11D
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | doub | 1.40Å | 1.39Å | Aromatic |
| C1 | C6 | sing | 1.36Å | 1.40Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | C2 | sing | 1.41Å | 1.50Å | Aromatic |
| C3 | C2 | sing | 1.42Å | 1.48Å | Aromatic |
| C10 | C3 | sing | 1.41Å | 1.39Å | Aromatic |
| C3 | C4 | doub | 1.41Å | 1.49Å | Aromatic |
| S14 | C4 | sing | 1.76Å | 1.60Å | |
| C4 | C5 | sing | 1.36Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | N11 | sing | 1.39Å | 1.41Å | |
| C9 | C8 | sing | 1.39Å | 1.39Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | C10 | doub | 1.36Å | 1.39Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | N11 | sing | 1.47Å | 1.46Å | |
| N11 | C12 | sing | 1.47Å | 1.46Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C12 | H12B | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| N17 | S14 | sing | 1.66Å | 1.61Å | |
| S14 | O16 | doub | 1.42Å | 1.44Å | |
| S14 | O15 | doub | 1.42Å | 1.44Å | |
| C18 | N17 | sing | 1.46Å | 1.45Å | |
| N17 | HN17 | sing | 0.97Å | 1.00Å | |
| C18 | C19 | sing | 1.53Å | 1.52Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C22 | C21 | sing | 1.53Å | 1.53Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C24 | C23 | sing | 1.53Å | 1.52Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C25 | C24 | sing | 1.53Å | 1.52Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C27 | C26 | sing | 1.53Å | 1.52Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C28 | C27 | sing | 1.51Å | 1.52Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| O29 | C28 | doub | 1.21Å | 1.25Å | |
| C28 | O30 | sing | 1.34Å | 1.25Å | |
| O30 | HO30 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 121.5° | 119.7° |
| C2 | C1 | H1 | 119.3° | 120.1° |
| C1 | C2 | C7 | 124.0° | 121.3° |
| C1 | C2 | C3 | 118.0° | 119.4° |
| C6 | C1 | H1 | 119.3° | 120.2° |
| C1 | C6 | C5 | 122.5° | 121.0° |
| C1 | C6 | H6 | 118.8° | 119.5° |
| C7 | C2 | C3 | 118.1° | 119.3° |
| C2 | C7 | C8 | 117.8° | 119.4° |
| C2 | C7 | N11 | 124.6° | 120.3° |
| C2 | C3 | C10 | 119.5° | 119.5° |
| C2 | C3 | C4 | 118.6° | 119.3° |
| C10 | C3 | C4 | 121.9° | 121.2° |
| C3 | C10 | C9 | 120.5° | 120.0° |
| C3 | C10 | H10 | 119.7° | 120.0° |
| C3 | C4 | S14 | 121.1° | 120.2° |
| C3 | C4 | C5 | 118.9° | 119.7° |
| S14 | C4 | C5 | 120.0° | 120.1° |
| C4 | S14 | N17 | 108.2° | 107.2° |
| C4 | S14 | O16 | 109.8° | 106.4° |
| C4 | S14 | O15 | 109.0° | 106.4° |
| C4 | C5 | C6 | 120.6° | 121.0° |
| C4 | C5 | H5 | 119.7° | 119.5° |
| C6 | C5 | H5 | 119.7° | 119.5° |
| C5 | C6 | H6 | 118.8° | 119.6° |
| C8 | C7 | N11 | 117.5° | 120.3° |
| C7 | C8 | C9 | 121.7° | 120.7° |
| C7 | C8 | H8 | 119.1° | 119.7° |
