0EU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.41Å | 1.41Å | Aromatic |
| C1 | C6 | sing | 1.39Å | 1.40Å | Aromatic |
| C1 | C14 | sing | 1.46Å | 1.41Å | Aromatic |
| C2 | C3 | sing | 1.37Å | 1.41Å | Aromatic |
| C3 | C4 | doub | 1.39Å | 1.42Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C5 | C6 | doub | 1.40Å | 1.41Å | Aromatic |
| C6 | S7 | sing | 1.76Å | 1.70Å | Aromatic |
| S7 | C8 | sing | 1.75Å | 1.74Å | Aromatic |
| C8 | N9 | sing | 1.38Å | 1.37Å | |
| C8 | C14 | doub | 1.36Å | 1.47Å | Aromatic |
| N9 | C10 | sing | 1.35Å | 1.34Å | |
| C10 | O10 | doub | 1.22Å | 1.22Å | |
| C10 | N11 | sing | 1.35Å | 1.33Å | |
| N11 | C35 | sing | 1.46Å | 1.46Å | |
| C14 | C15 | sing | 1.46Å | 1.50Å | |
| C15 | N15 | sing | 1.35Å | 1.34Å | |
| C15 | O15 | doub | 1.22Å | 1.23Å | |
| N15 | C16 | sing | 1.47Å | 1.47Å | |
| N15 | C18 | sing | 1.47Å | 1.47Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | C20 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | C20 | sing | 1.54Å | 1.53Å | |
| C20 | N20 | sing | 1.47Å | 1.48Å | |
| N20 | C21 | sing | 1.47Å | 1.48Å | |
| N20 | C24 | sing | 1.47Å | 1.48Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C23 | C25 | sing | 1.53Å | 1.54Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | sing | 1.51Å | 1.50Å | |
| C25 | C28 | sing | 1.54Å | 1.52Å | |
| C26 | O26 | doub | 1.21Å | 1.22Å | |
| C26 | O27 | sing | 1.34Å | 1.44Å | |
| O27 | C29 | sing | 1.46Å | 1.42Å | |
| C28 | C29 | sing | 1.55Å | 1.54Å | |
| C29 | C30 | sing | 1.53Å | 1.53Å | |
| C29 | C31 | sing | 1.53Å | 1.53Å | |
| C35 | C36 | sing | 1.53Å | 1.51Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| N9 | HN9 | sing | 0.97Å | 1.00Å | |
| N11 | HN11 | sing | 0.97Å | 1.00Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C30 | H30B | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C31 | H31B | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C36 | H36B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 120.5° | 119.0° |
| C2 | C1 | C14 | 131.1° | 128.8° |
| C1 | C2 | C3 | 119.7° | 120.4° |
| C1 | C2 | H2 | 120.2° | 119.8° |
| C6 | C1 | C14 | 108.4° | 112.2° |
| C1 | C6 | C5 | 120.1° | 119.7° |
| C1 | C6 | S7 | 118.9° | 110.4° |
| C1 | C14 | C8 | 111.9° | 113.8° |
| C1 | C14 | C15 | 122.1° | 123.1° |
| C2 | C3 | C4 | 119.9° | 120.3° |
| C3 | C2 | H2 | 120.2° | 119.8° |
| C2 | C3 | H3 | 120.1° | 119.8° |
| C3 | C4 | C5 | 120.0° | 120.1° |
| C4 | C3 | H3 | 120.0° | 119.8° |
| C3 | C4 | H4 | 120.0° | 119.9° |
| C4 | C5 | C6 | 119.9° | 120.5° |
