LUF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C25 | doub | 1.22Å | 1.23Å | |
| C25 | O1 | sing | 1.35Å | 1.46Å | |
| C25 | C24 | sing | 1.47Å | 1.44Å | |
| O1 | C23 | sing | 1.46Å | 1.42Å | |
| C24 | C22 | doub | 1.33Å | 1.32Å | |
| C23 | C22 | sing | 1.51Å | 1.49Å | |
| C23 | O2 | sing | 1.43Å | 1.42Å | |
| C22 | C20 | sing | 1.51Å | 1.49Å | |
| C20 | C18 | sing | 1.53Å | 1.49Å | |
| C18 | C19 | sing | 1.51Å | 1.49Å | |
| C21 | C17 | sing | 1.51Å | 1.49Å | |
| C19 | C17 | doub | 1.31Å | 1.32Å | |
| C17 | C16 | sing | 1.51Å | 1.49Å | |
| C16 | C15 | sing | 1.53Å | 1.51Å | |
| C15 | C13 | sing | 1.51Å | 1.49Å | |
| C13 | C12 | doub | 1.31Å | 1.32Å | |
| C14 | C12 | sing | 1.51Å | 1.48Å | |
| C12 | C10 | sing | 1.51Å | 1.50Å | |
| C10 | C7 | sing | 1.53Å | 1.52Å | |
| C8 | C1 | sing | 1.53Å | 1.50Å | |
| C7 | C3 | sing | 1.51Å | 1.52Å | |
| C1 | C9 | sing | 1.53Å | 1.51Å | |
| C1 | C3 | sing | 1.50Å | 1.48Å | |
| C1 | C2 | sing | 1.53Å | 1.50Å | |
| C3 | C6 | doub | 1.29Å | 1.32Å | |
| C2 | C4 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.51Å | |
| C6 | C5 | sing | 1.50Å | 1.49Å | |
| C6 | C11 | sing | 1.51Å | 1.49Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C24 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| O2 | H25 | sing | 0.97Å | 0.95Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.08Å | 1.08Å | |
| C16 | H29 | sing | 1.09Å | 1.10Å | |
| C16 | H30 | sing | 1.09Å | 1.10Å | |
| C14 | H31 | sing | 1.09Å | 1.10Å | |
| C14 | H32 | sing | 1.09Å | 1.10Å | |
| C14 | H33 | sing | 1.09Å | 1.10Å | |
| C9 | H35 | sing | 1.09Å | 1.10Å | |
| C9 | H36 | sing | 1.09Å | 1.10Å | |
| C9 | H37 | sing | 1.09Å | 1.10Å | |
| C11 | H38 | sing | 1.09Å | 1.10Å | |
| C11 | H39 | sing | 1.09Å | 1.10Å | |
| C11 | H40 | sing | 1.09Å | 1.10Å | |
| C2 | H41 | sing | 1.09Å | 1.10Å | |
| C2 | H42 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C25 | O1 | 125.6° | 125.0° |
| O3 | C25 | C24 | 124.5° | 125.0° |
| O1 | C25 | C24 | 109.9° | 110.0° |
| C25 | O1 | C23 | 106.6° | 107.6° |
| C25 | C24 | C22 | 103.7° | 109.5° |
| C25 | C24 | H22 | 128.1° | 125.3° |
| O1 | C23 | C22 | 102.0° | 106.0° |
| O1 | C23 | O2 | 113.8° | 110.2° |
| O1 | C23 | H24 | 109.6° | 110.2° |
| C24 | C22 | C23 | 115.4° | 107.0° |
| C24 | C22 | C20 | 124.7° | 126.5° |
| C22 | C24 | H22 | 128.2° | 125.3° |
| C22 | C23 | O2 | 112.9° | 109.8° |
