 | 109.5° | 109.8° |
| C13 | C11 | H22 | 107.0° | 109.4° |
| C13 | C1 | C4 | 111.7° | 113.7° |
| C13 | C1 | C2 | 114.2° | 113.6° |
| C13 | C1 | O12 | 112.1° | 112.0° |
| C1 | C13 | H7 | 109.4° | 109.7° |
| C1 | C13 | H8 | 109.4° | 109.7° |
| C11 | C6 | C7 | 119.8° | 118.5° |
| C11 | C6 | C5 | 121.1° | 122.3° |
| C6 | C11 | H22 | 106.9° | 109.4° |
| C24 | C23 | H38 | 120.5° | 120.0° |
| C23 | C24 | H39 | 119.6° | 120.0° |
| C4 | C3 | C2 | 90.8° | 87.2° |
| C3 | C4 | C1 | 89.4° | 87.0° |
| C4 | C3 | H3 | 113.9° | 113.6° |
| C4 | C3 | H4 | 113.9° | 113.6° |
| C3 | C4 | H5 | 114.2° | 113.7° |
| C3 | C4 | H6 | 114.2° | 113.7° |
| C3 | C2 | C1 | 89.4° | 87.0° |
| C3 | C2 | H1 | 114.2° | 113.7° |
| C3 | C2 | H2 | 114.2° | 113.7° |
| C2 | C3 | H3 | 113.9° | 113.6° |
| C2 | C3 | H4 | 113.9° | 113.5° |
| C4 | C1 | C2 | 90.2° | 87.5° |
| C4 | C1 | O12 | 113.6° | 114.0° |
| C1 | C4 | H5 | 114.2° | 113.5° |
| C1 | C4 | H6 | 114.3° | 113.6° |
| C2 | C1 | O12 | 113.4° | 114.0° |
| C1 | C2 | H1 | 114.2° | 113.6° |
| C1 | C2 | H2 | 114.2° | 113.7° |
| C1 | O12 | C5 | 114.7° | 117.4° |
| C7 | C6 | C5 | 119.1° | 119.1° |
| C6 | C7 | C8 | 118.7° | 118.8° |
| C6 | C7 | H21 | 120.6° | 120.6° |
| C6 | C5 | O12 | 122.2° | 121.8° |
| C6 | C5 | N10 | 120.2° | 120.3° |
| C7 | C8 | C14 | 120.7° | 120.5° |
| C7 | C8 | C9 | 119.7° | 119.1° |
| C8 | C7 | H21 | 120.6° | 120.6° |
| O12 | C5 | N10 | 117.6° | 118.0° |
| C5 | N10 | C9 | 121.9° | 122.0° |
| C18 | C15 | C14 | 111.7° | 109.5° |
| C18 | C15 | C16 | 108.2° | 109.4° |
| C18 | C15 | C17 | 110.6° | 109.5° |
| C15 | C18 | H15 | 109.5° | 109.5° |
| C15 | C18 | H16 | 109.5° | 109.5° |
| C15 | C18 | H17 | 109.5° | 109.4° |
| C14 | C8 | C9 | 119.5° | 120.4° |
| C8 | C14 | C15 | 113.6° | 109.5° |
| C8 | C14 | H10 | 108.4° | 109.4° |
| C8 | C14 | H11 | 108.4° | 109.5° |
| C8 | C9 | N10 | 120.3° | 120.7° |
| C8 | C9 | H9 | 119.8° | 119.6° |
| C14 | C15 | C16 | 107.8° | 109.4° |
| C14 | C15 | C17 | 108.8° | 109.5° |
| C15 | C14 | H10 | 108.4° | 109.5° |
| C15 | C14 | H11 | 108.4° | 109.5° |
| N10 | C9 | H9 | 119.8° | 119.6° |
| C16 | C15 | C17 | 109.6° | 109.5° |
| C15 | C16 | H18 | 109.5° | 109.5° |