| C5 | C4 | H4 | 120.0° | 120.0° |
| C4 | C5 | H5 | 120.1° | 119.7° |
| C5 | C6 | S7 | 121.1° | 129.8° |
| C6 | C5 | H5 | 120.0° | 119.8° |
| C6 | S7 | C8 | 88.4° | 92.7° |
| S7 | C8 | N9 | 124.4° | 124.5° |
| S7 | C8 | C14 | 112.4° | 110.9° |
| N9 | C8 | C14 | 123.2° | 124.5° |
| C8 | N9 | C10 | 121.3° | 120.0° |
| C8 | N9 | HN9 | 119.3° | 120.0° |
| C8 | C14 | C15 | 126.0° | 123.1° |
| N9 | C10 | O10 | 121.2° | 120.0° |
| N9 | C10 | N11 | 120.3° | 120.0° |
| C10 | N9 | HN9 | 119.3° | 120.0° |
| O10 | C10 | N11 | 118.5° | 120.0° |
| C10 | N11 | C35 | 125.4° | 120.0° |
| C10 | N11 | HN11 | 117.3° | 120.0° |
| N11 | C35 | C36 | 110.8° | 109.5° |
| C35 | N11 | HN11 | 117.3° | 120.0° |
| N11 | C35 | H35 | 109.0° | 109.4° |
| N11 | C35 | H35A | 109.0° | 109.5° |
| C14 | C15 | N15 | 120.5° | 120.0° |
| C14 | C15 | O15 | 117.6° | 120.0° |
| N15 | C15 | O15 | 121.9° | 120.0° |
| C15 | N15 | C16 | 121.5° | 120.6° |
| C15 | N15 | C18 | 123.3° | 120.6° |
| C16 | N15 | C18 | 115.2° | 118.8° |
| N15 | C16 | C17 | 105.6° | 108.7° |
| N15 | C16 | H16 | 110.8° | 109.6° |
| N15 | C16 | H16A | 110.8° | 109.6° |
| N15 | C18 | C19 | 108.3° | 108.8° |
| N15 | C18 | H18 | 109.9° | 109.6° |
| N15 | C18 | H18A | 109.8° | 109.6° |
| C16 | C17 | C20 | 110.4° | 109.3° |
| C17 | C16 | H16 | 110.8° | 109.6° |
| C17 | C16 | H16A | 110.8° | 109.6° |
| C16 | C17 | H17 | 109.2° | 109.5° |
| C16 | C17 | H17A | 109.2° | 109.5° |
| C17 | C20 | C19 | 108.1° | 109.7° |
| C17 | C20 | N20 | 109.6° | 109.5° |
| C20 | C17 | H17 | 109.1° | 109.5° |
| C20 | C17 | H17A | 109.2° | 109.5° |
| C17 | C20 | H20 | 110.5° | 109.5° |
| C18 | C19 | C20 | 113.8° | 109.3° |
| C19 | C18 | H18 | 109.8° | 109.6° |
| C19 | C18 | H18A | 109.8° | 109.6° |
| C18 | C19 | H19 | 108.1° | 109.5° |
| C18 | C19 | H19A | 108.1° | 109.5° |
| C19 | C20 | N20 | 110.2° | 109.6° |
| C20 | C19 | H19 | 108.1° | 109.6° |
| C20 | C19 | H19A | 108.1° | 109.4° |
| C19 | C20 | H20 | 110.0° | 109.1° |
| C20 | N20 | C21 | 110.9° | 111.0° |
| C20 | N20 | C24 | 110.7° | 111.0° |
| N20 | C20 | H20 | 108.4° | 109.5° |
| C21 | N20 | C24 | 112.6° | 111.2° |
| N20 | C21 | C22 | 111.0° | 109.6° |
| N20 | C21 | H21 | 109.0° | 109.5° |
| N20 | C21 | H21A | 108.9° | 109.5° |
| N20 | C24 | C25 | 112.7° | 109.6° |
| N20 | C24 | H24 | 108.4° | 109.5° |
| N20 | C24 | H24A | 108.4° | 109.5° |
| C21 | C22 | C23 | 110.9° | 109.2° |
| C22 | C21 | H21 | 108.9° | 109.4° |
| C22 | C21 | H21A | 109.0° | 109.4° |
| C21 | C22 | H22 | 109.0° | 109.5° |
| C21 | C22 | H22A | 109.0° | 109.6° |