| C23 | C22 | C20 | 119.9° | 126.5° |
| C22 | C23 | H24 | 108.7° | 110.4° |
| O2 | C23 | H24 | 109.6° | 110.2° |
| C23 | O2 | H25 | 109.5° | 114.0° |
| C22 | C20 | C18 | 110.4° | 109.5° |
| C22 | C20 | H16 | 109.2° | 109.5° |
| C22 | C20 | H17 | 109.2° | 109.5° |
| C20 | C18 | C19 | 105.6° | 109.5° |
| C18 | C20 | H16 | 109.2° | 109.4° |
| C18 | C20 | H17 | 109.3° | 109.5° |
| C20 | C18 | H26 | 110.4° | 109.4° |
| C20 | C18 | H27 | 110.4° | 109.4° |
| C18 | C19 | C17 | 122.0° | 120.0° |
| C19 | C18 | H26 | 110.4° | 109.5° |
| C19 | C18 | H27 | 110.4° | 109.5° |
| C18 | C19 | H28 | 119.0° | 119.9° |
| C21 | C17 | C19 | 120.4° | 120.0° |
| C21 | C17 | C16 | 121.2° | 120.0° |
| C17 | C21 | H18 | 109.5° | 109.5° |
| C17 | C21 | H19 | 109.5° | 109.5° |
| C17 | C21 | H20 | 109.5° | 109.5° |
| C19 | C17 | C16 | 118.5° | 119.9° |
| C17 | C19 | H28 | 119.0° | 120.1° |
| C17 | C16 | C15 | 110.6° | 109.5° |
| C17 | C16 | H29 | 109.2° | 109.4° |
| C17 | C16 | H30 | 109.2° | 109.4° |
| C16 | C15 | C13 | 110.8° | 109.5° |
| C16 | C15 | H14 | 109.1° | 109.5° |
| C16 | C15 | H15 | 109.1° | 109.5° |
| C15 | C16 | H29 | 109.2° | 109.6° |
| C15 | C16 | H30 | 109.2° | 109.5° |
| C15 | C13 | C12 | 121.6° | 120.0° |
| C15 | C13 | H13 | 119.2° | 120.0° |
| C13 | C15 | H14 | 109.2° | 109.4° |
| C13 | C15 | H15 | 109.1° | 109.4° |
| C13 | C12 | C14 | 120.8° | 120.0° |
| C13 | C12 | C10 | 119.5° | 120.0° |
| C12 | C13 | H13 | 119.2° | 120.0° |
| C14 | C12 | C10 | 119.6° | 120.0° |
| C12 | C14 | H31 | 109.5° | 109.4° |
| C12 | C14 | H32 | 109.5° | 109.5° |
| C12 | C14 | H33 | 109.5° | 109.4° |
| C12 | C10 | C7 | 111.2° | 109.5° |
| C12 | C10 | H11 | 109.0° | 109.5° |
| C12 | C10 | H12 | 109.0° | 109.5° |
| C10 | C7 | C3 | 112.6° | 109.5° |
| C10 | C7 | H6 | 108.7° | 109.5° |
| C10 | C7 | H7 | 108.7° | 109.5° |
| C7 | C10 | H11 | 109.1° | 109.5° |
| C7 | C10 | H12 | 109.0° | 109.4° |
| C8 | C1 | C9 | 111.6° | 109.4° |
| C8 | C1 | C3 | 106.8° | 109.4° |
| C8 | C1 | C2 | 112.6° | 109.4° |
| C1 | C8 | H8 | 109.5° | 109.5° |
| C1 | C8 | H9 | 109.5° | 109.5° |
| C1 | C8 | H10 | 109.5° | 109.5° |
| C7 | C3 | C1 | 121.3° | 117.9° |
| C7 | C3 | C6 | 122.0° | 117.9° |
| C3 | C7 | H6 | 108.7° | 109.4° |
| C3 | C7 | H7 | 108.7° | 109.5° |
| C9 | C1 | C3 | 111.9° | 109.4° |
| C9 | C1 | C2 | 111.6° | 109.2° |
| C1 | C9 | H35 | 109.5° | 109.5° |
| C1 | C9 | H36 | 109.5° | 109.5° |
| C1 | C9 | H37 | 109.5° | 109.5° |