| C7 | N11 | C13 | 118.6° | 111.0° |
| C7 | N11 | C12 | 122.8° | 111.0° |
| C9 | C8 | H8 | 119.1° | 119.6° |
| C8 | C9 | C10 | 122.4° | 121.1° |
| C8 | C9 | H9 | 118.8° | 119.5° |
| C10 | C9 | H9 | 118.8° | 119.5° |
| C9 | C10 | H10 | 119.8° | 120.0° |
| C13 | N11 | C12 | 118.7° | 111.0° |
| N11 | C13 | H13 | 109.5° | 109.4° |
| N11 | C13 | H13A | 109.5° | 109.4° |
| N11 | C13 | H13B | 109.5° | 109.5° |
| N11 | C12 | H12 | 109.5° | 109.5° |
| N11 | C12 | H12A | 109.5° | 109.4° |
| N11 | C12 | H12B | 109.4° | 109.5° |
| H12 | C12 | H12A | 109.4° | 109.5° |
| H12 | C12 | H12B | 109.5° | 109.5° |
| H12A | C12 | H12B | 109.5° | 109.4° |
| H13 | C13 | H13A | 109.5° | 109.5° |
| H13 | C13 | H13B | 109.4° | 109.5° |
| H13A | C13 | H13B | 109.5° | 109.5° |
| N17 | S14 | O16 | 110.7° | 106.4° |
| N17 | S14 | O15 | 110.4° | 106.4° |
| S14 | N17 | C18 | 122.2° | 120.0° |
| S14 | N17 | HN17 | 105.5° | 120.0° |
| O16 | S14 | O15 | 108.6° | 123.1° |
| C18 | N17 | HN17 | 105.4° | 120.0° |
| N17 | C18 | C19 | 113.9° | 109.5° |
| N17 | C18 | H18 | 108.0° | 109.5° |
| N17 | C18 | H18A | 108.0° | 109.5° |
| C19 | C18 | H18 | 108.0° | 109.5° |
| C19 | C18 | H18A | 108.0° | 109.5° |
| C18 | C19 | C20 | 109.3° | 109.5° |
| C18 | C19 | H19 | 109.6° | 109.5° |
| C18 | C19 | H19A | 109.5° | 109.5° |
| H18 | C18 | H18A | 110.9° | 109.5° |
| C20 | C19 | H19 | 109.5° | 109.4° |
| C20 | C19 | H19A | 109.6° | 109.5° |
| C19 | C20 | C21 | 111.6° | 109.5° |
| C19 | C20 | H20 | 108.7° | 109.4° |
| C19 | C20 | H20A | 108.7° | 109.5° |
| H19 | C19 | H19A | 109.4° | 109.5° |
| C21 | C20 | H20 | 108.8° | 109.5° |
| C21 | C20 | H20A | 108.8° | 109.4° |
| C20 | C21 | C22 | 111.1° | 109.5° |
| C20 | C21 | H21 | 108.9° | 109.4° |
| C20 | C21 | H21A | 108.9° | 109.4° |
| H20 | C20 | H20A | 110.2° | 109.5° |
| C22 | C21 | H21 | 108.9° | 109.5° |
| C22 | C21 | H21A | 109.0° | 109.5° |
| C21 | C22 | C23 | 110.7° | 109.5° |
| C21 | C22 | H22 | 109.1° | 109.5° |
| C21 | C22 | H22A | 109.1° | 109.5° |
| H21 | C21 | H21A | 110.0° | 109.4° |
| C23 | C22 | H22 | 109.1° | 109.5° |
| C23 | C22 | H22A | 109.1° | 109.5° |
| C22 | C23 | C24 | 111.2° | 109.5° |
| C22 | C23 | H23 | 108.9° | 109.5° |
| C22 | C23 | H23A | 108.9° | 109.5° |
| H22 | C22 | H22A | 109.8° | 109.4° |
| C24 | C23 | H23 | 108.9° | 109.4° |
| C24 | C23 | H23A | 108.9° | 109.5° |
| C23 | C24 | C25 | 110.0° | 109.5° |
| C23 | C24 | H24 | 109.3° | 109.5° |
| C23 | C24 | H24A | 109.3° | 109.5° |
| H23 | C23 | H23A | 110.0° | 109.5° |
| C25 | C24 | H24 | 109.3° | 109.5° |
| C25 | C24 | H24A | 109.3° | 109.5° |
| C24 | C25 | C26 | 111.3° | 109.5° |
| C24 | C25 | H25 | 108.9° | 109.4° |