| C22 | C23 | C25 | 111.7° | 109.2° |
| C23 | C22 | H22 | 109.0° | 109.5° |
| C23 | C22 | H22A | 109.0° | 109.5° |
| C22 | C23 | H23 | 108.8° | 109.5° |
| C22 | C23 | H23A | 108.7° | 109.5° |
| C23 | C25 | C24 | 112.2° | 110.5° |
| C23 | C25 | C26 | 110.4° | 110.5° |
| C23 | C25 | C28 | 109.3° | 109.9° |
| C25 | C23 | H23 | 108.7° | 109.6° |
| C25 | C23 | H23A | 108.7° | 109.5° |
| C24 | C25 | C26 | 108.5° | 110.6° |
| C24 | C25 | C28 | 113.9° | 110.0° |
| C25 | C24 | H24 | 108.4° | 109.5° |
| C25 | C24 | H24A | 108.4° | 109.4° |
| C26 | C25 | C28 | 102.1° | 105.3° |
| C25 | C26 | O26 | 126.3° | 125.2° |
| C25 | C26 | O27 | 111.8° | 109.6° |
| C25 | C28 | C29 | 108.1° | 102.0° |
| C25 | C28 | H28 | 109.9° | 110.9° |
| C25 | C28 | H28A | 109.9° | 110.9° |
| O26 | C26 | O27 | 122.0° | 125.2° |
| C26 | O27 | C29 | 109.8° | 109.9° |
| O27 | C29 | C28 | 105.8° | 104.5° |
| O27 | C29 | C30 | 108.3° | 110.5° |
| O27 | C29 | C31 | 108.7° | 110.4° |
| C28 | C29 | C30 | 110.7° | 110.4° |
| C28 | C29 | C31 | 111.3° | 110.4° |
| C29 | C28 | H28 | 109.9° | 110.9° |
| C29 | C28 | H28A | 109.9° | 110.9° |
| C30 | C29 | C31 | 111.8° | 110.5° |
| C29 | C30 | H30 | 109.5° | 109.5° |
| C29 | C30 | H30A | 109.5° | 109.5° |
| C29 | C30 | H30B | 109.5° | 109.5° |
| C29 | C31 | H31 | 109.5° | 109.6° |
| C29 | C31 | H31A | 109.5° | 109.5° |
| C29 | C31 | H31B | 109.4° | 109.5° |
| C36 | C35 | H35 | 109.0° | 109.4° |
| C36 | C35 | H35A | 109.0° | 109.5° |
| C35 | C36 | H36 | 109.5° | 109.4° |
| C35 | C36 | H36A | 109.5° | 109.5° |
| C35 | C36 | H36B | 109.5° | 109.5° |
| H16 | C16 | H16A | 108.1° | 109.7° |
| H17 | C17 | H17A | 109.8° | 109.5° |
| H18 | C18 | H18A | 109.1° | 109.7° |
| H19 | C19 | H19A | 110.8° | 109.5° |
| H21 | C21 | H21A | 110.0° | 109.4° |
| H22 | C22 | H22A | 110.0° | 109.6° |
| H23 | C23 | H23A | 110.2° | 109.6° |
| H24 | C24 | H24A | 110.5° | 109.4° |
| H28 | C28 | H28A | 109.0° | 110.9° |
| H30 | C30 | H30A | 109.5° | 109.5° |
| H30 | C30 | H30B | 109.4° | 109.5° |
| H30A | C30 | H30B | 109.5° | 109.5° |
| H31 | C31 | H31A | 109.5° | 109.5° |
| H31 | C31 | H31B | 109.4° | 109.5° |
| H31A | C31 | H31B | 109.5° | 109.4° |
| H35 | C35 | H35A | 109.9° | 109.5° |
| H36 | C36 | H36A | 109.4° | 109.5° |
| H36 | C36 | H36B | 109.5° | 109.5° |
| H36A | C36 | H36B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | C14 | 179.8° | 179.7° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.3° | 0.0° |
| C2 | C1 | C6 | C5 | 0.4° | 0.1° |
| C2 | C1 | C6 | S7 | 179.7° | 179.9° |
