LRQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O32 | C31 | doub | 1.22Å | 1.22Å | |
| O33 | C31 | sing | 1.35Å | 1.30Å | |
| C31 | C30 | sing | 1.46Å | 1.48Å | |
| C30 | C29 | doub | 1.35Å | 1.33Å | |
| C29 | C25 | sing | 1.47Å | 1.47Å | |
| C25 | C24 | doub | 1.40Å | 1.40Å | Aromatic |
| C25 | C26 | sing | 1.40Å | 1.40Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.37Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.37Å | Aromatic |
| C23 | F34 | sing | 1.35Å | 1.35Å | |
| C23 | C22 | doub | 1.39Å | 1.38Å | Aromatic |
| C3 | C2 | sing | 1.53Å | 1.51Å | |
| C27 | C22 | sing | 1.39Å | 1.40Å | Aromatic |
| C27 | F28 | sing | 1.35Å | 1.35Å | |
| C1 | C2 | sing | 1.53Å | 1.51Å | |
| C22 | C11 | sing | 1.51Å | 1.53Å | |
| C2 | C4 | sing | 1.53Å | 1.57Å | |
| C2 | F35 | sing | 1.40Å | 1.38Å | |
| C4 | N5 | sing | 1.47Å | 1.47Å | |
| C11 | N5 | sing | 1.47Å | 1.47Å | |
| C11 | C10 | sing | 1.54Å | 1.54Å | |
| C11 | C12 | sing | 1.51Å | 1.50Å | |
| N5 | C6 | sing | 1.46Å | 1.48Å | |
| N20 | C12 | sing | 1.37Å | 1.38Å | Aromatic |
| N20 | C19 | sing | 1.37Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.53Å | 1.52Å | |
| C12 | C13 | doub | 1.35Å | 1.37Å | Aromatic |
| C19 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C14 | sing | 1.42Å | 1.41Å | Aromatic |
| C6 | C21 | sing | 1.53Å | 1.53Å | |
| C6 | C8 | sing | 1.52Å | 1.52Å | |
| C13 | C21 | sing | 1.51Å | 1.50Å | |
| C13 | C14 | sing | 1.45Å | 1.44Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | doub | 1.40Å | 1.39Å | Aromatic |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.37Å | 1.39Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H13 | sing | 1.08Å | 1.08Å | |
| C16 | H14 | sing | 1.08Å | 1.08Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.08Å | 1.08Å | |
| C30 | H18 | sing | 1.08Å | 1.08Å | |
| C4 | H19 | sing | 1.09Å | 1.10Å | |
| C4 | H20 | sing | 1.09Å | 1.10Å | |
| N20 | H22 | sing | 0.97Å | 1.00Å | |
| C18 | H23 | sing | 1.08Å | 1.08Å | |
| C17 | H24 | sing | 1.08Å | 1.08Å | |
| C6 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C29 | H27 | sing | 1.08Å | 1.08Å | |
| O33 | H28 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O32 | C31 | O33 | 122.8° | 119.9° |
| O32 | C31 | C30 | 120.8° | 120.0° |
| O33 | C31 | C30 | 116.4° | 120.1° |
| C31 | O33 | H28 | 109.5° | 114.0° |
| C31 | C30 | C29 | 122.5° | 120.0° |