| C24 | C25 | H25A | 108.9° | 109.5° |
| H24 | C24 | H24A | 109.7° | 109.4° |
| C26 | C25 | H25 | 108.9° | 109.4° |
| C26 | C25 | H25A | 108.9° | 109.5° |
| C25 | C26 | C27 | 110.4° | 109.5° |
| C25 | C26 | H26 | 109.2° | 109.4° |
| C25 | C26 | H26A | 109.2° | 109.5° |
| H25 | C25 | H25A | 110.1° | 109.5° |
| C27 | C26 | H26 | 109.2° | 109.5° |
| C27 | C26 | H26A | 109.2° | 109.4° |
| C26 | C27 | C28 | 108.9° | 109.5° |
| C26 | C27 | H27 | 109.7° | 109.4° |
| C26 | C27 | H27A | 109.7° | 109.4° |
| H26 | C26 | H26A | 109.8° | 109.5° |
| C28 | C27 | H27 | 109.6° | 109.5° |
| C28 | C27 | H27A | 109.7° | 109.5° |
| C27 | C28 | O29 | 119.2° | 120.0° |
| C27 | C28 | O30 | 118.2° | 120.0° |
| H27 | C27 | H27A | 109.3° | 109.5° |
| O29 | C28 | O30 | 122.6° | 120.0° |
| C28 | O30 | HO30 | 109.5° | 116.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 179.8° |
| C1 | C2 | C7 | C3 | 179.9° | 180.0° |
| C1 | C2 | C3 | C10 | 179.7° | 180.0° |
| C1 | C2 | C3 | C4 | 0.5° | 0.0° |
| C2 | C1 | C6 | C5 | 0.0° | 0.1° |
| C2 | C1 | C6 | H6 | 179.9° | 179.7° |
| C1 | C2 | C7 | C8 | 179.7° | 180.0° |
| C1 | C2 | C7 | N11 | 0.2° | 0.0° |
| C6 | C1 | C2 | C7 | 179.9° | 179.9° |
| C6 | C1 | C2 | C3 | 0.1° | 0.0° |
| C1 | C6 | C5 | C4 | 0.5° | 0.1° |
| C1 | C6 | C5 | H6 | 180.0° | 179.6° |
| C1 | C6 | C5 | H5 | 179.5° | 179.9° |
| H1 | C1 | C2 | C7 | 0.1° | 0.3° |
| H1 | C1 | C2 | C3 | 180.0° | 179.8° |
| H1 | C1 | C6 | C5 | 180.0° | 179.7° |
| H1 | C1 | C6 | H6 | 0.0° | 0.1° |
| C7 | C2 | C3 | C10 | 0.4° | 0.0° |
| C7 | C2 | C3 | C4 | 179.6° | 180.0° |
| C2 | C7 | C8 | N11 | 179.9° | 179.9° |
| C2 | C7 | C8 | C9 | 0.2° | 0.0° |
| C2 | C7 | C8 | H8 | 179.8° | 180.0° |
| C2 | C7 | N11 | C13 | 166.5° | 116.1° |
| C2 | C7 | N11 | C12 | 14.5° | 120.0° |
| C2 | C3 | C10 | C4 | 179.1° | 179.9° |
| C2 | C3 | C4 | S14 | 179.6° | 180.0° |
| C2 | C3 | C4 | C5 | 1.0° | 0.0° |
| C3 | C2 | C7 | C8 | 0.4° | 0.0° |
| C3 | C2 | C7 | N11 | 179.7° | 180.0° |
| C2 | C3 | C10 | C9 | 0.2° | 0.1° |
| C2 | C3 | C10 | H10 | 179.8° | 180.0° |
| C10 | C3 | C4 | S14 | 1.3° | 0.0° |
| C10 | C3 | C4 | C5 | 179.8° | 180.0° |
| C3 | C10 | C9 | C8 | 0.1° | 0.1° |
| C3 | C10 | C9 | H10 | 180.0° | 179.9° |
| C3 | C10 | C9 | H9 | 179.8° | 180.0° |
| C3 | C4 | S14 | C5 | 178.5° | 180.0° |
| C3 | C4 | C5 | C6 | 1.0° | 0.1° |
| C3 | C4 | C5 | H5 | 179.0° | 180.0° |
| C4 | C3 | C10 | C9 | 179.3° | 180.0° |
| C4 | C3 | C10 | H10 | 0.7° | 0.1° |
| C3 | C4 | S14 | N17 | 45.0° | 64.0° |
| C3 | C4 | S14 | O16 | 165.9° | 49.5° |
| C3 | C4 | S14 | O15 | 75.2° | 177.5° |
| S14 | C4 | C5 | C6 | 179.6° | 179.9° |
| S14 | C4 | C5 | H5 | 0.5° | 0.0° |
| C4 | S14 | N17 | O16 | 120.4° | 113.6° |