| C2 | C1 | C14 | C8 | 179.5° | 179.9° |
| C2 | C1 | C14 | C15 | 0.7° | 0.0° |
| C1 | C2 | C3 | H3 | 179.7° | 179.9° |
| C6 | C1 | C2 | C3 | 0.5° | 0.1° |
| C1 | C6 | C5 | C4 | 0.1° | 0.1° |
| C1 | C6 | C5 | S7 | 179.9° | 180.0° |
| C1 | C6 | S7 | C8 | 0.1° | 0.0° |
| C6 | C1 | C14 | C8 | 0.7° | 0.5° |
| C6 | C1 | C14 | C15 | 179.5° | 179.7° |
| C6 | C1 | C2 | H2 | 179.6° | 180.0° |
| C1 | C6 | C5 | H5 | 179.9° | 180.0° |
| C14 | C1 | C2 | C3 | 179.3° | 179.7° |
| C14 | C1 | C6 | C5 | 179.4° | 179.8° |
| C14 | C1 | C6 | S7 | 0.5° | 0.2° |
| C1 | C14 | C8 | S7 | 0.7° | 0.4° |
| C1 | C14 | C8 | N9 | 179.8° | 179.8° |
| C1 | C14 | C8 | C15 | 178.7° | 179.9° |
| C1 | C14 | C15 | N15 | 73.3° | 90.0° |
| C1 | C14 | C15 | O15 | 106.4° | 90.0° |
| C14 | C1 | C2 | H2 | 0.7° | 0.4° |
| C2 | C3 | C4 | H3 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.1° | 0.0° |
| C2 | C3 | C4 | H4 | 179.9° | 180.0° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.0° | 0.0° |
| C4 | C3 | C2 | H2 | 179.7° | 179.9° |
| C3 | C4 | C5 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | S7 | 179.9° | 180.0° |
| C5 | C4 | C3 | H3 | 179.9° | 179.9° |
| C5 | C6 | S7 | C8 | 179.8° | 180.0° |
| C6 | C5 | C4 | H4 | 180.0° | 180.0° |
| C6 | S7 | C8 | N9 | 179.9° | 180.0° |
| C6 | S7 | C8 | C14 | 0.3° | 0.3° |
| S7 | C6 | C5 | H5 | 0.1° | 0.0° |
| S7 | C8 | N9 | C14 | 179.5° | 179.7° |
| S7 | C8 | N9 | C10 | 2.6° | 0.1° |
| S7 | C8 | C14 | C15 | 179.4° | 179.7° |
| S7 | C8 | N9 | HN9 | 177.5° | 180.0° |
| C8 | N9 | C10 | HN9 | 180.0° | 179.9° |
| C8 | N9 | C10 | O10 | 0.5° | 0.1° |
| C8 | N9 | C10 | N11 | 179.7° | 180.0° |
| N9 | C8 | C14 | C15 | 1.0° | 0.0° |
| C14 | C8 | N9 | C10 | 178.0° | 179.8° |
| C8 | C14 | C15 | N15 | 108.1° | 90.2° |
| C8 | C14 | C15 | O15 | 72.2° | 89.8° |
| C14 | C8 | N9 | HN9 | 2.0° | 0.3° |
| N9 | C10 | O10 | N11 | 179.8° | 179.9° |
| N9 | C10 | N11 | C35 | 179.8° | 179.9° |
| N9 | C10 | N11 | HN11 | 0.2° | 0.1° |
| O10 | C10 | N11 | C35 | 0.0° | 0.0° |
| O10 | C10 | N9 | HN9 | 179.5° | 180.0° |
| O10 | C10 | N11 | HN11 | 180.0° | 180.0° |
| C10 | N11 | C35 | HN11 | 180.0° | 180.0° |
| C10 | N11 | C35 | C36 | 165.2° | 180.0° |
| N11 | C10 | N9 | HN9 | 0.3° | 0.1° |
| C10 | N11 | C35 | H35 | 45.2° | 60.0° |
| C10 | N11 | C35 | H35A | 74.8° | 60.0° |
| N11 | C35 | C36 | H35 | 120.0° | 119.9° |
| N11 | C35 | C36 | H35A | 120.0° | 120.1° |
| N11 | C35 | H35 | H35A | 119.4° | 120.0° |
| N11 | C35 | C36 | H36 | 180.0° | 60.1° |
| N11 | C35 | C36 | H36A | 60.0° | 59.9° |
