A1JDF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C3 | doub | 1.36Å | 1.37Å | Aromatic |
| C4 | C5 | sing | 1.40Å | 1.40Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.46Å | 1.45Å | Aromatic |
| C6 | N7 | doub | 1.30Å | 1.30Å | Aromatic |
| C5 | C12 | doub | 1.41Å | 1.42Å | Aromatic |
| N7 | N8 | sing | 1.40Å | 1.40Å | Aromatic |
| C2 | F1 | sing | 1.35Å | 1.37Å | |
| C2 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | N8 | sing | 1.37Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.51Å | 1.52Å | |
| N8 | C9 | sing | 1.47Å | 1.46Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | C11 | sing | 1.53Å | 1.53Å | |
| C14 | N15 | sing | 1.47Å | 1.48Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| N15 | C16 | sing | 1.35Å | 1.35Å | |
| O26 | S25 | doub | 1.42Å | 1.42Å | |
| C16 | C18 | sing | 1.47Å | 1.46Å | |
| C16 | O17 | doub | 1.22Å | 1.21Å | |
| C19 | C18 | doub | 1.38Å | 1.36Å | Aromatic |
| C19 | C20 | sing | 1.40Å | 1.37Å | Aromatic |
| S25 | C20 | sing | 1.76Å | 1.76Å | |
| S25 | O27 | doub | 1.42Å | 1.44Å | |
| S25 | C28 | sing | 1.76Å | 1.76Å | |
| C18 | N23 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | doub | 1.36Å | 1.38Å | Aromatic |
| C29 | C30 | sing | 1.41Å | 1.41Å | Aromatic |
| C20 | C21 | doub | 1.35Å | 1.37Å | Aromatic |
| C31 | C30 | doub | 1.38Å | 1.45Å | Aromatic |
| C31 | N32 | sing | 1.34Å | 1.32Å | Aromatic |
| C28 | C38 | sing | 1.40Å | 1.40Å | Aromatic |
| C30 | C35 | sing | 1.47Å | 1.42Å | Aromatic |
| N23 | C21 | sing | 1.36Å | 1.37Å | Aromatic |
| N23 | C24 | sing | 1.46Å | 1.48Å | |
| N32 | N33 | sing | 1.40Å | 1.40Å | Aromatic |
| C21 | C22 | sing | 1.51Å | 1.51Å | |
| C38 | C36 | doub | 1.36Å | 1.36Å | Aromatic |
| C35 | N33 | doub | 1.32Å | 1.35Å | Aromatic |
| C35 | C36 | sing | 1.41Å | 1.37Å | Aromatic |
| C36 | C37 | sing | 1.51Å | 1.50Å | |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C19 | H6 | sing | 1.08Å | 1.08Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C31 | H10 | sing | 1.08Å | 1.08Å | |
| C37 | H11 | sing | 1.09Å | 1.10Å | |
| C37 | H12 | sing | 1.09Å | 1.10Å | |
| C37 | H13 | sing | 1.09Å | 1.10Å | |
| C38 | H14 | sing | 1.08Å | 1.08Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| N15 | H20 | sing | 0.97Å | 1.00Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C29 | H24 | sing | 1.08Å | 1.08Å | |