| C15 | C16 | H19 | 109.5° | 109.5° |
| C15 | C16 | H20 | 109.5° | 109.5° |
| C15 | C17 | H12 | 109.5° | 109.5° |
| C15 | C17 | H13 | 109.5° | 109.5° |
| C15 | C17 | H14 | 109.5° | 109.5° |
| H1 | C2 | H2 | 109.5° | 112.9° |
| H3 | C3 | H4 | 109.5° | 112.9° |
| H5 | C4 | H6 | 109.5° | 112.9° |
| H7 | C13 | H8 | 109.5° | 109.8° |
| H10 | C14 | H11 | 109.5° | 109.4° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H12 | C17 | H14 | 109.4° | 109.5° |
| H13 | C17 | H14 | 109.4° | 109.4° |
| H15 | C18 | H16 | 109.5° | 109.5° |
| H15 | C18 | H17 | 109.4° | 109.4° |
| H16 | C18 | H17 | 109.5° | 109.4° |
| H18 | C16 | H19 | 109.5° | 109.4° |
| H18 | C16 | H20 | 109.5° | 109.4° |
| H19 | C16 | H20 | 109.4° | 109.5° |
| H25 | C28 | H26 | 109.5° | 109.5° |
| H31 | C35 | H32 | 109.5° | 109.4° |
| H31 | C35 | H33 | 109.5° | 109.5° |
| H32 | C35 | H33 | 109.5° | 109.5° |
| H34 | C31 | H35 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C19 | H36 | 180.0° | 179.9° |
| C20 | C21 | C22 | H37 | 180.0° | 180.0° |
| C21 | C20 | C19 | C31 | 179.2° | 180.0° |
| C21 | C20 | C19 | C24 | 0.6° | 0.4° |
| C20 | C21 | C22 | F32 | 179.5° | 179.9° |
| C20 | C21 | C22 | C23 | 1.1° | 0.0° |
| C19 | C20 | C21 | C22 | 0.4° | 0.1° |
| C20 | C19 | C31 | C24 | 178.6° | 179.6° |
| C20 | C19 | C31 | C25 | 112.5° | 89.7° |
| C20 | C19 | C24 | C23 | 1.0° | 0.6° |
| C20 | C19 | C31 | H34 | 127.3° | 150.3° |
| C20 | C19 | C31 | H35 | 7.7° | 30.4° |
| C19 | C20 | C21 | H37 | 179.6° | 179.9° |
| C20 | C19 | C24 | H39 | 179.0° | 179.7° |
| C21 | C22 | F32 | C23 | 179.4° | 179.9° |
| C21 | C22 | C23 | C24 | 0.7° | 0.2° |
| C22 | C21 | C20 | H36 | 179.6° | 180.0° |
| C21 | C22 | C23 | H38 | 179.3° | 180.0° |
| C19 | C31 | C25 | H34 | 120.2° | 120.0° |
| C19 | C31 | C25 | H35 | 120.2° | 120.0° |
| C19 | C31 | C25 | N27 | 45.8° | 65.0° |
| C19 | C31 | C25 | C26 | 168.6° | 175.0° |
| C31 | C19 | C24 | C23 | 179.6° | 179.8° |
| C19 | C31 | C25 | H29 | 73.3° | 55.0° |
| C19 | C31 | H34 | H35 | 119.4° | 120.0° |
| C31 | C19 | C20 | H36 | 0.8° | 0.1° |
| C31 | C19 | C24 | H39 | 0.4° | 0.1° |
| C31 | C25 | N27 | C26 | 123.2° | 120.0° |
| C31 | C25 | N27 | H29 | 118.6° | 120.0° |