| N11 | C35 | C36 | H36B | 60.0° | 180.0° |
| C14 | C15 | N15 | O15 | 179.7° | 180.0° |
| C14 | C15 | N15 | C16 | 179.3° | 180.0° |
| C14 | C15 | N15 | C18 | 0.6° | 0.3° |
| C15 | N15 | C16 | C18 | 178.8° | 179.7° |
| C15 | N15 | C16 | C17 | 117.3° | 126.4° |
| C15 | N15 | C18 | C19 | 123.5° | 126.4° |
| C15 | N15 | C16 | H16 | 2.7° | 6.7° |
| C15 | N15 | C16 | H16A | 122.7° | 113.8° |
| C15 | N15 | C18 | H18 | 116.6° | 113.8° |
| C15 | N15 | C18 | H18A | 3.5° | 6.6° |
| O15 | C15 | N15 | C16 | 0.4° | 0.0° |
| O15 | C15 | N15 | C18 | 179.1° | 179.7° |
| N15 | C16 | C17 | H16 | 120.0° | 119.8° |
| N15 | C16 | C17 | H16A | 120.0° | 119.8° |
| N15 | C16 | C17 | C20 | 62.9° | 54.7° |
| C16 | N15 | C18 | C19 | 57.8° | 53.9° |
| N15 | C16 | H16 | H16A | 121.6° | 120.4° |
| N15 | C16 | C17 | H17 | 57.1° | 65.3° |
| N15 | C16 | C17 | H17A | 177.0° | 174.6° |
| C16 | N15 | C18 | H18 | 62.2° | 65.8° |
| C16 | N15 | C18 | H18A | 177.8° | 173.7° |
| C18 | N15 | C16 | C17 | 63.9° | 53.9° |
| N15 | C18 | C19 | H18 | 120.0° | 119.7° |
| N15 | C18 | C19 | H18A | 120.0° | 119.8° |
| N15 | C18 | C19 | C20 | 50.7° | 54.5° |
| C18 | N15 | C16 | H16 | 176.1° | 173.7° |
| C18 | N15 | C16 | H16A | 56.1° | 65.9° |
| N15 | C18 | H18 | H18A | 120.5° | 120.3° |
| N15 | C18 | C19 | H19 | 170.8° | 174.6° |
| N15 | C18 | C19 | H19A | 69.3° | 65.3° |
| C16 | C17 | C20 | H17 | 120.0° | 120.0° |
| C16 | C17 | C20 | H17A | 120.0° | 119.9° |
| C16 | C17 | C20 | C19 | 58.7° | 61.1° |
| C16 | C17 | C20 | N20 | 178.9° | 178.6° |
| C17 | C16 | H16 | H16A | 121.6° | 120.4° |
| C16 | C17 | H17 | H17A | 119.6° | 120.0° |
| C16 | C17 | C20 | H20 | 61.7° | 58.6° |
| C17 | C20 | C19 | C18 | 52.7° | 61.1° |
| C17 | C20 | C19 | N20 | 119.8° | 120.2° |
| C17 | C20 | C19 | H20 | 120.7° | 119.9° |
| C17 | C20 | N20 | H20 | 120.7° | 120.0° |
| C17 | C20 | N20 | C21 | 58.1° | 56.0° |
| C17 | C20 | N20 | C24 | 176.2° | 179.8° |
| C20 | C17 | C16 | H16 | 177.1° | 174.4° |
| C20 | C17 | C16 | H16A | 57.1° | 65.1° |
| C20 | C17 | H17 | H17A | 119.6° | 120.1° |
| C17 | C20 | C19 | H19 | 172.7° | 178.9° |
| C17 | C20 | C19 | H19A | 67.3° | 58.8° |
| C18 | C19 | C20 | H19 | 120.0° | 120.1° |
| C18 | C19 | C20 | H19A | 120.0° | 119.9° |
| C18 | C19 | C20 | N20 | 172.5° | 178.7° |
| C19 | C18 | H18 | H18A | 120.5° | 120.4° |
| C18 | C19 | H19 | H19A | 118.2° | 120.1° |
| C18 | C19 | C20 | H20 | 68.1° | 58.9° |
| C19 | C20 | N20 | H20 | 120.4° | 119.7° |
| C19 | C20 | N20 | C21 | 177.0° | 176.4° |
| C19 | C20 | N20 | C24 | 57.3° | 59.5° |