| N32 | H25 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | C4 | C5 | 119.6° | 119.8° |
| C4 | C3 | C2 | 120.2° | 120.6° |
| C4 | C3 | H1 | 119.9° | 119.7° |
| C3 | C4 | H2 | 120.2° | 120.1° |
| C4 | C5 | C6 | 132.6° | 133.9° |
| C4 | C5 | C12 | 121.0° | 119.8° |
| C5 | C4 | H2 | 120.2° | 120.1° |
| C3 | C2 | F1 | 119.2° | 119.7° |
| C3 | C2 | C13 | 121.1° | 120.6° |
| C2 | C3 | H1 | 119.9° | 119.7° |
| C5 | C6 | N7 | 108.3° | 107.7° |
| C6 | C5 | C12 | 106.4° | 106.3° |
| C5 | C6 | H3 | 125.8° | 126.1° |
| C6 | N7 | N8 | 110.1° | 110.1° |
| N7 | C6 | H3 | 125.9° | 126.2° |
| C5 | C12 | C13 | 118.3° | 119.4° |
| C5 | C12 | N8 | 105.7° | 106.8° |
| N7 | N8 | C12 | 109.4° | 109.1° |
| N7 | N8 | C9 | 122.2° | 125.5° |
| F1 | C2 | C13 | 119.7° | 119.7° |
| C2 | C13 | C12 | 119.8° | 119.7° |
| C2 | C13 | C14 | 118.8° | 120.2° |
| C13 | C12 | N8 | 136.1° | 133.8° |
| C12 | C13 | C14 | 121.3° | 120.2° |
| C12 | N8 | C9 | 128.4° | 125.5° |
| C13 | C14 | N15 | 105.4° | 109.5° |
| C13 | C14 | H18 | 110.5° | 109.4° |
| C13 | C14 | H19 | 110.5° | 109.5° |
| N8 | C9 | C10 | 118.9° | 117.5° |
| N8 | C9 | C11 | 114.1° | 117.5° |
| N8 | C9 | H15 | 117.9° | 115.6° |
| C10 | C9 | C11 | 59.9° | 60.0° |
| C9 | C10 | C11 | 60.0° | 60.0° |
| C10 | C9 | H15 | 116.4° | 117.5° |
| C9 | C10 | H16 | 120.0° | 117.5° |
| C9 | C10 | H17 | 120.0° | 117.5° |
| C9 | C11 | C10 | 60.1° | 60.0° |
| C9 | C11 | H4 | 120.0° | 117.5° |
| C9 | C11 | H5 | 120.0° | 117.5° |
| C11 | C9 | H15 | 116.4° | 117.6° |
| C14 | N15 | C16 | 123.1° | 120.0° |
| N15 | C14 | H18 | 110.5° | 109.4° |
| N15 | C14 | H19 | 110.5° | 109.5° |
| C14 | N15 | H20 | 118.4° | 119.9° |
| C10 | C11 | H4 | 120.0° | 117.5° |
| C10 | C11 | H5 | 120.0° | 117.5° |
| C11 | C10 | H16 | 120.0° | 117.4° |
| C11 | C10 | H17 | 120.0° | 117.5° |
| N15 | C16 | C18 | 121.5° | 120.0° |
| N15 | C16 | O17 | 120.2° | 120.0° |
| C16 | N15 | H20 | 118.4° | 120.1° |
| O26 | S25 | C20 | 104.7° | 106.4° |
| O26 | S25 | O27 | 116.4° | 123.2° |
| O26 | S25 | C28 | 106.5° | 106.4° |
| C18 | C16 | O17 | 118.3° | 120.0° |
| C16 | C18 | C19 | 125.1° | 126.2° |
| C16 | C18 | N23 | 128.0° | 126.2° |
| C18 | C19 | C20 | 109.0° | 107.0° |