| C31 | C25 | N27 | C33 | 132.8° | 62.4° |
| C31 | C25 | C26 | O30 | 49.4° | 65.3° |
| C31 | C25 | C26 | H29 | 117.9° | 120.0° |
| C31 | C25 | C26 | C28 | 171.1° | 174.7° |
| C25 | C31 | C19 | C24 | 66.1° | 89.9° |
| C31 | C25 | C26 | H27 | 69.7° | 54.7° |
| C31 | C25 | N27 | H30 | 47.2° | 117.5° |
| C25 | C31 | H34 | H35 | 119.3° | 120.0° |
| C25 | N27 | C33 | H30 | 180.0° | 179.9° |
| N27 | C25 | C26 | O30 | 173.0° | 174.7° |
| N27 | C25 | C26 | H29 | 118.6° | 120.0° |
| N27 | C25 | C26 | C28 | 65.3° | 54.7° |
| C25 | N27 | C33 | C35 | 178.8° | 175.1° |
| C25 | N27 | C33 | O34 | 0.7° | 4.8° |
| N27 | C25 | C26 | H27 | 53.9° | 65.3° |
| N27 | C25 | C31 | H34 | 166.0° | 55.0° |
| N27 | C25 | C31 | H35 | 74.5° | 175.0° |
| C33 | N27 | C25 | C26 | 104.0° | 57.5° |
| N27 | C33 | C35 | O34 | 178.1° | 179.9° |
| C33 | N27 | C25 | H29 | 14.2° | 177.5° |
| N27 | C33 | C35 | H31 | 178.1° | 5.0° |
| N27 | C33 | C35 | H32 | 58.1° | 124.9° |
| N27 | C33 | C35 | H33 | 61.9° | 115.0° |
| O30 | C26 | C25 | C28 | 121.7° | 120.0° |
| O30 | C26 | C25 | H27 | 119.1° | 120.1° |
| O30 | C26 | C28 | H27 | 119.4° | 120.0° |
| O30 | C26 | C28 | N29 | 50.4° | 61.0° |
| O30 | C26 | C28 | H25 | 170.0° | 58.9° |
| O30 | C26 | C28 | H26 | 69.3° | 179.0° |
| O30 | C26 | C25 | H29 | 68.5° | 54.7° |
| C25 | C26 | C28 | H27 | 119.3° | 120.0° |
| C25 | C26 | C28 | N29 | 171.7° | 179.0° |
| C25 | C26 | C28 | H25 | 68.7° | 61.0° |
| C25 | C26 | C28 | H26 | 52.0° | 59.1° |
| C25 | C26 | O30 | H28 | 180.0° | 60.0° |
| C26 | C25 | N27 | H30 | 75.9° | 122.5° |
| C26 | C25 | C31 | H34 | 71.1° | 65.0° |
| C26 | C25 | C31 | H35 | 48.4° | 55.0° |
| C26 | C28 | N29 | H25 | 119.7° | 120.0° |
| C26 | C28 | N29 | H26 | 119.7° | 120.0° |
| C26 | C28 | N29 | C11 | 159.5° | 178.7° |
| C26 | C28 | N29 | H23 | 38.5° | 54.7° |
| C26 | C28 | H25 | H26 | 121.0° | 120.1° |
| C28 | C26 | O30 | H28 | 56.8° | 60.0° |
| C28 | C26 | C25 | H29 | 53.2° | 65.3° |
| C19 | C24 | C23 | C22 | 0.3° | 0.5° |
| C19 | C24 | C23 | H39 | 180.0° | 179.7° |
| C24 | C19 | C31 | H34 | 54.1° | 30.1° |
| C24 | C19 | C31 | H35 | 173.7° | 150.0° |
| C24 | C19 | C20 | H36 | 179.4° | 179.7° |
| C19 | C24 | C23 | H38 | 179.7° | 179.7° |