| C19 | C20 | C17 | H17 | 61.3° | 58.9° |
| C19 | C20 | C17 | H17A | 178.8° | 178.9° |
| C20 | C19 | C18 | H18 | 69.3° | 65.2° |
| C20 | C19 | C18 | H18A | 170.7° | 174.3° |
| C20 | C19 | H19 | H19A | 118.2° | 120.0° |
| C20 | N20 | C21 | C24 | 124.6° | 124.1° |
| C20 | N20 | C21 | C22 | 177.6° | 173.8° |
| C20 | N20 | C24 | C25 | 178.9° | 175.0° |
| N20 | C20 | C17 | H17 | 58.9° | 61.4° |
| N20 | C20 | C17 | H17A | 61.0° | 58.6° |
| N20 | C20 | C19 | H19 | 67.5° | 58.7° |
| N20 | C20 | C19 | H19A | 52.5° | 61.4° |
| C20 | N20 | C21 | H21 | 57.6° | 53.8° |
| C20 | N20 | C21 | H21A | 62.4° | 66.2° |
| C20 | N20 | C24 | H24 | 58.9° | 64.9° |
| C20 | N20 | C24 | H24A | 61.1° | 55.0° |
| N20 | C21 | C22 | H21 | 120.0° | 120.1° |
| N20 | C21 | C22 | H21A | 120.0° | 120.1° |
| N20 | C21 | C22 | C23 | 56.9° | 59.5° |
| C21 | N20 | C24 | C25 | 54.2° | 60.9° |
| C21 | N20 | C20 | H20 | 62.6° | 64.0° |
| N20 | C21 | H21 | H21A | 119.4° | 120.0° |
| N20 | C21 | C22 | H22 | 63.1° | 60.3° |
| N20 | C21 | C22 | H22A | 176.9° | 179.5° |
| C21 | N20 | C24 | H24 | 65.8° | 59.1° |
| C21 | N20 | C24 | H24A | 174.2° | 179.1° |
| C24 | N20 | C21 | C22 | 57.8° | 62.1° |
| N20 | C24 | C25 | C23 | 49.7° | 57.9° |
| N20 | C24 | C25 | H24 | 120.0° | 120.1° |
| N20 | C24 | C25 | H24A | 120.0° | 120.0° |
| N20 | C24 | C25 | C26 | 171.9° | 179.5° |
| N20 | C24 | C25 | C28 | 75.2° | 63.6° |
| C24 | N20 | C20 | H20 | 63.1° | 60.2° |
| C24 | N20 | C21 | H21 | 177.8° | 177.8° |
| C24 | N20 | C21 | H21A | 62.2° | 57.9° |
| N20 | C24 | H24 | H24A | 118.7° | 120.0° |
| C21 | C22 | C23 | H22 | 120.0° | 119.9° |
| C21 | C22 | C23 | H22A | 120.0° | 120.0° |
| C21 | C22 | C23 | C25 | 52.9° | 56.8° |
| C22 | C21 | H21 | H21A | 119.4° | 119.8° |
| C21 | C22 | H22 | H22A | 119.4° | 120.2° |
| C21 | C22 | C23 | H23 | 172.9° | 176.8° |
| C21 | C22 | C23 | H23A | 67.0° | 63.1° |
| C22 | C23 | C25 | H23 | 120.0° | 119.9° |
| C22 | C23 | C25 | H23A | 120.0° | 119.9° |
| C22 | C23 | C25 | C24 | 49.3° | 56.5° |
| C22 | C23 | C25 | C26 | 170.5° | 179.1° |
| C22 | C23 | C25 | C28 | 78.0° | 65.1° |
| C23 | C22 | C21 | H21 | 176.9° | 179.6° |
| C23 | C22 | C21 | H21A | 63.1° | 60.5° |
| C23 | C22 | H22 | H22A | 119.5° | 120.1° |
| C22 | C23 | H23 | H23A | 119.1° | 120.1° |
| C23 | C25 | C24 | C26 | 122.2° | 122.6° |
| C23 | C25 | C24 | C28 | 124.9° | 121.5° |
| C23 | C25 | C26 | C28 | 116.1° | 118.6° |
| C23 | C25 | C26 | O26 | 71.4° | 59.1° |
| C23 | C25 | C26 | O27 | 109.6° | 121.0° |