| C3 | C1 | C2 | 101.8° | 110.1° |
| C1 | C3 | C6 | 116.5° | 124.1° |
| C1 | C2 | C4 | 108.6° | 108.4° |
| C1 | C2 | H41 | 109.7° | 109.6° |
| C1 | C2 | H42 | 109.7° | 109.6° |
| C3 | C6 | C5 | 114.1° | 124.0° |
| C3 | C6 | C11 | 123.9° | 118.0° |
| C2 | C4 | C5 | 110.1° | 108.5° |
| C2 | C4 | H1 | 109.3° | 109.6° |
| C2 | C4 | H2 | 109.3° | 109.8° |
| C4 | C2 | H41 | 109.7° | 109.6° |
| C4 | C2 | H42 | 109.7° | 109.7° |
| C4 | C5 | C6 | 101.5° | 110.1° |
| C5 | C4 | H1 | 109.3° | 109.6° |
| C5 | C4 | H2 | 109.3° | 109.6° |
| C4 | C5 | H3 | 111.4° | 109.4° |
| C4 | C5 | H4 | 111.4° | 109.3° |
| C5 | C6 | C11 | 121.9° | 118.0° |
| C6 | C5 | H3 | 111.4° | 109.4° |
| C6 | C5 | H4 | 111.4° | 109.2° |
| C6 | C11 | H38 | 109.5° | 109.5° |
| C6 | C11 | H39 | 109.5° | 109.5° |
| C6 | C11 | H40 | 109.4° | 109.4° |
| H1 | C4 | H2 | 109.5° | 109.6° |
| H3 | C5 | H4 | 109.5° | 109.4° |
| H6 | C7 | H7 | 109.5° | 109.5° |
| H8 | C8 | H9 | 109.5° | 109.5° |
| H8 | C8 | H10 | 109.4° | 109.5° |
| H9 | C8 | H10 | 109.5° | 109.5° |
| H11 | C10 | H12 | 109.5° | 109.5° |
| H14 | C15 | H15 | 109.5° | 109.5° |
| H16 | C20 | H17 | 109.4° | 109.4° |
| H18 | C21 | H19 | 109.5° | 109.4° |
| H18 | C21 | H20 | 109.5° | 109.5° |
| H19 | C21 | H20 | 109.4° | 109.4° |
| H26 | C18 | H27 | 109.5° | 109.4° |
| H29 | C16 | H30 | 109.5° | 109.5° |
| H31 | C14 | H32 | 109.5° | 109.5° |
| H31 | C14 | H33 | 109.5° | 109.5° |
| H32 | C14 | H33 | 109.5° | 109.5° |
| H35 | C9 | H36 | 109.5° | 109.5° |
| H35 | C9 | H37 | 109.4° | 109.5° |
| H36 | C9 | H37 | 109.5° | 109.5° |
| H38 | C11 | H39 | 109.5° | 109.5° |
| H38 | C11 | H40 | 109.5° | 109.4° |
| H39 | C11 | H40 | 109.5° | 109.5° |
| H41 | C2 | H42 | 109.5° | 109.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C25 | O1 | C24 | 179.7° | 180.0° |
| O3 | C25 | O1 | C23 | 166.2° | 179.7° |
| O3 | C25 | C24 | C22 | 174.4° | 180.0° |
| O3 | C25 | C24 | H22 | 5.6° | 0.1° |
| O1 | C25 | C24 | C22 | 5.3° | 0.0° |
| C25 | O1 | C23 | C22 | 14.8° | 0.4° |
| C25 | O1 | C23 | O2 | 136.7° | 119.1° |
| O1 | C25 | C24 | H22 | 174.7° | 180.0° |
| C25 | O1 | C23 | H24 | 100.2° | 119.1° |
| C24 | C25 | O1 | C23 | 13.5° | 0.2° |
| C25 | C24 | C22 | H22 | 180.0° | 179.9° |
| C25 | C24 | C22 | C23 | 4.8° | 0.3° |
| C25 | C24 | C22 | C20 | 174.8° | 180.0° |
| O1 | C23 | C22 | C24 | 13.0° | 0.4° |
| O1 | C23 | C22 | O2 | 122.5° | 119.0° |