| C31 | C30 | H18 | 118.7° | 120.0° |
| C30 | C29 | C25 | 126.7° | 120.0° |
| C29 | C30 | H18 | 118.8° | 120.0° |
| C30 | C29 | H27 | 116.6° | 120.0° |
| C29 | C25 | C24 | 120.4° | 120.1° |
| C29 | C25 | C26 | 120.3° | 120.2° |
| C25 | C29 | H27 | 116.7° | 120.0° |
| C24 | C25 | C26 | 119.3° | 119.7° |
| C25 | C24 | C23 | 119.2° | 119.8° |
| C25 | C24 | H17 | 120.4° | 120.1° |
| C25 | C26 | C27 | 118.7° | 119.8° |
| C25 | C26 | H26 | 120.6° | 120.1° |
| C24 | C23 | F34 | 118.8° | 119.9° |
| C24 | C23 | C22 | 123.9° | 120.2° |
| C23 | C24 | H17 | 120.4° | 120.1° |
| C26 | C27 | C22 | 123.9° | 120.1° |
| C26 | C27 | F28 | 118.4° | 119.9° |
| C27 | C26 | H26 | 120.6° | 120.1° |
| F34 | C23 | C22 | 117.2° | 119.9° |
| C23 | C22 | C27 | 115.0° | 120.3° |
| C23 | C22 | C11 | 125.5° | 119.9° |
| C3 | C2 | C1 | 109.9° | 109.5° |
| C3 | C2 | C4 | 110.9° | 109.5° |
| C3 | C2 | F35 | 108.3° | 109.4° |
| C2 | C3 | H4 | 109.5° | 109.5° |
| C2 | C3 | H5 | 109.4° | 109.5° |
| C2 | C3 | H6 | 109.4° | 109.5° |
| C22 | C27 | F28 | 117.8° | 120.0° |
| C27 | C22 | C11 | 119.5° | 119.8° |
| C1 | C2 | C4 | 108.3° | 109.5° |
| C1 | C2 | F35 | 108.3° | 109.4° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.4° | 109.5° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C22 | C11 | N5 | 106.6° | 110.8° |
| C22 | C11 | C10 | 119.5° | 110.9° |
| C22 | C11 | C12 | 109.1° | 111.4° |
| C4 | C2 | F35 | 111.1° | 109.5° |
| C2 | C4 | N5 | 111.8° | 109.5° |
| C2 | C4 | H19 | 108.9° | 109.5° |
| C2 | C4 | H20 | 108.9° | 109.5° |
| C4 | N5 | C11 | 112.6° | 111.0° |
| C4 | N5 | C6 | 113.0° | 111.1° |
| N5 | C4 | H19 | 108.9° | 109.5° |
| N5 | C4 | H20 | 108.9° | 109.5° |
| N5 | C11 | C10 | 107.3° | 108.1° |
| N5 | C11 | C12 | 108.9° | 107.9° |
| C11 | N5 | C6 | 113.4° | 111.9° |
| C10 | C11 | C12 | 105.2° | 107.6° |
| C11 | C10 | C9 | 107.9° | 107.9° |
| C11 | C10 | H11 | 109.9° | 109.8° |
| C11 | C10 | H12 | 109.9° | 109.8° |
| C11 | C12 | N20 | 126.3° | 127.3° |
| C11 | C12 | C13 | 123.8° | 122.7° |
| N5 | C6 | C21 | 110.1° | 111.3° |
| N5 | C6 | C8 | 110.1° | 111.7° |
| N5 | C6 | H25 | 108.3° | 107.5° |
| C12 | N20 | C19 | 108.6° | 109.6° |
| N20 | C12 | C13 | 109.9° | 110.0° |
| C12 | N20 | H22 | 125.7° | 125.2° |
| N20 | C19 | C18 | 130.4° | 132.0° |
| N20 | C19 | C14 | 107.8° | 107.4° |
| C19 | N20 | H22 | 125.7° | 125.2° |
| C10 | C9 | C8 | 111.8° | 109.1° |