| C19 | C18 | N23 | 107.0° | 107.5° |
| C18 | C19 | H6 | 125.5° | 126.5° |
| C19 | C20 | S25 | 120.2° | 126.0° |
| C19 | C20 | C21 | 107.8° | 107.9° |
| C20 | C19 | H6 | 125.5° | 126.5° |
| C20 | S25 | O27 | 107.6° | 106.4° |
| C20 | S25 | C28 | 114.0° | 107.2° |
| S25 | C20 | C21 | 132.0° | 126.1° |
| O27 | S25 | C28 | 107.9° | 106.4° |
| S25 | C28 | C29 | 121.4° | 119.1° |
| S25 | C28 | C38 | 118.0° | 119.1° |
| C18 | N23 | C21 | 108.0° | 108.6° |
| C18 | N23 | C24 | 124.9° | 125.6° |
| C28 | C29 | C30 | 118.3° | 119.5° |
| C29 | C28 | C38 | 120.6° | 121.7° |
| C28 | C29 | H24 | 120.9° | 120.3° |
| C29 | C30 | C31 | 135.8° | 134.8° |
| C29 | C30 | C35 | 119.9° | 118.8° |
| C30 | C29 | H24 | 120.8° | 120.2° |
| C20 | C21 | N23 | 108.2° | 108.9° |
| C20 | C21 | C22 | 127.3° | 125.6° |
| C30 | C31 | N32 | 108.8° | 107.9° |
| C31 | C30 | C35 | 104.3° | 106.4° |
| C30 | C31 | H10 | 125.6° | 126.0° |
| C31 | N32 | N33 | 109.5° | 110.0° |
| N32 | C31 | H10 | 125.6° | 126.1° |
| C31 | N32 | H25 | 125.3° | 125.0° |
| C28 | C38 | C36 | 120.8° | 121.8° |
| C28 | C38 | H14 | 119.6° | 119.1° |
| C30 | C35 | N33 | 109.1° | 106.8° |
| C30 | C35 | C36 | 119.9° | 118.5° |
| C21 | N23 | C24 | 127.1° | 125.7° |
| N23 | C21 | C22 | 124.5° | 125.6° |
| N23 | C24 | H7 | 109.5° | 109.5° |
| N23 | C24 | H8 | 109.5° | 109.4° |
| N23 | C24 | H9 | 109.5° | 109.5° |
| N32 | N33 | C35 | 108.3° | 108.9° |
| N33 | N32 | H25 | 125.2° | 125.0° |
| C21 | C22 | H21 | 109.5° | 109.5° |
| C21 | C22 | H22 | 109.5° | 109.5° |
| C21 | C22 | H23 | 109.5° | 109.5° |
| C38 | C36 | C35 | 120.4° | 119.6° |
| C38 | C36 | C37 | 122.9° | 120.2° |
| C36 | C38 | H14 | 119.6° | 119.1° |
| N33 | C35 | C36 | 131.0° | 134.7° |
| C35 | C36 | C37 | 116.6° | 120.2° |
| C36 | C37 | H11 | 109.5° | 109.4° |
| C36 | C37 | H12 | 109.5° | 109.5° |
| C36 | C37 | H13 | 109.5° | 109.5° |
| H4 | C11 | H5 | 109.4° | 115.6° |
| H7 | C24 | H8 | 109.5° | 109.4° |
| H7 | C24 | H9 | 109.5° | 109.5° |
| H8 | C24 | H9 | 109.4° | 109.5° |
| H11 | C37 | H12 | 109.5° | 109.5° |
| H11 | C37 | H13 | 109.5° | 109.4° |
| H12 | C37 | H13 | 109.5° | 109.5° |
| H16 | C10 | H17 | 109.5° | 115.6° |
| H18 | C14 | H19 | 109.5° | 109.4° |
| H21 | C22 | H22 | 109.5° | 109.4° |
| H21 | C22 | H23 | 109.4° | 109.5° |