| O1 | C23 | C22 | H24 | 115.7° | 119.3° |
| O1 | C23 | O2 | H24 | 123.1° | 121.7° |
| O1 | C23 | C22 | C20 | 166.6° | 179.9° |
| O1 | C23 | O2 | H25 | 180.0° | 61.4° |
| C24 | C22 | C23 | C20 | 179.6° | 179.7° |
| C24 | C22 | C23 | O2 | 135.5° | 119.4° |
| C24 | C22 | C20 | C18 | 15.4° | 95.1° |
| C24 | C22 | C20 | H16 | 135.5° | 145.0° |
| C24 | C22 | C20 | H17 | 104.8° | 25.0° |
| C24 | C22 | C23 | H24 | 102.7° | 118.9° |
| C22 | C23 | O2 | H24 | 121.3° | 121.9° |
| C23 | C22 | C20 | C18 | 164.2° | 85.3° |
| C23 | C22 | C20 | H16 | 44.1° | 34.7° |
| C23 | C22 | C20 | H17 | 75.6° | 154.7° |
| C23 | C22 | C24 | H22 | 175.2° | 179.8° |
| C22 | C23 | O2 | H25 | 64.4° | 177.8° |
| O2 | C23 | C22 | C20 | 44.2° | 60.9° |
| C22 | C20 | C18 | H16 | 120.1° | 120.0° |
| C22 | C20 | C18 | H17 | 120.2° | 120.0° |
| C22 | C20 | C18 | C19 | 99.5° | 180.0° |
| C22 | C20 | H16 | H17 | 119.6° | 120.0° |
| C20 | C22 | C24 | H22 | 5.3° | 0.1° |
| C20 | C22 | C23 | H24 | 77.7° | 60.8° |
| C22 | C20 | C18 | H26 | 141.1° | 60.0° |
| C22 | C20 | C18 | H27 | 19.9° | 60.0° |
| C20 | C18 | C19 | H26 | 119.4° | 120.0° |
| C20 | C18 | C19 | H27 | 119.4° | 120.0° |
| C20 | C18 | C19 | C17 | 27.9° | 123.9° |
| C18 | C20 | H16 | H17 | 119.6° | 120.0° |
| C20 | C18 | H26 | H27 | 121.8° | 119.9° |
| C20 | C18 | C19 | H28 | 152.1° | 56.2° |
| C18 | C19 | C17 | C21 | 0.7° | 5.7° |
| C18 | C19 | C17 | H28 | 180.0° | 179.9° |
| C18 | C19 | C17 | C16 | 179.3° | 174.4° |
| C19 | C18 | C20 | H16 | 20.6° | 60.0° |
| C19 | C18 | C20 | H17 | 140.3° | 59.9° |
| C19 | C18 | H26 | H27 | 121.8° | 120.1° |
| C21 | C17 | C19 | C16 | 179.9° | 179.9° |
| C21 | C17 | C16 | C15 | 120.6° | 85.0° |
| C17 | C21 | H18 | H19 | 120.0° | 120.0° |
| C17 | C21 | H18 | H20 | 120.0° | 120.0° |
| C17 | C21 | H19 | H20 | 120.0° | 120.0° |
| C21 | C17 | C19 | H28 | 179.3° | 174.4° |
| C21 | C17 | C16 | H29 | 119.2° | 155.0° |
| C21 | C17 | C16 | H30 | 0.5° | 35.0° |
| C19 | C17 | C16 | C15 | 59.3° | 95.0° |
| C19 | C17 | C21 | H18 | 180.0° | 175.3° |
| C19 | C17 | C21 | H19 | 60.0° | 55.3° |
| C19 | C17 | C21 | H20 | 60.0° | 64.7° |
| C17 | C19 | C18 | H26 | 147.2° | 3.9° |
| C17 | C19 | C18 | H27 | 91.5° | 116.1° |
| C19 | C17 | C16 | H29 | 60.9° | 25.1° |
| C19 | C17 | C16 | H30 | 179.4° | 145.0° |
| C17 | C16 | C15 | H29 | 120.1° | 120.0° |
| C17 | C16 | C15 | H30 | 120.1° | 119.9° |