| C23 | C25 | C28 | C29 | 103.4° | 103.9° |
| C25 | C23 | C22 | H22 | 67.0° | 63.0° |
| C25 | C23 | C22 | H22A | 172.9° | 176.8° |
| C25 | C23 | H23 | H23A | 119.1° | 120.2° |
| C23 | C25 | C24 | H24 | 70.3° | 62.1° |
| C23 | C25 | C24 | H24A | 169.7° | 178.0° |
| C23 | C25 | C28 | H28 | 136.6° | 138.0° |
| C23 | C25 | C28 | H28A | 16.6° | 14.3° |
| C24 | C25 | C26 | C28 | 120.5° | 118.8° |
| C24 | C25 | C26 | O26 | 52.0° | 63.5° |
| C24 | C25 | C26 | O27 | 127.1° | 116.4° |
| C24 | C25 | C28 | C29 | 130.2° | 134.3° |
| C24 | C25 | C23 | H23 | 169.3° | 176.4° |
| C24 | C25 | C23 | H23A | 70.7° | 63.4° |
| C25 | C24 | H24 | H24A | 118.7° | 119.9° |
| C24 | C25 | C28 | H28 | 10.2° | 16.2° |
| C24 | C25 | C28 | H28A | 109.8° | 107.5° |
| C25 | C26 | O26 | O27 | 179.0° | 179.9° |
| C25 | C26 | O27 | C29 | 3.4° | 20.8° |
| C26 | C25 | C28 | C29 | 13.5° | 15.1° |
| C26 | C25 | C23 | H23 | 69.5° | 61.0° |
| C26 | C25 | C23 | H23A | 50.5° | 59.2° |
| C26 | C25 | C24 | H24 | 51.9° | 60.5° |
| C26 | C25 | C24 | H24A | 68.1° | 59.5° |
| C26 | C25 | C28 | H28 | 106.5° | 103.0° |
| C26 | C25 | C28 | H28A | 133.5° | 133.3° |
| C28 | C25 | C26 | O26 | 172.5° | 177.7° |
| C28 | C25 | C26 | O27 | 6.6° | 2.4° |
| C25 | C28 | C29 | O27 | 16.1° | 26.5° |
| C25 | C28 | C29 | H28 | 120.0° | 118.1° |
| C25 | C28 | C29 | H28A | 120.0° | 118.2° |
| C25 | C28 | C29 | C30 | 101.0° | 92.2° |
| C25 | C28 | C29 | C31 | 134.0° | 145.2° |
| C28 | C25 | C23 | H23 | 42.0° | 54.8° |
| C28 | C25 | C23 | H23A | 162.0° | 175.0° |
| C28 | C25 | C24 | H24 | 164.8° | 176.4° |
| C28 | C25 | C24 | H24A | 44.8° | 56.4° |
| C25 | C28 | H28 | H28A | 120.5° | 123.7° |
| O26 | C26 | O27 | C29 | 177.4° | 159.3° |
| C26 | O27 | C29 | C28 | 11.9° | 30.4° |
| C26 | O27 | C29 | C30 | 106.8° | 88.4° |
| C26 | O27 | C29 | C31 | 131.5° | 149.1° |
| O27 | C29 | C28 | C30 | 117.1° | 118.8° |
| O27 | C29 | C28 | C31 | 117.9° | 118.7° |
| O27 | C29 | C30 | C31 | 119.8° | 122.4° |
| O27 | C29 | C28 | H28 | 103.9° | 91.6° |
| O27 | C29 | C28 | H28A | 136.1° | 144.7° |
| O27 | C29 | C30 | H30 | 180.0° | 61.4° |
| O27 | C29 | C30 | H30A | 60.0° | 178.6° |
| O27 | C29 | C30 | H30B | 60.0° | 58.5° |
| O27 | C29 | C31 | H31 | 180.0° | 58.5° |
| O27 | C29 | C31 | H31A | 60.0° | 178.5° |
| O27 | C29 | C31 | H31B | 60.0° | 61.5° |
| C28 | C29 | C30 | C31 | 124.7° | 122.5° |
| C29 | C28 | H28 | H28A | 120.6° | 123.7° |
| C28 | C29 | C30 | H30 | 64.4° | 176.5° |
| C28 | C29 | C30 | H30A | 55.6° | 63.5° |
| C28 | C29 | C30 | H30B | 175.6° | 56.5° |