| C35 | C33 | N27 | H30 | 1.2° | 5.0° |
| C33 | C35 | H31 | H32 | 120.0° | 120.0° |
| C33 | C35 | H31 | H33 | 120.0° | 119.9° |
| C33 | C35 | H32 | H33 | 120.0° | 120.0° |
| C28 | N29 | C11 | H23 | 120.9° | 124.0° |
| C28 | N29 | C11 | C13 | 68.2° | 83.8° |
| C28 | N29 | C11 | C6 | 57.9° | 155.7° |
| C28 | N29 | C11 | H22 | 175.4° | 36.0° |
| N29 | C28 | H25 | H26 | 121.0° | 119.9° |
| N29 | C28 | C26 | H27 | 69.0° | 59.0° |
| N29 | C11 | C13 | C6 | 126.2° | 120.2° |
| N29 | C11 | C13 | H22 | 116.9° | 119.7° |
| N29 | C11 | C13 | C1 | 160.9° | 166.3° |
| N29 | C11 | C6 | H22 | 118.0° | 119.7° |
| N29 | C11 | C6 | C7 | 48.4° | 41.6° |
| N29 | C11 | C6 | C5 | 133.1° | 138.9° |
| N29 | C11 | C13 | H7 | 79.1° | 46.6° |
| N29 | C11 | C13 | H8 | 40.8° | 74.1° |
| C11 | N29 | C28 | H25 | 80.9° | 58.7° |
| C11 | N29 | C28 | H26 | 39.8° | 61.3° |
| F32 | C22 | C23 | C24 | 179.9° | 179.7° |
| F32 | C22 | C21 | H37 | 0.5° | 0.1° |
| F32 | C22 | C23 | H38 | 0.1° | 0.1° |
| C22 | C23 | C24 | H38 | 180.0° | 179.8° |
| C23 | C22 | C21 | H37 | 178.9° | 180.0° |
| C22 | C23 | C24 | H39 | 179.6° | 179.7° |
| O34 | C33 | N27 | H30 | 179.2° | 175.1° |
| O34 | C33 | C35 | H31 | 0.0° | 175.0° |
| O34 | C33 | C35 | H32 | 120.0° | 55.0° |
| O34 | C33 | C35 | H33 | 120.0° | 65.1° |
| C11 | C13 | C1 | H7 | 120.0° | 119.7° |
| C11 | C13 | C1 | H8 | 120.0° | 119.7° |
| C13 | C11 | C6 | H22 | 117.0° | 120.1° |
| C11 | C13 | C1 | C4 | 171.5° | 167.7° |
| C11 | C13 | C1 | C2 | 71.0° | 69.7° |
| C11 | C13 | C1 | O12 | 59.7° | 61.2° |
| C13 | C11 | C6 | C7 | 173.4° | 161.7° |
| C13 | C11 | C6 | C5 | 8.0° | 18.7° |
| C11 | C13 | H7 | H8 | 119.9° | 120.7° |
| C13 | C11 | N29 | H23 | 170.9° | 40.2° |
| C1 | C13 | C11 | C6 | 34.7° | 46.1° |
| C13 | C1 | C4 | C3 | 112.1° | 89.6° |
| C13 | C1 | C2 | C3 | 109.8° | 89.7° |
| C13 | C1 | C4 | C2 | 116.2° | 114.7° |
| C13 | C1 | C4 | O12 | 128.0° | 130.0° |
| C13 | C1 | C2 | O12 | 130.1° | 129.9° |
| C13 | C1 | O12 | C5 | 55.1° | 45.1° |
| C13 | C1 | C2 | H1 | 6.6° | 24.9° |
| C13 | C1 | C2 | H2 | 133.8° | 155.7° |
| C13 | C1 | C4 | H5 | 131.5° | 155.9° |
| C13 | C1 | C4 | H6 | 4.4° | 25.0° |
| C1 | C13 | H7 | H8 | 119.9° | 120.6° |