| C17 | C16 | C15 | C13 | 175.2° | 180.0° |
| C17 | C16 | C15 | H14 | 64.6° | 60.0° |
| C17 | C16 | C15 | H15 | 55.0° | 60.1° |
| C16 | C17 | C21 | H18 | 0.1° | 4.6° |
| C16 | C17 | C21 | H19 | 120.1° | 124.6° |
| C16 | C17 | C21 | H20 | 119.9° | 115.4° |
| C16 | C17 | C19 | H28 | 0.7° | 5.5° |
| C17 | C16 | H29 | H30 | 119.5° | 119.9° |
| C16 | C15 | C13 | H14 | 120.2° | 120.0° |
| C16 | C15 | C13 | H15 | 120.2° | 120.0° |
| C16 | C15 | C13 | C12 | 95.9° | 120.3° |
| C16 | C15 | C13 | H13 | 84.1° | 59.6° |
| C16 | C15 | H14 | H15 | 119.4° | 120.0° |
| C15 | C16 | H29 | H30 | 119.5° | 120.1° |
| C15 | C13 | C12 | H13 | 180.0° | 180.0° |
| C15 | C13 | C12 | C14 | 0.2° | 5.7° |
| C15 | C13 | C12 | C10 | 179.6° | 174.3° |
| C13 | C15 | H14 | H15 | 119.4° | 120.0° |
| C13 | C15 | C16 | H29 | 55.0° | 60.0° |
| C13 | C15 | C16 | H30 | 64.7° | 60.0° |
| C13 | C12 | C14 | C10 | 179.8° | 180.0° |
| C13 | C12 | C10 | C7 | 151.8° | 95.0° |
| C13 | C12 | C10 | H11 | 31.5° | 25.0° |
| C13 | C12 | C10 | H12 | 88.0° | 145.0° |
| C12 | C13 | C15 | H14 | 24.3° | 119.7° |
| C12 | C13 | C15 | H15 | 143.9° | 0.3° |
| C13 | C12 | C14 | H31 | 180.0° | 84.5° |
| C13 | C12 | C14 | H32 | 60.0° | 155.4° |
| C13 | C12 | C14 | H33 | 60.0° | 35.4° |
| C14 | C12 | C10 | C7 | 28.4° | 85.0° |
| C14 | C12 | C10 | H11 | 148.7° | 155.0° |
| C14 | C12 | C10 | H12 | 91.8° | 35.0° |
| C14 | C12 | C13 | H13 | 179.8° | 174.2° |
| C12 | C14 | H31 | H32 | 120.0° | 120.1° |
| C12 | C14 | H31 | H33 | 120.0° | 119.9° |
| C12 | C14 | H32 | H33 | 120.0° | 120.0° |
| C12 | C10 | C7 | H11 | 120.3° | 120.0° |
| C12 | C10 | C7 | H12 | 120.2° | 120.0° |
| C12 | C10 | C7 | C3 | 172.5° | 180.0° |
| C12 | C10 | C7 | H6 | 52.1° | 60.0° |
| C12 | C10 | C7 | H7 | 67.0° | 60.0° |
| C12 | C10 | H11 | H12 | 119.2° | 120.0° |
| C10 | C12 | C13 | H13 | 0.4° | 5.7° |
| C10 | C12 | C14 | H31 | 0.2° | 95.5° |
| C10 | C12 | C14 | H32 | 119.8° | 24.6° |
| C10 | C12 | C14 | H33 | 120.2° | 144.6° |
| C10 | C7 | C3 | H6 | 120.5° | 120.0° |
| C10 | C7 | C3 | H7 | 120.5° | 120.1° |
| C10 | C7 | C3 | C1 | 54.9° | 85.0° |
| C10 | C7 | C3 | C6 | 131.0° | 95.0° |
| C10 | C7 | H6 | H7 | 118.6° | 120.0° |
| C7 | C10 | H11 | H12 | 119.2° | 120.0° |
| C8 | C1 | C3 | C7 | 19.5° | 42.7° |
| C8 | C1 | C9 | C3 | 119.7° | 119.7° |
| C8 | C1 | C9 | C2 | 126.9° | 119.7° |
| C8 | C1 | C3 | C2 | 118.2° | 120.2° |
| C8 | C1 | C3 | C6 | 154.8° | 137.3° |