| C28 | C29 | C31 | H31 | 63.8° | 56.5° |
| C28 | C29 | C31 | H31A | 176.1° | 63.5° |
| C28 | C29 | C31 | H31B | 56.1° | 176.5° |
| C30 | C29 | C28 | H28 | 139.0° | 149.6° |
| C30 | C29 | C28 | H28A | 19.0° | 26.0° |
| C29 | C30 | H30 | H30A | 120.0° | 120.0° |
| C29 | C30 | H30 | H30B | 120.0° | 120.0° |
| C29 | C30 | H30A | H30B | 120.0° | 120.0° |
| C30 | C29 | C31 | H31 | 60.5° | 179.0° |
| C30 | C29 | C31 | H31A | 59.5° | 59.0° |
| C30 | C29 | C31 | H31B | 179.5° | 60.9° |
| C31 | C29 | C28 | H28 | 14.0° | 27.1° |
| C31 | C29 | C28 | H28A | 106.0° | 96.6° |
| C31 | C29 | C30 | H30 | 60.2° | 61.0° |
| C31 | C29 | C30 | H30A | 179.7° | 59.0° |
| C31 | C29 | C30 | H30B | 59.8° | 179.0° |
| C29 | C31 | H31 | H31A | 120.0° | 120.0° |
| C29 | C31 | H31 | H31B | 120.0° | 120.1° |
| C29 | C31 | H31A | H31B | 120.0° | 120.0° |
| C36 | C35 | N11 | HN11 | 14.8° | 0.0° |
| C36 | C35 | H35 | H35A | 119.5° | 120.0° |
| C35 | C36 | H36 | H36A | 120.0° | 120.0° |
| C35 | C36 | H36 | H36B | 120.0° | 120.0° |
| C35 | C36 | H36A | H36B | 120.0° | 120.0° |
| H2 | C2 | C3 | H3 | 0.3° | 0.0° |
| H3 | C3 | C4 | H4 | 0.1° | 0.0° |
| H4 | C4 | C5 | H5 | 0.0° | 0.1° |
| HN11 | N11 | C35 | H35 | 134.8° | 120.0° |
| HN11 | N11 | C35 | H35A | 105.2° | 120.0° |
| H16 | C16 | C17 | H17 | 62.9° | 54.4° |
| H16 | C16 | C17 | H17A | 57.1° | 65.6° |
| H16A | C16 | C17 | H17 | 177.1° | 174.9° |
| H16A | C16 | C17 | H17A | 63.0° | 54.8° |
| H17 | C17 | C20 | H20 | 178.3° | 178.6° |
| H17A | C17 | C20 | H20 | 58.4° | 61.4° |
| H18 | C18 | C19 | H19 | 50.8° | 54.9° |
| H18 | C18 | C19 | H19A | 170.7° | 174.9° |
| H18A | C18 | C19 | H19 | 69.3° | 65.6° |
| H18A | C18 | C19 | H19A | 50.7° | 54.4° |
| H19 | C19 | C20 | H20 | 51.9° | 61.2° |
| H19A | C19 | C20 | H20 | 171.9° | 178.8° |
| H21 | C21 | C22 | H22 | 56.9° | 59.8° |
| H21 | C21 | C22 | H22A | 63.1° | 60.4° |
| H21A | C21 | C22 | H22 | 176.9° | 179.6° |
| H21A | C21 | C22 | H22A | 56.9° | 59.4° |
| H22 | C22 | C23 | H23 | 53.0° | 56.9° |
| H22 | C22 | C23 | H23A | 173.0° | 177.1° |
| H22A | C22 | C23 | H23 | 67.1° | 63.2° |
| H22A | C22 | C23 | H23A | 52.9° | 56.9° |
| H30 | C30 | H30A | H30B | 120.0° | 120.0° |
| H31 | C31 | H31A | H31B | 120.0° | 120.0° |
| H35 | C35 | C36 | H36 | 60.0° | 180.0° |
| H35 | C35 | C36 | H36A | 180.0° | 60.0° |
| H35 | C35 | C36 | H36B | 60.0° | 60.0° |
| H35A | C35 | C36 | H36 | 60.0° | 60.0° |
| H35A | C35 | C36 | H36A | 60.0° | 180.0° |
| H35A | C35 | C36 | H36B | 180.0° | 60.0° |
| H36 | C36 | H36A | H36B | 120.0° | 120.0° |