| C1 | C13 | C11 | H22 | 82.2° | 74.1° |
| C11 | C6 | C7 | C5 | 178.6° | 179.5° |
| C11 | C6 | C7 | C8 | 179.5° | 179.2° |
| C11 | C6 | C5 | O12 | 1.8° | 0.9° |
| C11 | C6 | C5 | N10 | 179.6° | 179.1° |
| C6 | C11 | C13 | H7 | 154.7° | 73.6° |
| C6 | C11 | C13 | H8 | 85.4° | 165.7° |
| C11 | C6 | C7 | H21 | 0.5° | 0.7° |
| C6 | C11 | N29 | H23 | 63.0° | 80.3° |
| C4 | C3 | C2 | H3 | 116.7° | 114.6° |
| C4 | C3 | C2 | H4 | 116.7° | 114.6° |
| C3 | C4 | C1 | H5 | 116.4° | 114.6° |
| C3 | C4 | C1 | H6 | 116.5° | 114.5° |
| C4 | C3 | C2 | C1 | 4.2° | 25.1° |
| C3 | C4 | C1 | O12 | 119.9° | 140.4° |
| C4 | C3 | C2 | H1 | 120.6° | 139.5° |
| C4 | C3 | C2 | H2 | 112.2° | 89.5° |
| C4 | C3 | H3 | H4 | 128.9° | 131.3° |
| C3 | C4 | H5 | H6 | 129.5° | 131.4° |
| C3 | C2 | C1 | H1 | 116.4° | 114.5° |
| C3 | C2 | C1 | H2 | 116.4° | 114.6° |
| C3 | C2 | C1 | O12 | 120.1° | 140.4° |
| C3 | C2 | H1 | H2 | 129.5° | 131.4° |
| C2 | C3 | H3 | H4 | 128.8° | 131.2° |
| C2 | C3 | C4 | H5 | 112.2° | 89.4° |
| C2 | C3 | C4 | H6 | 120.7° | 139.6° |
| C4 | C1 | C2 | O12 | 115.9° | 115.3° |
| C4 | C1 | O12 | C5 | 177.1° | 176.0° |
| C4 | C1 | C2 | H1 | 120.6° | 139.7° |
| C4 | C1 | C2 | H2 | 112.3° | 89.5° |
| C1 | C4 | C3 | H3 | 112.5° | 139.6° |
| C1 | C4 | C3 | H4 | 120.9° | 89.5° |
| C1 | C4 | H5 | H6 | 129.5° | 131.3° |
| C4 | C1 | C13 | H7 | 51.5° | 72.6° |
| C4 | C1 | C13 | H8 | 68.4° | 48.0° |
| C2 | C1 | O12 | C5 | 76.0° | 85.5° |
| C1 | C2 | H1 | H2 | 129.5° | 131.2° |
| C1 | C2 | C3 | H3 | 112.5° | 139.6° |
| C1 | C2 | C3 | H4 | 120.9° | 89.5° |
| C2 | C1 | C4 | H5 | 112.3° | 89.4° |
| C2 | C1 | C4 | H6 | 120.6° | 139.7° |
| C2 | C1 | C13 | H7 | 49.0° | 170.7° |
| C2 | C1 | C13 | H8 | 168.9° | 50.0° |
| C1 | O12 | C5 | C6 | 25.7° | 14.2° |
| C1 | O12 | C5 | N10 | 155.7° | 165.8° |
| O12 | C1 | C2 | H1 | 123.5° | 105.0° |
| O12 | C1 | C2 | H2 | 3.7° | 25.8° |
| O12 | C1 | C4 | H5 | 3.5° | 25.8° |
| O12 | C1 | C4 | H6 | 123.6° | 105.1° |
| O12 | C1 | C13 | H7 | 179.7° | 58.4° |
| O12 | C1 | C13 | H8 | 60.4° | 179.1° |
| C6 | C7 | C8 | H21 | 180.0° | 180.0° |
| C7 | C6 | C5 | O12 | 179.7° | 179.6° |
| C7 | C6 | C5 | N10 | 1.1° | 0.4° |