| C10 | C9 | H9 | 108.9° | 109.6° |
| C10 | C9 | H10 | 108.9° | 109.7° |
| C9 | C10 | H11 | 109.9° | 109.8° |
| C9 | C10 | H12 | 109.9° | 109.8° |
| C12 | C13 | C21 | 122.6° | 123.8° |
| C12 | C13 | C14 | 106.9° | 107.1° |
| C18 | C19 | C14 | 121.8° | 120.6° |
| C19 | C18 | C17 | 118.4° | 116.9° |
| C19 | C18 | H23 | 120.8° | 121.5° |
| C19 | C14 | C13 | 106.8° | 105.9° |
| C19 | C14 | C15 | 118.6° | 121.2° |
| C21 | C6 | C8 | 112.9° | 111.9° |
| C6 | C21 | C13 | 110.0° | 109.2° |
| C6 | C21 | H15 | 109.4° | 109.5° |
| C6 | C21 | H16 | 109.3° | 109.6° |
| C21 | C6 | H25 | 107.7° | 107.5° |
| C6 | C8 | C9 | 111.4° | 110.8° |
| C6 | C8 | H7 | 109.0° | 109.2° |
| C6 | C8 | H8 | 109.0° | 109.2° |
| C8 | C6 | H25 | 107.7° | 106.7° |
| C21 | C13 | C14 | 130.5° | 129.2° |
| C13 | C21 | H15 | 109.3° | 109.5° |
| C13 | C21 | H16 | 109.3° | 109.5° |
| C13 | C14 | C15 | 134.6° | 132.9° |
| C18 | C17 | C16 | 120.7° | 122.2° |
| C17 | C18 | H23 | 120.8° | 121.6° |
| C18 | C17 | H24 | 119.7° | 118.9° |
| C14 | C15 | C16 | 119.8° | 116.9° |
| C14 | C15 | H13 | 120.1° | 121.5° |
| C9 | C8 | H7 | 109.0° | 109.2° |
| C9 | C8 | H8 | 109.0° | 109.2° |
| C8 | C9 | H9 | 108.9° | 109.5° |
| C8 | C9 | H10 | 108.9° | 109.5° |
| C17 | C16 | C15 | 120.8° | 122.1° |
| C17 | C16 | H14 | 119.6° | 118.9° |
| C16 | C17 | H24 | 119.6° | 118.9° |
| C16 | C15 | H13 | 120.1° | 121.6° |
| C15 | C16 | H14 | 119.6° | 118.9° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.4° |
| H4 | C3 | H5 | 109.5° | 109.5° |
| H4 | C3 | H6 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H7 | C8 | H8 | 109.4° | 109.2° |
| H9 | C9 | H10 | 109.5° | 109.6° |
| H11 | C10 | H12 | 109.5° | 109.7° |
| H15 | C21 | H16 | 109.5° | 109.5° |
| H19 | C4 | H20 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O32 | C31 | O33 | C30 | 179.5° | 180.0° |
| O32 | C31 | C30 | C29 | 179.2° | 0.0° |
| O32 | C31 | C30 | H18 | 0.8° | 179.9° |
| O32 | C31 | O33 | H28 | 0.0° | 0.1° |
| O33 | C31 | C30 | C29 | 1.3° | 180.0° |
| O33 | C31 | C30 | H18 | 178.7° | 0.1° |
| C31 | C30 | C29 | H18 | 180.0° | 179.9° |
| C31 | C30 | C29 | C25 | 177.6° | 180.0° |
| C31 | C30 | C29 | H27 | 2.4° | 0.0° |
| C30 | C31 | O33 | H28 | 179.4° | 180.0° |
| C30 | C29 | C25 | H27 | 180.0° | 180.0° |
| C30 | C29 | C25 | C24 | 0.9° | 180.0° |
| C30 | C29 | C25 | C26 | 179.2° | 0.3° |
| C29 | C25 | C24 | C26 | 179.9° | 179.7° |