| C8 | C1 | C2 | C4 | 81.6° | 169.6° |
| C1 | C8 | H8 | H9 | 120.0° | 120.0° |
| C1 | C8 | H8 | H10 | 120.0° | 120.0° |
| C1 | C8 | H9 | H10 | 120.0° | 120.0° |
| C8 | C1 | C9 | H35 | 180.0° | 60.0° |
| C8 | C1 | C9 | H36 | 60.0° | 180.0° |
| C8 | C1 | C9 | H37 | 60.0° | 60.0° |
| C8 | C1 | C2 | H41 | 158.5° | 50.0° |
| C8 | C1 | C2 | H42 | 38.3° | 70.7° |
| C7 | C3 | C1 | C9 | 102.9° | 77.1° |
| C7 | C3 | C1 | C6 | 174.4° | 180.0° |
| C7 | C3 | C1 | C2 | 137.7° | 162.9° |
| C7 | C3 | C6 | C5 | 98.4° | 179.6° |
| C7 | C3 | C6 | C11 | 82.6° | 0.5° |
| C3 | C7 | H6 | H7 | 118.5° | 120.0° |
| C3 | C7 | C10 | H11 | 67.2° | 60.0° |
| C3 | C7 | C10 | H12 | 52.3° | 60.1° |
| C9 | C1 | C3 | C2 | 119.4° | 120.0° |
| C9 | C1 | C3 | C6 | 82.7° | 102.9° |
| C9 | C1 | C2 | C4 | 152.0° | 70.7° |
| C9 | C1 | C8 | H8 | 180.0° | 60.0° |
| C9 | C1 | C8 | H9 | 60.0° | 180.0° |
| C9 | C1 | C8 | H10 | 60.0° | 60.0° |
| C1 | C9 | H35 | H36 | 120.0° | 120.0° |
| C1 | C9 | H35 | H37 | 120.0° | 120.0° |
| C1 | C9 | H36 | H37 | 120.0° | 120.0° |
| C9 | C1 | C2 | H41 | 32.1° | 169.7° |
| C9 | C1 | C2 | H42 | 88.1° | 49.0° |
| C3 | C1 | C2 | C4 | 32.4° | 49.4° |
| C1 | C3 | C6 | C5 | 75.9° | 0.4° |
| C1 | C3 | C6 | C11 | 103.1° | 179.5° |
| C1 | C3 | C7 | H6 | 65.5° | 155.0° |
| C1 | C3 | C7 | H7 | 175.4° | 35.0° |
| C3 | C1 | C8 | H8 | 57.3° | 59.8° |
| C3 | C1 | C8 | H9 | 177.4° | 60.3° |
| C3 | C1 | C8 | H10 | 62.7° | 179.8° |
| C3 | C1 | C9 | H35 | 60.4° | 179.7° |
| C3 | C1 | C9 | H36 | 59.7° | 60.3° |
| C3 | C1 | C9 | H37 | 179.7° | 59.8° |
| C3 | C1 | C2 | H41 | 87.4° | 70.2° |
| C3 | C1 | C2 | H42 | 152.3° | 169.1° |
| C2 | C1 | C3 | C6 | 36.6° | 17.1° |
| C1 | C2 | C4 | H41 | 119.9° | 119.6° |
| C1 | C2 | C4 | H42 | 119.9° | 119.7° |
| C1 | C2 | C4 | C5 | 75.7° | 67.4° |
| C1 | C2 | C4 | H1 | 164.2° | 172.9° |
| C1 | C2 | C4 | H2 | 44.3° | 52.4° |
| C2 | C1 | C8 | H8 | 53.6° | 179.6° |
| C2 | C1 | C8 | H9 | 66.4° | 60.4° |
| C2 | C1 | C8 | H10 | 173.6° | 59.6° |
| C2 | C1 | C9 | H35 | 53.1° | 59.7° |
| C2 | C1 | C9 | H36 | 173.1° | 60.3° |
| C2 | C1 | C9 | H37 | 66.9° | 179.6° |
| C1 | C2 | H41 | H42 | 120.4° | 120.6° |
| C3 | C6 | C5 | C4 | 27.8° | 17.1° |
| C3 | C6 | C5 | C11 | 179.0° | 179.9° |
| C3 | C6 | C5 | H3 | 146.5° | 137.3° |
| C3 | C6 | C5 | H4 | 90.9° | 103.0° |
| C6 | C3 | C7 | H6 | 108.5° | 25.0° |
| C6 | C3 | C7 | H7 | 10.5° | 145.0° |
