A1JDR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O34 | C25 | sing | 1.43Å | 1.41Å | |
| C20 | C25 | sing | 1.53Å | 1.51Å | |
| C25 | C22 | sing | 1.53Å | 1.53Å | |
| C25 | C21 | sing | 1.53Å | 1.51Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C23 | N30 | sing | 1.47Å | 1.46Å | |
| N27 | N30 | sing | 1.40Å | 1.34Å | Aromatic |
| N27 | C11 | doub | 1.32Å | 1.34Å | Aromatic |
| N30 | C8 | sing | 1.34Å | 1.36Å | Aromatic |
| C11 | C4 | sing | 1.41Å | 1.38Å | Aromatic |
| C11 | C9 | sing | 1.47Å | 1.40Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.37Å | Aromatic |
| C4 | C10 | doub | 1.36Å | 1.39Å | Aromatic |
| C9 | C3 | sing | 1.41Å | 1.38Å | Aromatic |
| C10 | C24 | sing | 1.51Å | 1.51Å | |
| C10 | C13 | sing | 1.40Å | 1.41Å | Aromatic |
| C19 | C24 | sing | 1.53Å | 1.51Å | |
| C18 | C24 | sing | 1.53Å | 1.52Å | |
| C3 | C13 | doub | 1.36Å | 1.40Å | Aromatic |
| C24 | O33 | sing | 1.43Å | 1.42Å | |
| C13 | N31 | sing | 1.40Å | 1.42Å | |
| N31 | C16 | sing | 1.35Å | 1.37Å | |
| O32 | C16 | doub | 1.22Å | 1.21Å | |
| C16 | C14 | sing | 1.48Å | 1.42Å | |
| C14 | N28 | doub | 1.32Å | 1.34Å | Aromatic |
| C14 | C2 | sing | 1.42Å | 1.42Å | Aromatic |
| N28 | N29 | sing | 1.28Å | 1.34Å | Aromatic |
| C17 | C15 | sing | 1.51Å | 1.49Å | |
| C5 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| C5 | C12 | sing | 1.39Å | 1.38Å | Aromatic |
| C2 | C7 | doub | 1.35Å | 1.38Å | Aromatic |
| N29 | C12 | sing | 1.40Å | 1.39Å | |
| N29 | C7 | sing | 1.36Å | 1.37Å | Aromatic |
| C15 | N26 | sing | 1.32Å | 1.34Å | Aromatic |
| C12 | C1 | doub | 1.39Å | 1.38Å | Aromatic |
| N26 | C6 | doub | 1.32Å | 1.34Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.37Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C19 | H6 | sing | 1.09Å | 1.10Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C4 | H17 | sing | 1.08Å | 1.08Å | |
| C5 | H18 | sing | 1.08Å | 1.08Å | |
| C6 | H19 | sing | 1.08Å | 1.08Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| N31 | H28 | sing | 0.97Å | 1.00Å | |
| O33 | H29 | sing | 0.97Å | 0.95Å | |
| O34 | H30 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O34 | C25 | C20 | 106.6° | 109.5° |
| O34 | C25 | C22 | 109.4° | 109.4° |
| O34 | C25 | C21 | 105.4° | 109.5° |
| C25 | O34 | H30 | 109.5° | 114.0° |
| C20 | C25 | C22 | 115.3° | 109.4° |
| C20 | C25 | C21 | 110.6° | 109.5° |
| C25 | C20 | H9 | 109.5° | 109.5° |
| C25 | C20 | H10 | 109.5° | 109.4° |
| C25 | C20 | H11 | 109.5° | 109.5° |
| C22 | C25 | C21 | 109.0° | 109.5° |
| C25 | C22 | C23 | 118.3° | 109.5° |
| C25 | C22 | H15 | 107.2° | 109.5° |
| C25 | C22 | H16 | 107.2° | 109.5° |
| C25 | C21 | H12 | 109.5° | 109.4° |
| C25 | C21 | H13 | 109.4° | 109.5° |
| C25 | C21 | H14 | 109.5° | 109.5° |
| C22 | C23 | N30 | 109.3° | 109.5° |