| C29 | C25 | C24 | C23 | 179.8° | 180.0° |
| C29 | C25 | C26 | C27 | 179.8° | 179.7° |
| C29 | C25 | C24 | H17 | 0.2° | 0.0° |
| C25 | C29 | C30 | H18 | 2.4° | 0.1° |
| C29 | C25 | C26 | H26 | 0.2° | 0.3° |
| C25 | C24 | C23 | H17 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.1° | 0.1° |
| C25 | C24 | C23 | F34 | 180.0° | 180.0° |
| C25 | C24 | C23 | C22 | 0.1° | 0.6° |
| C24 | C25 | C26 | H26 | 180.0° | 180.0° |
| C24 | C25 | C29 | H27 | 179.1° | 0.0° |
| C26 | C25 | C24 | C23 | 0.1° | 0.3° |
| C25 | C26 | C27 | H26 | 180.0° | 180.0° |
| C25 | C26 | C27 | C22 | 0.3° | 0.1° |
| C25 | C26 | C27 | F28 | 179.9° | 179.9° |
| C26 | C25 | C24 | H17 | 179.9° | 179.7° |
| C26 | C25 | C29 | H27 | 0.8° | 179.7° |
| C24 | C23 | F34 | C22 | 179.9° | 179.4° |
| C24 | C23 | C22 | C27 | 0.5° | 0.6° |
| C24 | C23 | C22 | C11 | 179.0° | 179.7° |
| C26 | C27 | C22 | C23 | 0.5° | 0.3° |
| C26 | C27 | C22 | F28 | 179.7° | 180.0° |
| C26 | C27 | C22 | C11 | 179.2° | 180.0° |
| F34 | C23 | C22 | C27 | 179.6° | 180.0° |
| F34 | C23 | C22 | C11 | 1.1° | 0.3° |
| F34 | C23 | C24 | H17 | 0.0° | 0.0° |
| C23 | C22 | C27 | C11 | 178.6° | 179.7° |
| C23 | C22 | C27 | F28 | 179.7° | 179.7° |
| C23 | C22 | C11 | N5 | 111.1° | 95.6° |
| C23 | C22 | C11 | C10 | 10.5° | 24.5° |
| C23 | C22 | C11 | C12 | 131.4° | 144.2° |
| C22 | C23 | C24 | H17 | 179.9° | 179.4° |
| C3 | C2 | C1 | C4 | 121.3° | 120.0° |
| C3 | C2 | C1 | F35 | 118.2° | 120.0° |
| C3 | C2 | C4 | F35 | 120.6° | 120.0° |
| C3 | C2 | C4 | N5 | 58.2° | 175.1° |
| C3 | C2 | C1 | H1 | 180.0° | 180.0° |
| C3 | C2 | C1 | H2 | 60.0° | 60.0° |
| C3 | C2 | C1 | H3 | 60.0° | 60.0° |
| C2 | C3 | H4 | H5 | 120.0° | 120.0° |
| C2 | C3 | H4 | H6 | 120.0° | 120.0° |
| C2 | C3 | H5 | H6 | 120.0° | 120.0° |
| C3 | C2 | C4 | H19 | 62.2° | 55.0° |
| C3 | C2 | C4 | H20 | 178.5° | 65.0° |
| C27 | C22 | C11 | N5 | 67.4° | 84.1° |
| C27 | C22 | C11 | C10 | 171.1° | 155.9° |
| C27 | C22 | C11 | C12 | 50.1° | 36.1° |
| C22 | C27 | C26 | H26 | 179.7° | 180.0° |
| F28 | C27 | C22 | C11 | 1.1° | 0.0° |
| F28 | C27 | C26 | H26 | 0.1° | 0.0° |
| C1 | C2 | C4 | F35 | 118.8° | 120.0° |
| C1 | C2 | C4 | N5 | 178.9° | 55.0° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C1 | C2 | C3 | H4 | 180.0° | 60.6° |
| C1 | C2 | C3 | H5 | 60.0° | 179.4° |
| C1 | C2 | C3 | H6 | 60.0° | 59.4° |
| C1 | C2 | C4 | H19 | 58.5° | 65.0° |