| C3 | C6 | C11 | H38 | 180.0° | 180.0° |
| C3 | C6 | C11 | H39 | 60.0° | 60.0° |
| C3 | C6 | C11 | H40 | 60.0° | 60.0° |
| C2 | C4 | C5 | H1 | 120.1° | 119.7° |
| C2 | C4 | C5 | H2 | 120.1° | 120.0° |
| C2 | C4 | C5 | C6 | 40.0° | 49.4° |
| C2 | C4 | H1 | H2 | 119.7° | 120.6° |
| C2 | C4 | C5 | H3 | 78.7° | 169.7° |
| C2 | C4 | C5 | H4 | 158.7° | 70.6° |
| C4 | C2 | H41 | H42 | 120.4° | 120.6° |
| C4 | C5 | C6 | H3 | 118.7° | 120.3° |
| C4 | C5 | C6 | H4 | 118.7° | 120.1° |
| C4 | C5 | C6 | C11 | 151.3° | 162.9° |
| C5 | C4 | H1 | H2 | 119.7° | 120.4° |
| C4 | C5 | H3 | H4 | 123.7° | 119.7° |
| C5 | C4 | C2 | H41 | 44.1° | 52.2° |
| C5 | C4 | C2 | H42 | 164.4° | 172.9° |
| C6 | C5 | C4 | H1 | 160.1° | 169.1° |
| C6 | C5 | C4 | H2 | 80.1° | 70.5° |
| C6 | C5 | H3 | H4 | 123.7° | 119.6° |
| C5 | C6 | C11 | H38 | 1.1° | 0.0° |
| C5 | C6 | C11 | H39 | 121.1° | 120.0° |
| C5 | C6 | C11 | H40 | 118.9° | 119.9° |
| C11 | C6 | C5 | H3 | 32.6° | 42.6° |
| C11 | C6 | C5 | H4 | 90.1° | 77.1° |
| C6 | C11 | H38 | H39 | 120.0° | 120.0° |
| C6 | C11 | H38 | H40 | 120.0° | 119.9° |
| C6 | C11 | H39 | H40 | 120.0° | 120.0° |
| H1 | C4 | C5 | H3 | 41.4° | 70.6° |
| H1 | C4 | C5 | H4 | 81.2° | 49.1° |
| H1 | C4 | C2 | H41 | 76.0° | 67.5° |
| H1 | C4 | C2 | H42 | 44.3° | 53.2° |
| H2 | C4 | C5 | H3 | 161.2° | 49.7° |
| H2 | C4 | C5 | H4 | 38.6° | 169.5° |
| H2 | C4 | C2 | H41 | 164.2° | 172.0° |
| H2 | C4 | C2 | H42 | 75.5° | 67.3° |
| H6 | C7 | C10 | H11 | 172.3° | 60.0° |
| H6 | C7 | C10 | H12 | 68.1° | 180.0° |
| H7 | C7 | C10 | H11 | 53.2° | 180.0° |
| H7 | C7 | C10 | H12 | 172.8° | 60.0° |
| H8 | C8 | H9 | H10 | 120.0° | 120.0° |
| H13 | C13 | C15 | H14 | 155.7° | 60.4° |
| H13 | C13 | C15 | H15 | 36.1° | 179.6° |
| H14 | C15 | C16 | H29 | 175.3° | 180.0° |
| H14 | C15 | C16 | H30 | 55.6° | 60.0° |
| H15 | C15 | C16 | H29 | 65.1° | 59.9° |
| H15 | C15 | C16 | H30 | 175.2° | 180.0° |
| H16 | C20 | C18 | H26 | 98.8° | 180.0° |
| H16 | C20 | C18 | H27 | 140.0° | 60.1° |
| H17 | C20 | C18 | H26 | 20.9° | 60.1° |
| H17 | C20 | C18 | H27 | 100.3° | 180.0° |
| H18 | C21 | H19 | H20 | 120.0° | 120.0° |
| H24 | C23 | O2 | H25 | 56.9° | 60.3° |
| H26 | C18 | C19 | H28 | 32.8° | 176.2° |
| H27 | C18 | C19 | H28 | 88.5° | 63.8° |
| H31 | C14 | H32 | H33 | 120.0° | 120.0° |
| H35 | C9 | H36 | H37 | 120.0° | 120.0° |
| H38 | C11 | H39 | H40 | 120.0° | 120.0° |