| C4 | S14 | N17 | O15 | 119.2° | 113.6° |
| C4 | S14 | O16 | O15 | 119.1° | 123.0° |
| C4 | S14 | N17 | C18 | 105.5° | 63.9° |
| C4 | S14 | N17 | HN17 | 134.5° | 116.1° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | H6 | 179.4° | 179.7° |
| C5 | C4 | S14 | N17 | 136.5° | 116.0° |
| C5 | C4 | S14 | O16 | 15.6° | 130.5° |
| C5 | C4 | S14 | O15 | 103.3° | 2.5° |
| H5 | C5 | C6 | H6 | 0.5° | 0.3° |
| C7 | C8 | C9 | H8 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 0.1° | 0.1° |
| C7 | C8 | C9 | H9 | 179.9° | 180.0° |
| C8 | C7 | N11 | C13 | 13.4° | 63.9° |
| C8 | C7 | N11 | C12 | 165.6° | 60.0° |
| N11 | C7 | C8 | C9 | 179.9° | 180.0° |
| N11 | C7 | C8 | H8 | 0.1° | 0.0° |
| C7 | N11 | C13 | C12 | 179.1° | 123.9° |
| C7 | N11 | C12 | H12 | 180.0° | 60.0° |
| C7 | N11 | C12 | H12A | 60.0° | 180.0° |
| C7 | N11 | C12 | H12B | 60.0° | 60.0° |
| C7 | N11 | C13 | H13 | 180.0° | 60.0° |
| C7 | N11 | C13 | H13A | 60.0° | 180.0° |
| C7 | N11 | C13 | H13B | 60.0° | 60.0° |
| C8 | C9 | C10 | H9 | 180.0° | 179.9° |
| C8 | C9 | C10 | H10 | 179.9° | 180.0° |
| H8 | C8 | C9 | C10 | 179.9° | 179.9° |
| H8 | C8 | C9 | H9 | 0.1° | 0.0° |
| H9 | C9 | C10 | H10 | 0.2° | 0.1° |
| C13 | N11 | C12 | H12 | 1.0° | 63.9° |
| C13 | N11 | C12 | H12A | 119.0° | 56.1° |
| C13 | N11 | C12 | H12B | 121.0° | 176.1° |
| N11 | C13 | H13 | H13A | 120.0° | 119.9° |
| N11 | C13 | H13 | H13B | 120.0° | 120.0° |
| N11 | C13 | H13A | H13B | 120.0° | 120.0° |
| N11 | C12 | H12 | H12A | 120.0° | 120.0° |
| N11 | C12 | H12 | H12B | 120.0° | 120.0° |
| N11 | C12 | H12A | H12B | 120.0° | 120.0° |
| C12 | N11 | C13 | H13 | 0.9° | 176.1° |
| C12 | N11 | C13 | H13A | 120.9° | 56.1° |
| C12 | N11 | C13 | H13B | 119.1° | 63.9° |
| H12 | C12 | H12A | H12B | 120.0° | 120.0° |
| H13 | C13 | H13A | H13B | 120.0° | 120.0° |
| N17 | S14 | O16 | O15 | 121.4° | 122.9° |
| S14 | N17 | C18 | HN17 | 120.0° | 180.0° |
| S14 | N17 | C18 | C19 | 75.4° | 163.8° |
| S14 | N17 | C18 | H18 | 164.6° | 76.2° |
| S14 | N17 | C18 | H18A | 44.6° | 43.8° |
| O16 | S14 | N17 | C18 | 14.9° | 177.5° |
| O16 | S14 | N17 | HN17 | 105.1° | 2.5° |
| O15 | S14 | N17 | C18 | 135.2° | 49.6° |
| O15 | S14 | N17 | HN17 | 15.2° | 130.4° |
| N17 | C18 | C19 | H18 | 120.0° | 120.0° |
| N17 | C18 | C19 | H18A | 120.0° | 120.0° |
| N17 | C18 | H18 | H18A | 118.2° | 120.0° |
| N17 | C18 | C19 | C20 | 174.0° | 180.0° |
| N17 | C18 | C19 | H19 | 66.0° | 60.0° |
| N17 | C18 | C19 | H19A | 54.0° | 60.0° |
| HN17 | N17 | C18 | C19 | 44.6° | 16.2° |
| HN17 | N17 | C18 | H18 | 75.4° | 103.8° |
| HN17 | N17 | C18 | H18A | 164.6° | 136.2° |
| C19 | C18 | H18 | H18A | 118.2° | 120.0° |
| C18 | C19 | C20 | H19 | 120.0° | 120.0° |