| C23 | C22 | H15 | 107.2° | 109.5° |
| C23 | C22 | H16 | 107.2° | 109.5° |
| C22 | C23 | H26 | 109.5° | 109.5° |
| C22 | C23 | H27 | 109.5° | 109.5° |
| C23 | N30 | N27 | 120.0° | 125.0° |
| C23 | N30 | C8 | 126.6° | 125.0° |
| N30 | C23 | H26 | 109.5° | 109.5° |
| N30 | C23 | H27 | 109.5° | 109.4° |
| N30 | N27 | C11 | 105.4° | 109.0° |
| N27 | N30 | C8 | 113.4° | 109.9° |
| N27 | C11 | C4 | 130.8° | 134.6° |
| N27 | C11 | C9 | 109.2° | 106.8° |
| N30 | C8 | C9 | 104.1° | 107.9° |
| N30 | C8 | H5 | 128.0° | 126.1° |
| C4 | C11 | C9 | 120.0° | 118.6° |
| C11 | C4 | C10 | 115.7° | 119.7° |
| C11 | C4 | H17 | 122.2° | 120.2° |
| C11 | C9 | C8 | 107.8° | 106.4° |
| C11 | C9 | C3 | 127.2° | 118.9° |
| C8 | C9 | C3 | 124.9° | 134.7° |
| C9 | C8 | H5 | 127.9° | 126.0° |
| C4 | C10 | C24 | 116.3° | 119.2° |
| C4 | C10 | C13 | 121.9° | 121.7° |
| C10 | C4 | H17 | 122.1° | 120.1° |
| C9 | C3 | C13 | 111.3° | 119.5° |
| C9 | C3 | H3 | 124.3° | 120.2° |
| C24 | C10 | C13 | 121.7° | 119.1° |
| C10 | C24 | C19 | 110.1° | 109.5° |
| C10 | C24 | C18 | 115.0° | 109.4° |
| C10 | C24 | O33 | 109.9° | 109.5° |
| C10 | C13 | C3 | 123.8° | 121.6° |
| C10 | C13 | N31 | 118.1° | 119.2° |
| C19 | C24 | C18 | 108.6° | 109.4° |
| C19 | C24 | O33 | 110.6° | 109.5° |
| C24 | C19 | H6 | 109.5° | 109.5° |
| C24 | C19 | H7 | 109.4° | 109.5° |
| C24 | C19 | H8 | 109.5° | 109.4° |
| C18 | C24 | O33 | 102.4° | 109.5° |
| C24 | C18 | H23 | 109.5° | 109.4° |
| C24 | C18 | H24 | 109.5° | 109.4° |
| C24 | C18 | H25 | 109.5° | 109.5° |
| C3 | C13 | N31 | 118.1° | 119.2° |
| C13 | C3 | H3 | 124.3° | 120.3° |
| C24 | O33 | H29 | 109.5° | 114.0° |
| C13 | N31 | C16 | 126.5° | 120.0° |
| C13 | N31 | H28 | 116.8° | 120.0° |
| N31 | C16 | O32 | 127.9° | 120.1° |
| N31 | C16 | C14 | 112.2° | 120.0° |
| C16 | N31 | H28 | 116.7° | 120.0° |
| O32 | C16 | C14 | 119.9° | 120.0° |
| C16 | C14 | N28 | 120.3° | 126.4° |
| C16 | C14 | C2 | 127.6° | 126.5° |
| N28 | C14 | C2 | 112.2° | 107.1° |
| C14 | N28 | N29 | 103.9° | 110.1° |
| C14 | C2 | C7 | 104.3° | 105.6° |
| C14 | C2 | H2 | 127.8° | 127.2° |
| N28 | N29 | C12 | 120.9° | 124.9° |
| N28 | N29 | C7 | 113.4° | 110.1° |
| C17 | C15 | C5 | 120.7° | 119.6° |
| C17 | C15 | N26 | 115.7° | 119.6° |
| C15 | C17 | H20 | 109.5° | 109.5° |
| C15 | C17 | H21 | 109.4° | 109.5° |
| C15 | C17 | H22 | 109.5° | 109.5° |
| C15 | C5 | C12 | 116.3° | 119.1° |
| C5 | C15 | N26 | 123.6° | 120.8° |
| C15 | C5 | H18 | 121.8° | 120.4° |
| C5 | C12 | N29 | 120.1° | 120.9° |
| C5 | C12 | C1 | 121.8° | 118.3° |
| C12 | C5 | H18 | 121.8° | 120.5° |
| C2 | C7 | N29 | 106.3° | 107.1° |
| C7 | C2 | H2 | 127.8° | 127.2° |
| C2 | C7 | H4 | 126.9° | 126.4° |
| C12 | N29 | C7 | 125.7° | 125.0° |
| N29 | C12 | C1 | 118.0° | 120.9° |