| C6 | C7 | C8 | C14 | 179.5° | 180.0° |
| C6 | C7 | C8 | C9 | 0.2° | 0.1° |
| C7 | C6 | C11 | H22 | 69.6° | 78.1° |
| C5 | C6 | C7 | C8 | 0.9° | 0.3° |
| C6 | C5 | O12 | N10 | 178.6° | 180.0° |
| C6 | C5 | N10 | C9 | 0.4° | 0.2° |
| C5 | C6 | C7 | H21 | 179.1° | 179.7° |
| C5 | C6 | C11 | H22 | 108.9° | 101.4° |
| C7 | C8 | C14 | C9 | 179.7° | 179.9° |
| C7 | C8 | C14 | C15 | 97.0° | 87.8° |
| C7 | C8 | C9 | N10 | 0.5° | 0.1° |
| C7 | C8 | C9 | H9 | 179.5° | 179.8° |
| C7 | C8 | C14 | H10 | 142.4° | 32.2° |
| C7 | C8 | C14 | H11 | 23.6° | 152.2° |
| O12 | C5 | N10 | C9 | 179.1° | 179.8° |
| C5 | N10 | C9 | C8 | 0.3° | 0.0° |
| C5 | N10 | C9 | H9 | 179.7° | 179.9° |
| C18 | C15 | C14 | C8 | 72.8° | 59.2° |
| C18 | C15 | C14 | C16 | 118.8° | 119.9° |
| C18 | C15 | C14 | C17 | 122.4° | 120.0° |
| C18 | C15 | C16 | C17 | 120.7° | 120.0° |
| C18 | C15 | C14 | H10 | 166.6° | 179.2° |
| C18 | C15 | C14 | H11 | 47.8° | 60.8° |
| C18 | C15 | C17 | H12 | 180.0° | 63.8° |
| C18 | C15 | C17 | H13 | 60.0° | 56.2° |
| C18 | C15 | C17 | H14 | 60.0° | 176.2° |
| C15 | C18 | H15 | H16 | 120.0° | 120.1° |
| C15 | C18 | H15 | H17 | 120.0° | 119.9° |
| C15 | C18 | H16 | H17 | 120.0° | 119.9° |
| C18 | C15 | C16 | H18 | 180.0° | 174.2° |
| C18 | C15 | C16 | H19 | 60.0° | 65.8° |
| C18 | C15 | C16 | H20 | 60.0° | 54.2° |
| C8 | C14 | C15 | H10 | 120.6° | 120.0° |
| C8 | C14 | C15 | H11 | 120.6° | 120.0° |
| C14 | C8 | C9 | N10 | 179.8° | 179.8° |
| C8 | C14 | C15 | C16 | 168.5° | 60.7° |
| C8 | C14 | C15 | C17 | 49.6° | 179.3° |
| C14 | C8 | C9 | H9 | 0.2° | 0.2° |
| C8 | C14 | H10 | H11 | 118.1° | 120.0° |
| C14 | C8 | C7 | H21 | 0.5° | 0.0° |
| C9 | C8 | C14 | C15 | 83.3° | 92.1° |
| C8 | C9 | N10 | H9 | 180.0° | 179.9° |
| C9 | C8 | C14 | H10 | 37.3° | 147.8° |
| C9 | C8 | C14 | H11 | 156.1° | 27.9° |
| C9 | C8 | C7 | H21 | 179.8° | 179.9° |
| C14 | C15 | C16 | C17 | 118.3° | 120.0° |
| C15 | C14 | H10 | H11 | 118.1° | 120.0° |
| C14 | C15 | C17 | H12 | 56.9° | 56.2° |
| C14 | C15 | C17 | H13 | 176.9° | 176.3° |
| C14 | C15 | C17 | H14 | 63.1° | 63.8° |
| C14 | C15 | C18 | H15 | 180.0° | 59.9° |
| C14 | C15 | C18 | H16 | 60.0° | 180.0° |
| C14 | C15 | C18 | H17 | 60.0° | 60.0° |