| H22 | C22 | H23 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | C4 | C5 | H2 | 180.0° | 180.0° |
| C4 | C3 | C2 | H1 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 179.6° | 180.0° |
| C3 | C4 | C5 | C12 | 0.9° | 0.0° |
| C4 | C3 | C2 | F1 | 178.5° | 180.0° |
| C4 | C3 | C2 | C13 | 0.3° | 0.2° |
| C5 | C4 | C3 | C2 | 0.9° | 0.0° |
| C4 | C5 | C6 | C12 | 179.5° | 180.0° |
| C4 | C5 | C6 | N7 | 179.9° | 180.0° |
| C4 | C5 | C12 | C13 | 0.4° | 0.3° |
| C4 | C5 | C12 | N8 | 179.4° | 180.0° |
| C5 | C4 | C3 | H1 | 179.2° | 180.0° |
| C4 | C5 | C6 | H3 | 0.1° | 0.0° |
| C3 | C2 | F1 | C13 | 178.9° | 179.7° |
| C3 | C2 | C13 | C12 | 0.2° | 0.5° |
| C3 | C2 | C13 | C14 | 178.2° | 179.7° |
| C2 | C3 | C4 | H2 | 179.1° | 179.9° |
| C5 | C6 | N7 | H3 | 180.0° | 180.0° |
| C5 | C6 | N7 | N8 | 0.7° | 0.0° |
| C6 | C5 | C12 | C13 | 180.0° | 179.7° |
| C6 | C5 | C12 | N8 | 0.2° | 0.0° |
| C6 | C5 | C4 | H2 | 0.4° | 0.0° |
| N7 | C6 | C5 | C12 | 0.3° | 0.0° |
| C6 | N7 | N8 | C12 | 0.8° | 0.0° |
| C6 | N7 | N8 | C9 | 178.7° | 180.0° |
| C5 | C12 | N8 | N7 | 0.6° | 0.0° |
| C5 | C12 | C13 | C2 | 0.1° | 0.5° |
| C5 | C12 | C13 | N8 | 179.8° | 179.6° |
| C5 | C12 | C13 | C14 | 178.2° | 179.7° |
| C5 | C12 | N8 | C9 | 178.2° | 180.0° |
| C12 | C5 | C4 | H2 | 179.1° | 180.0° |
| C12 | C5 | C6 | H3 | 179.6° | 180.0° |
| N7 | N8 | C12 | C13 | 179.6° | 179.7° |
| N7 | N8 | C12 | C9 | 177.6° | 180.0° |
| N7 | N8 | C9 | C10 | 30.6° | 75.6° |
| N7 | N8 | C9 | C11 | 98.2° | 7.0° |
| N8 | N7 | C6 | H3 | 179.3° | 180.0° |
| N7 | N8 | C9 | H15 | 119.6° | 138.7° |
| F1 | C2 | C13 | C12 | 179.0° | 179.8° |
| F1 | C2 | C13 | C14 | 0.6° | 0.0° |
| F1 | C2 | C3 | H1 | 1.4° | 0.0° |
| C2 | C13 | C12 | C14 | 178.3° | 179.8° |
| C2 | C13 | C12 | N8 | 179.9° | 179.9° |
| C2 | C13 | C14 | N15 | 97.5° | 97.2° |
| C13 | C2 | C3 | H1 | 179.7° | 179.8° |
| C2 | C13 | C14 | H18 | 143.1° | 142.8° |
| C2 | C13 | C14 | H19 | 21.8° | 22.9° |
| C13 | C12 | N8 | C9 | 1.9° | 0.3° |
| C12 | C13 | C14 | N15 | 80.8° | 83.0° |
| C12 | C13 | C14 | H18 | 38.5° | 37.0° |
| C12 | C13 | C14 | H19 | 159.8° | 156.9° |
| N8 | C12 | C13 | C14 | 1.6° | 0.1° |
| C12 | N8 | C9 | C10 | 146.8° | 104.3° |
| C12 | N8 | C9 | C11 | 79.1° | 173.0° |
| C12 | N8 | C9 | H15 | 63.0° | 41.3° |