| C1 | C2 | C4 | H20 | 60.8° | 175.0° |
| C22 | C11 | N5 | C4 | 63.5° | 59.3° |
| C22 | C11 | N5 | C10 | 129.0° | 121.7° |
| C22 | C11 | N5 | C12 | 117.6° | 122.3° |
| C22 | C11 | C10 | C12 | 122.9° | 122.1° |
| C22 | C11 | N5 | C6 | 166.7° | 176.0° |
| C22 | C11 | C12 | N20 | 48.3° | 37.4° |
| C22 | C11 | C10 | C9 | 176.9° | 174.9° |
| C22 | C11 | C12 | C13 | 132.0° | 142.7° |
| C22 | C11 | C10 | H11 | 57.1° | 65.4° |
| C22 | C11 | C10 | H12 | 63.4° | 55.3° |
| C2 | C4 | N5 | H19 | 120.3° | 120.0° |
| C2 | C4 | N5 | H20 | 120.4° | 120.0° |
| C2 | C4 | N5 | C11 | 139.7° | 162.2° |
| C2 | C4 | N5 | C6 | 90.3° | 72.6° |
| C4 | C2 | C1 | H1 | 58.7° | 60.0° |
| C4 | C2 | C1 | H2 | 61.3° | 180.0° |
| C4 | C2 | C1 | H3 | 178.7° | 60.0° |
| C4 | C2 | C3 | H4 | 60.3° | 179.4° |
| C4 | C2 | C3 | H5 | 179.7° | 59.4° |
| C4 | C2 | C3 | H6 | 59.7° | 60.6° |
| C2 | C4 | H19 | H20 | 118.9° | 120.0° |
| F35 | C2 | C4 | N5 | 62.4° | 64.9° |
| F35 | C2 | C1 | H1 | 61.8° | 60.0° |
| F35 | C2 | C1 | H2 | 178.2° | 60.0° |
| F35 | C2 | C1 | H3 | 58.2° | 180.0° |
| F35 | C2 | C3 | H4 | 61.9° | 59.4° |
| F35 | C2 | C3 | H5 | 58.1° | 60.6° |
| F35 | C2 | C3 | H6 | 178.1° | 179.4° |
| F35 | C2 | C4 | H19 | 177.2° | 175.0° |
| F35 | C2 | C4 | H20 | 58.0° | 55.0° |
| C4 | N5 | C11 | C6 | 129.8° | 124.7° |
| C4 | N5 | C11 | C10 | 65.5° | 62.4° |
| C4 | N5 | C11 | C12 | 178.9° | 178.4° |
| C4 | N5 | C6 | C21 | 163.8° | 167.0° |
| C4 | N5 | C6 | C8 | 71.2° | 67.2° |
| N5 | C4 | H19 | H20 | 119.0° | 120.0° |
| C4 | N5 | C6 | H25 | 46.3° | 49.5° |
| N5 | C11 | C10 | C12 | 115.9° | 116.3° |
| N5 | C11 | C12 | N20 | 164.3° | 159.3° |
| N5 | C11 | C10 | C9 | 61.9° | 63.4° |
| N5 | C11 | C12 | C13 | 16.1° | 20.8° |
| C11 | N5 | C6 | C21 | 66.6° | 68.4° |
| C11 | N5 | C6 | C8 | 58.5° | 57.4° |
| N5 | C11 | C10 | H11 | 178.3° | 56.3° |
| N5 | C11 | C10 | H12 | 57.8° | 177.0° |
| C11 | N5 | C4 | H19 | 19.4° | 42.2° |
| C11 | N5 | C4 | H20 | 100.0° | 77.8° |
| C11 | N5 | C6 | H25 | 176.0° | 174.2° |
| C10 | C11 | N5 | C6 | 64.3° | 62.4° |
| C10 | C11 | C12 | N20 | 81.0° | 84.3° |
| C11 | C10 | C9 | H11 | 119.7° | 119.6° |
| C11 | C10 | C9 | H12 | 119.8° | 119.6° |
| C10 | C11 | C12 | C13 | 98.6° | 95.6° |
| C11 | C10 | C9 | C8 | 57.9° | 60.4° |
| C11 | C10 | C9 | H9 | 62.5° | 179.8° |
| C11 | C10 | C9 | H10 | 178.2° | 59.5° |
| C11 | C10 | H11 | H12 | 120.7° | 120.8° |