| C14 | C15 | C16 | H18 | 59.0° | 54.2° |
| C14 | C15 | C16 | H19 | 61.0° | 174.2° |
| C14 | C15 | C16 | H20 | 179.0° | 65.7° |
| C16 | C15 | C14 | H10 | 47.9° | 59.3° |
| C16 | C15 | C14 | H11 | 70.9° | 179.2° |
| C16 | C15 | C17 | H12 | 60.8° | 176.2° |
| C16 | C15 | C17 | H13 | 59.2° | 63.8° |
| C16 | C15 | C17 | H14 | 179.2° | 56.2° |
| C16 | C15 | C18 | H15 | 61.5° | 60.0° |
| C16 | C15 | C18 | H16 | 58.5° | 60.1° |
| C16 | C15 | C18 | H17 | 178.5° | 180.0° |
| C15 | C16 | H18 | H19 | 120.0° | 120.0° |
| C15 | C16 | H18 | H20 | 120.0° | 120.0° |
| C15 | C16 | H19 | H20 | 120.0° | 120.0° |
| C17 | C15 | C14 | H10 | 71.0° | 60.7° |
| C17 | C15 | C14 | H11 | 170.2° | 59.2° |
| C15 | C17 | H12 | H13 | 120.0° | 120.0° |
| C15 | C17 | H12 | H14 | 120.0° | 120.1° |
| C15 | C17 | H13 | H14 | 120.0° | 120.0° |
| C17 | C15 | C18 | H15 | 58.6° | 179.9° |
| C17 | C15 | C18 | H16 | 178.6° | 60.0° |
| C17 | C15 | C18 | H17 | 61.4° | 60.0° |
| C17 | C15 | C16 | H18 | 59.3° | 65.8° |
| C17 | C15 | C16 | H19 | 179.4° | 54.2° |
| C17 | C15 | C16 | H20 | 60.7° | 174.3° |
| H1 | C2 | C3 | H3 | 3.9° | 105.9° |
| H1 | C2 | C3 | H4 | 122.6° | 24.9° |
| H2 | C2 | C3 | H3 | 131.1° | 25.1° |
| H2 | C2 | C3 | H4 | 4.5° | 155.9° |
| H3 | C3 | C4 | H5 | 131.1° | 25.2° |
| H3 | C3 | C4 | H6 | 3.9° | 105.8° |
| H4 | C3 | C4 | H5 | 4.5° | 156.1° |
| H4 | C3 | C4 | H6 | 122.6° | 25.1° |
| H7 | C13 | C11 | H22 | 37.8° | 166.3° |
| H8 | C13 | C11 | H22 | 157.7° | 45.6° |
| H12 | C17 | H13 | H14 | 119.9° | 120.0° |
| H15 | C18 | H16 | H17 | 119.9° | 120.0° |
| H18 | C16 | H19 | H20 | 120.0° | 119.9° |
| H22 | C11 | N29 | H23 | 54.5° | 159.9° |
| H23 | N29 | C28 | H25 | 158.2° | 65.3° |
| H23 | N29 | C28 | H26 | 81.1° | 174.8° |
| H25 | C28 | C26 | H27 | 50.6° | 179.0° |
| H26 | C28 | C26 | H27 | 171.3° | 60.9° |
| H27 | C26 | O30 | H28 | 61.7° | 180.0° |
| H27 | C26 | C25 | H29 | 172.4° | 174.7° |
| H29 | C25 | N27 | H30 | 165.9° | 2.5° |
| H29 | C25 | C31 | H34 | 46.9° | 175.0° |
| H29 | C25 | C31 | H35 | 166.4° | 65.0° |
| H31 | C35 | H32 | H33 | 120.0° | 120.0° |
| H36 | C20 | C21 | H37 | 0.4° | 0.0° |
| H38 | C23 | C24 | H39 | 0.4° | 0.0° |