| C13 | C14 | N15 | H18 | 119.3° | 120.0° |
| C13 | C14 | N15 | H19 | 119.3° | 120.1° |
| C13 | C14 | N15 | C16 | 153.5° | 180.0° |
| C13 | C14 | H18 | H19 | 121.8° | 120.0° |
| C13 | C14 | N15 | H20 | 26.5° | 0.1° |
| N8 | C9 | C10 | C11 | 102.7° | 107.5° |
| N8 | C9 | C10 | H15 | 150.6° | 145.0° |
| N8 | C9 | C11 | H15 | 142.7° | 145.1° |
| N8 | C9 | C11 | H4 | 1.1° | 0.0° |
| N8 | C9 | C11 | H5 | 139.9° | 145.1° |
| N8 | C9 | C10 | H16 | 147.8° | 0.1° |
| N8 | C9 | C10 | H17 | 6.8° | 145.0° |
| C10 | C9 | C11 | H15 | 106.6° | 107.5° |
| C9 | C10 | C11 | H16 | 109.5° | 107.5° |
| C9 | C10 | C11 | H17 | 109.5° | 107.5° |
| C10 | C9 | C11 | H4 | 109.5° | 107.5° |
| C10 | C9 | C11 | H5 | 109.5° | 107.5° |
| C9 | C10 | H16 | H17 | 144.7° | 145.8° |
| C9 | C11 | H4 | H5 | 144.7° | 145.7° |
| C14 | N15 | C16 | H20 | 180.0° | 179.9° |
| C14 | N15 | C16 | C18 | 179.5° | 175.0° |
| C14 | N15 | C16 | O17 | 2.0° | 5.0° |
| N15 | C14 | H18 | H19 | 121.9° | 120.0° |
| C10 | C11 | H4 | H5 | 144.7° | 145.7° |
| C11 | C10 | H16 | H17 | 144.7° | 145.7° |
| N15 | C16 | C18 | O17 | 177.6° | 180.0° |
| N15 | C16 | C18 | C19 | 11.6° | 5.0° |
| N15 | C16 | C18 | N23 | 167.2° | 174.6° |
| C16 | N15 | C14 | H18 | 34.2° | 60.0° |
| C16 | N15 | C14 | H19 | 87.2° | 59.9° |
| O26 | S25 | C20 | C19 | 18.4° | 1.5° |
| O26 | S25 | C20 | O27 | 124.4° | 132.9° |
| O26 | S25 | C20 | C28 | 116.0° | 113.5° |
| O26 | S25 | O27 | C28 | 119.6° | 122.9° |
| O26 | S25 | C28 | C29 | 46.3° | 23.7° |
| O26 | S25 | C20 | C21 | 158.1° | 178.5° |
| O26 | S25 | C28 | C38 | 132.4° | 156.4° |
| C16 | C18 | C19 | N23 | 179.0° | 179.7° |
| C16 | C18 | C19 | C20 | 179.9° | 179.9° |
| C16 | C18 | N23 | C21 | 179.1° | 179.9° |
| C16 | C18 | N23 | C24 | 0.2° | 0.1° |
| C16 | C18 | C19 | H6 | 0.1° | 0.1° |
| C18 | C16 | N15 | H20 | 0.4° | 5.1° |
| O17 | C16 | C18 | C19 | 170.8° | 175.0° |
| O17 | C16 | C18 | N23 | 10.4° | 5.4° |
| O17 | C16 | N15 | H20 | 178.0° | 174.9° |
| C18 | C19 | C20 | H6 | 180.0° | 179.9° |
| C18 | C19 | C20 | S25 | 179.0° | 180.0° |
| C18 | C19 | C20 | C21 | 1.7° | 0.0° |
| C19 | C18 | N23 | C21 | 0.2° | 0.4° |
| C19 | C18 | N23 | C24 | 179.1° | 179.8° |
| C19 | C20 | S25 | C21 | 176.5° | 180.0° |
| C19 | C20 | S25 | O27 | 142.8° | 131.5° |