| C12 | C11 | N5 | C6 | 49.1° | 53.7° |
| C11 | C12 | N20 | C13 | 179.7° | 180.0° |
| C11 | C12 | N20 | C19 | 180.0° | 179.6° |
| C12 | C11 | C10 | C9 | 53.9° | 52.8° |
| C11 | C12 | C13 | C21 | 0.2° | 0.5° |
| C11 | C12 | C13 | C14 | 179.9° | 179.5° |
| C12 | C11 | C10 | H11 | 65.8° | 172.5° |
| C12 | C11 | C10 | H12 | 173.7° | 66.8° |
| C11 | C12 | N20 | H22 | 0.1° | 0.5° |
| N5 | C6 | C21 | C8 | 123.4° | 125.7° |
| N5 | C6 | C21 | H25 | 117.8° | 117.5° |
| N5 | C6 | C8 | H25 | 117.8° | 117.2° |
| N5 | C6 | C21 | C13 | 45.2° | 42.9° |
| N5 | C6 | C8 | C9 | 50.4° | 53.2° |
| N5 | C6 | C8 | H7 | 69.9° | 173.5° |
| N5 | C6 | C8 | H8 | 170.7° | 67.1° |
| N5 | C6 | C21 | H15 | 165.3° | 77.0° |
| N5 | C6 | C21 | H16 | 74.8° | 162.9° |
| C6 | N5 | C4 | H19 | 149.4° | 167.4° |
| C6 | N5 | C4 | H20 | 30.1° | 47.4° |
| C12 | N20 | C19 | H22 | 180.0° | 179.9° |
| C12 | N20 | C19 | C18 | 179.8° | 179.8° |
| C12 | N20 | C19 | C14 | 0.2° | 0.2° |
| N20 | C12 | C13 | C21 | 179.5° | 179.5° |
| N20 | C12 | C13 | C14 | 0.3° | 0.5° |
| C19 | N20 | C12 | C13 | 0.3° | 0.4° |
| N20 | C19 | C18 | C14 | 179.9° | 180.0° |
| N20 | C19 | C14 | C13 | 0.0° | 0.1° |
| N20 | C19 | C18 | C17 | 180.0° | 179.8° |
| N20 | C19 | C14 | C15 | 180.0° | 179.9° |
| N20 | C19 | C18 | H23 | 0.0° | 0.0° |
| C10 | C9 | C8 | C6 | 52.6° | 55.3° |
| C10 | C9 | C8 | H9 | 120.3° | 119.9° |
| C10 | C9 | C8 | H10 | 120.3° | 120.0° |
| C10 | C9 | C8 | H7 | 67.7° | 175.6° |
| C10 | C9 | C8 | H8 | 172.9° | 65.1° |
| C10 | C9 | H9 | H10 | 118.9° | 120.3° |
| C9 | C10 | H11 | H12 | 120.8° | 120.8° |
| C12 | C13 | C14 | C19 | 0.1° | 0.4° |
| C12 | C13 | C21 | C6 | 14.5° | 11.0° |
| C12 | C13 | C21 | C14 | 179.7° | 180.0° |
| C12 | C13 | C14 | C15 | 179.9° | 179.6° |
| C12 | C13 | C21 | H15 | 134.6° | 108.9° |
| C12 | C13 | C21 | H16 | 105.6° | 131.0° |
| C13 | C12 | N20 | H22 | 179.7° | 179.5° |
| C18 | C19 | C14 | C13 | 179.9° | 179.9° |
| C19 | C18 | C17 | H23 | 180.0° | 179.9° |
| C18 | C19 | C14 | C15 | 0.1° | 0.1° |
| C19 | C18 | C17 | C16 | 0.1° | 0.1° |
| C18 | C19 | N20 | H22 | 0.2° | 0.2° |
| C19 | C18 | C17 | H24 | 179.9° | 180.0° |
| C19 | C14 | C13 | C21 | 179.6° | 179.6° |
| C19 | C14 | C13 | C15 | 180.0° | 180.0° |
| C14 | C19 | C18 | C17 | 0.0° | 0.1° |
| C19 | C14 | C15 | C16 | 0.0° | 0.1° |
| C19 | C14 | C15 | H13 | 180.0° | 180.0° |
| C14 | C19 | N20 | H22 | 179.8° | 179.8° |