| C18 | C19 | C20 | H19A | 120.0° | 120.0° |
| C18 | C19 | H19 | H19A | 120.1° | 120.0° |
| C18 | C19 | C20 | C21 | 151.5° | 180.0° |
| C18 | C19 | C20 | H20 | 88.5° | 60.0° |
| C18 | C19 | C20 | H20A | 31.5° | 60.0° |
| H18 | C18 | C19 | C20 | 54.0° | 60.0° |
| H18 | C18 | C19 | H19 | 174.0° | 180.0° |
| H18 | C18 | C19 | H19A | 66.0° | 60.0° |
| H18A | C18 | C19 | C20 | 66.0° | 60.0° |
| H18A | C18 | C19 | H19 | 54.0° | 60.0° |
| H18A | C18 | C19 | H19A | 174.0° | 180.0° |
| C20 | C19 | H19 | H19A | 120.1° | 120.0° |
| C19 | C20 | C21 | H20 | 120.0° | 120.0° |
| C19 | C20 | C21 | H20A | 120.0° | 120.0° |
| C19 | C20 | H20 | H20A | 119.1° | 120.0° |
| C19 | C20 | C21 | C22 | 177.0° | 180.0° |
| C19 | C20 | C21 | H21 | 63.0° | 59.9° |
| C19 | C20 | C21 | H21A | 57.0° | 60.0° |
| H19 | C19 | C20 | C21 | 31.5° | 60.0° |
| H19 | C19 | C20 | H20 | 151.5° | 180.0° |
| H19 | C19 | C20 | H20A | 88.5° | 60.0° |
| H19A | C19 | C20 | C21 | 88.5° | 60.0° |
| H19A | C19 | C20 | H20 | 31.5° | 60.0° |
| H19A | C19 | C20 | H20A | 151.5° | 180.0° |
| C21 | C20 | H20 | H20A | 119.2° | 120.0° |
| C20 | C21 | C22 | H21 | 120.0° | 120.0° |
| C20 | C21 | C22 | H21A | 120.0° | 120.0° |
| C20 | C21 | H21 | H21A | 119.3° | 119.9° |
| C20 | C21 | C22 | C23 | 30.7° | 180.0° |
| C20 | C21 | C22 | H22 | 150.7° | 60.0° |
| C20 | C21 | C22 | H22A | 89.3° | 60.0° |
| H20 | C20 | C21 | C22 | 57.0° | 60.0° |
| H20 | C20 | C21 | H21 | 177.0° | 179.9° |
| H20 | C20 | C21 | H21A | 63.0° | 60.0° |
| H20A | C20 | C21 | C22 | 63.0° | 60.0° |
| H20A | C20 | C21 | H21 | 57.0° | 60.1° |
| H20A | C20 | C21 | H21A | 177.0° | 180.0° |
| C22 | C21 | H21 | H21A | 119.4° | 120.0° |
| C21 | C22 | C23 | H22 | 120.0° | 120.0° |
| C21 | C22 | C23 | H22A | 120.0° | 120.0° |
| C21 | C22 | H22 | H22A | 119.5° | 119.9° |
| C21 | C22 | C23 | C24 | 171.7° | 180.0° |
| C21 | C22 | C23 | H23 | 68.3° | 60.0° |
| C21 | C22 | C23 | H23A | 51.7° | 60.0° |
| H21 | C21 | C22 | C23 | 89.3° | 60.0° |
| H21 | C21 | C22 | H22 | 30.8° | 180.0° |
| H21 | C21 | C22 | H22A | 150.7° | 60.1° |
| H21A | C21 | C22 | C23 | 150.7° | 60.0° |
| H21A | C21 | C22 | H22 | 89.3° | 60.0° |
| H21A | C21 | C22 | H22A | 30.7° | 179.9° |
| C23 | C22 | H22 | H22A | 119.5° | 120.0° |
| C22 | C23 | C24 | H23 | 120.0° | 120.0° |
| C22 | C23 | C24 | H23A | 120.0° | 120.0° |
| C22 | C23 | H23 | H23A | 119.3° | 120.0° |
| C22 | C23 | C24 | C25 | 149.1° | 180.0° |
| C22 | C23 | C24 | H24 | 90.9° | 60.0° |
| C22 | C23 | C24 | H24A | 29.1° | 59.9° |
| H22 | C22 | C23 | C24 | 51.7° | 60.0° |
| H22 | C22 | C23 | H23 | 171.7° | 180.0° |
| H22 | C22 | C23 | H23A | 68.3° | 60.0° |
| H22A | C22 | C23 | C24 | 68.3° | 60.0° |