| C19 | C20 | S25 | C28 | 97.6° | 115.0° |
| C20 | C19 | C18 | N23 | 1.1° | 0.3° |
| C19 | C20 | C21 | N23 | 1.6° | 0.2° |
| C19 | C20 | C21 | C22 | 178.4° | 180.0° |
| C20 | S25 | O27 | C28 | 123.4° | 114.1° |
| C20 | S25 | C28 | C29 | 68.6° | 89.8° |
| C20 | S25 | C28 | C38 | 112.7° | 90.0° |
| S25 | C20 | C21 | N23 | 178.4° | 179.8° |
| S25 | C20 | C21 | C22 | 1.6° | 0.1° |
| S25 | C20 | C19 | H6 | 1.0° | 0.0° |
| O27 | S25 | C28 | C29 | 172.0° | 156.7° |
| O27 | S25 | C20 | C21 | 33.7° | 48.5° |
| O27 | S25 | C28 | C38 | 6.7° | 23.5° |
| S25 | C28 | C29 | C38 | 178.7° | 179.8° |
| S25 | C28 | C29 | C30 | 177.5° | 179.8° |
| C28 | S25 | C20 | C21 | 85.9° | 65.0° |
| S25 | C28 | C38 | C36 | 177.8° | 180.0° |
| S25 | C28 | C38 | H14 | 2.1° | 0.0° |
| S25 | C28 | C29 | H24 | 2.5° | 0.1° |
| C18 | N23 | C21 | C20 | 0.9° | 0.4° |
| C18 | N23 | C21 | C24 | 179.3° | 179.8° |
| C18 | N23 | C21 | C22 | 179.1° | 179.9° |
| N23 | C18 | C19 | H6 | 178.9° | 179.8° |
| C18 | N23 | C24 | H7 | 180.0° | 90.1° |
| C18 | N23 | C24 | H8 | 60.0° | 149.9° |
| C18 | N23 | C24 | H9 | 60.0° | 29.9° |
| C28 | C29 | C30 | H24 | 180.0° | 179.9° |
| C28 | C29 | C30 | C31 | 178.2° | 179.9° |
| C28 | C29 | C30 | C35 | 0.5° | 0.4° |
| C29 | C28 | C38 | C36 | 0.9° | 0.2° |
| C29 | C28 | C38 | H14 | 179.1° | 179.8° |
| C29 | C30 | C31 | C35 | 178.8° | 179.8° |
| C29 | C30 | C31 | N32 | 177.7° | 179.8° |
| C30 | C29 | C28 | C38 | 1.2° | 0.4° |
| C29 | C30 | C35 | N33 | 179.3° | 179.8° |
| C29 | C30 | C35 | C36 | 0.5° | 0.1° |
| C29 | C30 | C31 | H10 | 2.3° | 0.2° |
| C20 | C21 | N23 | C22 | 180.0° | 179.7° |
| C20 | C21 | N23 | C24 | 179.8° | 179.8° |
| C21 | C20 | C19 | H6 | 178.3° | 180.0° |
| C20 | C21 | C22 | H21 | 90.0° | 90.0° |
| C20 | C21 | C22 | H22 | 150.0° | 150.0° |
| C20 | C21 | C22 | H23 | 30.0° | 30.0° |
| C30 | C31 | N32 | H10 | 180.0° | 180.0° |
| C30 | C31 | N32 | N33 | 2.0° | 0.0° |
| C31 | C30 | C35 | N33 | 0.2° | 0.0° |
| C31 | C30 | C35 | C36 | 179.6° | 180.0° |
| C31 | C30 | C29 | H24 | 1.8° | 0.0° |
| C30 | C31 | N32 | H25 | 178.0° | 180.0° |
| N32 | C31 | C30 | C35 | 1.1° | 0.0° |
| C31 | N32 | N33 | H25 | 180.0° | 180.0° |
| C31 | N32 | N33 | C35 | 2.1° | 0.0° |
| C28 | C38 | C36 | H14 | 180.0° | 180.0° |
| C28 | C38 | C36 | C35 | 0.1° | 0.1° |