| C14 | C19 | C18 | H23 | 180.0° | 180.0° |
| C21 | C6 | C8 | H25 | 118.7° | 117.3° |
| C6 | C21 | C13 | H15 | 120.1° | 119.9° |
| C6 | C21 | C13 | H16 | 120.1° | 120.0° |
| C6 | C21 | C13 | C14 | 165.2° | 169.0° |
| C21 | C6 | C8 | C9 | 73.0° | 72.2° |
| C21 | C6 | C8 | H7 | 166.7° | 48.1° |
| C21 | C6 | C8 | H8 | 47.3° | 167.4° |
| C6 | C21 | H15 | H16 | 119.8° | 120.2° |
| C8 | C6 | C21 | C13 | 78.2° | 82.8° |
| C6 | C8 | C9 | H7 | 120.3° | 120.3° |
| C6 | C8 | C9 | H8 | 120.3° | 120.3° |
| C6 | C8 | H7 | H8 | 119.1° | 119.3° |
| C6 | C8 | C9 | H9 | 67.7° | 175.1° |
| C6 | C8 | C9 | H10 | 172.9° | 64.7° |
| C8 | C6 | C21 | H15 | 41.9° | 157.3° |
| C8 | C6 | C21 | H16 | 161.7° | 37.2° |
| C21 | C13 | C14 | C15 | 0.4° | 0.4° |
| C13 | C21 | H15 | H16 | 119.7° | 120.1° |
| C13 | C21 | C6 | H25 | 163.1° | 160.3° |
| C13 | C14 | C15 | C16 | 180.0° | 179.9° |
| C13 | C14 | C15 | H13 | 0.0° | 0.0° |
| C14 | C13 | C21 | H15 | 45.1° | 71.1° |
| C14 | C13 | C21 | H16 | 74.7° | 49.0° |
| C18 | C17 | C16 | H24 | 180.0° | 179.8° |
| C18 | C17 | C16 | C15 | 0.2° | 0.1° |
| C18 | C17 | C16 | H14 | 179.8° | 179.9° |
| C14 | C15 | C16 | C17 | 0.2° | 0.1° |
| C14 | C15 | C16 | H13 | 180.0° | 179.9° |
| C14 | C15 | C16 | H14 | 179.9° | 180.0° |
| C9 | C8 | H7 | H8 | 119.1° | 119.4° |
| C8 | C9 | H9 | H10 | 119.0° | 120.1° |
| C8 | C9 | C10 | H11 | 177.6° | 59.2° |
| C8 | C9 | C10 | H12 | 61.9° | 179.9° |
| C9 | C8 | C6 | H25 | 168.3° | 170.5° |
| C17 | C16 | C15 | H14 | 180.0° | 180.0° |
| C17 | C16 | C15 | H13 | 179.8° | 180.0° |
| C16 | C17 | C18 | H23 | 179.9° | 180.0° |
| C15 | C16 | C17 | H24 | 179.8° | 179.9° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H4 | C3 | H5 | H6 | 120.0° | 120.0° |
| H7 | C8 | C9 | H9 | 172.0° | 64.6° |
| H7 | C8 | C9 | H10 | 52.6° | 55.6° |
| H7 | C8 | C6 | H25 | 48.0° | 69.2° |
| H8 | C8 | C9 | H9 | 52.6° | 54.8° |
| H8 | C8 | C9 | H10 | 66.8° | 174.9° |
| H8 | C8 | C6 | H25 | 71.4° | 50.1° |
| H9 | C9 | C10 | H11 | 57.2° | 60.6° |
| H9 | C9 | C10 | H12 | 177.7° | 60.1° |
| H10 | C9 | C10 | H11 | 62.1° | 179.1° |
| H10 | C9 | C10 | H12 | 58.4° | 60.2° |
| H13 | C15 | C16 | H14 | 0.1° | 0.0° |
| H14 | C16 | C17 | H24 | 0.2° | 0.1° |
| H15 | C21 | C6 | H25 | 76.9° | 40.4° |
| H16 | C21 | C6 | H25 | 43.0° | 79.7° |
| H18 | C30 | C29 | H27 | 177.6° | 179.9° |
| H23 | C18 | C17 | H24 | 0.1° | 0.2° |