| H22A | C22 | C23 | H23 | 51.7° | 60.0° |
| H22A | C22 | C23 | H23A | 171.7° | 180.0° |
| C24 | C23 | H23 | H23A | 119.3° | 120.0° |
| C23 | C24 | C25 | H24 | 120.0° | 120.0° |
| C23 | C24 | C25 | H24A | 120.0° | 120.1° |
| C23 | C24 | H24 | H24A | 119.8° | 120.0° |
| C23 | C24 | C25 | C26 | 180.0° | 180.0° |
| C23 | C24 | C25 | H25 | 60.0° | 60.0° |
| C23 | C24 | C25 | H25A | 60.0° | 60.0° |
| H23 | C23 | C24 | C25 | 29.1° | 60.0° |
| H23 | C23 | C24 | H24 | 149.1° | 180.0° |
| H23 | C23 | C24 | H24A | 90.9° | 60.1° |
| H23A | C23 | C24 | C25 | 90.9° | 60.0° |
| H23A | C23 | C24 | H24 | 29.1° | 60.0° |
| H23A | C23 | C24 | H24A | 149.1° | 179.9° |
| C25 | C24 | H24 | H24A | 119.8° | 120.0° |
| C24 | C25 | C26 | H25 | 120.0° | 119.9° |
| C24 | C25 | C26 | H25A | 120.0° | 120.1° |
| C24 | C25 | H25 | H25A | 119.3° | 120.1° |
| C24 | C25 | C26 | C27 | 154.2° | 180.0° |
| C24 | C25 | C26 | H26 | 85.8° | 60.1° |
| C24 | C25 | C26 | H26A | 34.1° | 60.0° |
| H24 | C24 | C25 | C26 | 60.0° | 60.0° |
| H24 | C24 | C25 | H25 | 180.0° | 180.0° |
| H24 | C24 | C25 | H25A | 60.0° | 60.0° |
| H24A | C24 | C25 | C26 | 60.0° | 59.9° |
| H24A | C24 | C25 | H25 | 60.0° | 60.0° |
| H24A | C24 | C25 | H25A | 180.0° | 180.0° |
| C26 | C25 | H25 | H25A | 119.3° | 120.0° |
| C25 | C26 | C27 | H26 | 120.0° | 120.0° |
| C25 | C26 | C27 | H26A | 120.0° | 120.0° |
| C25 | C26 | H26 | H26A | 119.6° | 120.0° |
| C25 | C26 | C27 | C28 | 73.5° | 180.0° |
| C25 | C26 | C27 | H27 | 46.5° | 60.0° |
| C25 | C26 | C27 | H27A | 166.5° | 60.0° |
| H25 | C25 | C26 | C27 | 34.2° | 60.0° |
| H25 | C25 | C26 | H26 | 154.2° | 180.0° |
| H25 | C25 | C26 | H26A | 85.8° | 60.0° |
| H25A | C25 | C26 | C27 | 85.8° | 60.0° |
| H25A | C25 | C26 | H26 | 34.1° | 60.0° |
| H25A | C25 | C26 | H26A | 154.1° | 180.0° |
| C27 | C26 | H26 | H26A | 119.6° | 120.0° |
| C26 | C27 | C28 | H27 | 120.0° | 120.0° |
| C26 | C27 | C28 | H27A | 120.0° | 120.0° |
| C26 | C27 | H27 | H27A | 120.2° | 119.9° |
| C26 | C27 | C28 | O29 | 175.9° | 0.1° |
| C26 | C27 | C28 | O30 | 5.7° | 180.0° |
| H26 | C26 | C27 | C28 | 166.5° | 60.0° |
| H26 | C26 | C27 | H27 | 73.5° | 180.0° |
| H26 | C26 | C27 | H27A | 46.5° | 60.0° |
| H26A | C26 | C27 | C28 | 46.5° | 60.0° |
| H26A | C26 | C27 | H27 | 166.5° | 60.0° |
| H26A | C26 | C27 | H27A | 73.5° | 180.0° |
| C28 | C27 | H27 | H27A | 120.2° | 120.1° |
| C27 | C28 | O29 | O30 | 178.4° | 179.9° |
| C27 | C28 | O30 | HO30 | 178.4° | 180.0° |
| H27 | C27 | C28 | O29 | 64.1° | 119.9° |
| H27 | C27 | C28 | O30 | 114.3° | 60.0° |
| H27A | C27 | C28 | O29 | 55.9° | 120.0° |
| H27A | C27 | C28 | O30 | 125.7° | 60.0° |
| O29 | C28 | O30 | HO30 | 0.0° | 0.0° |