| C28 | C38 | C36 | C37 | 178.6° | 180.0° |
| C38 | C28 | C29 | H24 | 178.7° | 179.7° |
| C30 | C35 | N33 | N32 | 1.4° | 0.0° |
| C30 | C35 | C36 | C38 | 0.8° | 0.1° |
| C30 | C35 | N33 | C36 | 179.7° | 179.9° |
| C30 | C35 | C36 | C37 | 179.4° | 180.0° |
| C35 | C30 | C31 | H10 | 178.8° | 180.0° |
| C35 | C30 | C29 | H24 | 179.5° | 179.8° |
| C21 | N23 | C24 | H7 | 0.8° | 89.6° |
| C21 | N23 | C24 | H8 | 119.2° | 30.3° |
| C21 | N23 | C24 | H9 | 120.8° | 150.3° |
| N23 | C21 | C22 | H21 | 90.0° | 89.6° |
| N23 | C21 | C22 | H22 | 30.0° | 30.3° |
| N23 | C21 | C22 | H23 | 150.0° | 150.4° |
| C24 | N23 | C21 | C22 | 0.2° | 0.1° |
| N23 | C24 | H7 | H8 | 120.0° | 119.9° |
| N23 | C24 | H7 | H9 | 120.0° | 120.1° |
| N23 | C24 | H8 | H9 | 120.0° | 120.0° |
| N32 | N33 | C35 | C36 | 178.4° | 179.9° |
| N33 | N32 | C31 | H10 | 178.0° | 180.0° |
| C21 | C22 | H21 | H22 | 120.0° | 120.0° |
| C21 | C22 | H21 | H23 | 120.0° | 120.0° |
| C21 | C22 | H22 | H23 | 120.0° | 120.0° |
| C38 | C36 | C35 | N33 | 178.9° | 180.0° |
| C38 | C36 | C35 | C37 | 178.6° | 180.0° |
| C38 | C36 | C37 | H11 | 90.8° | 90.1° |
| C38 | C36 | C37 | H12 | 149.2° | 30.0° |
| C38 | C36 | C37 | H13 | 29.2° | 150.0° |
| N33 | C35 | C36 | C37 | 0.3° | 0.1° |
| C35 | N33 | N32 | H25 | 177.8° | 180.0° |
| C35 | C36 | C37 | H11 | 90.6° | 90.0° |
| C35 | C36 | C37 | H12 | 29.4° | 150.0° |
| C35 | C36 | C37 | H13 | 149.3° | 29.9° |
| C35 | C36 | C38 | H14 | 179.8° | 180.0° |
| C36 | C37 | H11 | H12 | 120.0° | 120.0° |
| C36 | C37 | H11 | H13 | 120.0° | 119.9° |
| C36 | C37 | H12 | H13 | 120.0° | 120.0° |
| C37 | C36 | C38 | H14 | 1.4° | 0.0° |
| H1 | C3 | C4 | H2 | 0.9° | 0.0° |
| H4 | C11 | C9 | H15 | 143.9° | 145.0° |
| H4 | C11 | C10 | H16 | 141.0° | 0.0° |
| H4 | C11 | C10 | H17 | 0.0° | 145.0° |
| H5 | C11 | C9 | H15 | 2.8° | 0.0° |
| H5 | C11 | C10 | H16 | 0.0° | 145.0° |
| H5 | C11 | C10 | H17 | 141.0° | 0.0° |
| H7 | C24 | H8 | H9 | 120.0° | 120.0° |
| H10 | C31 | N32 | H25 | 2.1° | 0.0° |
| H11 | C37 | H12 | H13 | 120.0° | 120.0° |
| H15 | C9 | C10 | H16 | 2.8° | 145.1° |
| H15 | C9 | C10 | H17 | 143.8° | 0.1° |
| H18 | C14 | N15 | H20 | 145.8° | 120.0° |
| H19 | C14 | N15 | H20 | 92.9° | 120.0° |
| H21 | C22 | H22 | H23 | 120.0° | 119.9° |