| N29 | C7 | H4 | 126.9° | 126.5° |
| C15 | N26 | C6 | 117.9° | 121.9° |
| C12 | C1 | C6 | 116.8° | 119.1° |
| C12 | C1 | H1 | 121.6° | 120.4° |
| N26 | C6 | C1 | 123.5° | 120.8° |
| N26 | C6 | H19 | 118.3° | 119.6° |
| C6 | C1 | H1 | 121.6° | 120.4° |
| C1 | C6 | H19 | 118.3° | 119.6° |
| H6 | C19 | H7 | 109.5° | 109.5° |
| H6 | C19 | H8 | 109.5° | 109.5° |
| H7 | C19 | H8 | 109.5° | 109.5° |
| H9 | C20 | H10 | 109.5° | 109.5° |
| H9 | C20 | H11 | 109.5° | 109.5° |
| H10 | C20 | H11 | 109.4° | 109.5° |
| H12 | C21 | H13 | 109.5° | 109.4° |
| H12 | C21 | H14 | 109.5° | 109.5° |
| H13 | C21 | H14 | 109.5° | 109.5° |
| H15 | C22 | H16 | 109.5° | 109.5° |
| H20 | C17 | H21 | 109.5° | 109.4° |
| H20 | C17 | H22 | 109.5° | 109.5° |
| H21 | C17 | H22 | 109.5° | 109.4° |
| H23 | C18 | H24 | 109.4° | 109.5° |
| H23 | C18 | H25 | 109.5° | 109.5° |
| H24 | C18 | H25 | 109.5° | 109.5° |
| H26 | C23 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O34 | C25 | C20 | C22 | 121.7° | 120.0° |
| O34 | C25 | C20 | C21 | 114.1° | 120.0° |
| O34 | C25 | C22 | C21 | 114.8° | 120.0° |
| O34 | C25 | C22 | C23 | 95.4° | 65.0° |
| O34 | C25 | C20 | H9 | 180.0° | 180.0° |
| O34 | C25 | C20 | H10 | 60.0° | 60.0° |
| O34 | C25 | C20 | H11 | 60.0° | 60.0° |
| O34 | C25 | C21 | H12 | 180.0° | 180.0° |
| O34 | C25 | C21 | H13 | 60.0° | 60.0° |
| O34 | C25 | C21 | H14 | 60.0° | 60.1° |
| O34 | C25 | C22 | H15 | 25.9° | 55.0° |
| O34 | C25 | C22 | H16 | 143.4° | 175.0° |
| C20 | C25 | C22 | C21 | 125.1° | 120.0° |
| C20 | C25 | C22 | C23 | 24.8° | 175.0° |
| C25 | C20 | H9 | H10 | 120.0° | 120.0° |
| C25 | C20 | H9 | H11 | 120.0° | 120.0° |
| C25 | C20 | H10 | H11 | 120.0° | 120.0° |
| C20 | C25 | C21 | H12 | 65.1° | 60.0° |
| C20 | C25 | C21 | H13 | 174.9° | 179.9° |
| C20 | C25 | C21 | H14 | 54.9° | 60.0° |
| C20 | C25 | C22 | H15 | 146.0° | 65.0° |
| C20 | C25 | C22 | H16 | 96.5° | 55.0° |
| C20 | C25 | O34 | H30 | 180.0° | 60.0° |
| C25 | C22 | C23 | H15 | 121.3° | 120.0° |
| C25 | C22 | C23 | H16 | 121.2° | 120.0° |
| C25 | C22 | C23 | N30 | 179.2° | 180.0° |
| C22 | C25 | C20 | H9 | 58.3° | 60.0° |
| C22 | C25 | C20 | H10 | 178.4° | 180.0° |
| C22 | C25 | C20 | H11 | 61.7° | 60.0° |
| C22 | C25 | C21 | H12 | 62.6° | 60.0° |
| C22 | C25 | C21 | H13 | 57.4° | 60.0° |
| C22 | C25 | C21 | H14 | 177.4° | 180.0° |
| C25 | C22 | H15 | H16 | 116.0° | 120.0° |
| C25 | C22 | C23 | H26 | 59.2° | 60.0° |
| C25 | C22 | C23 | H27 | 60.8° | 60.0° |
| C22 | C25 | O34 | H30 | 54.7° | 180.0° |
| C21 | C25 | C22 | C23 | 149.8° | 55.0° |
| C21 | C25 | C20 | H9 | 65.9° | 60.0° |
| C21 | C25 | C20 | H10 | 54.1° | 60.0° |
| C21 | C25 | C20 | H11 | 174.1° | 180.0° |
| C25 | C21 | H12 | H13 | 120.0° | 120.0° |
| C25 | C21 | H12 | H14 | 120.0° | 120.0° |
| C25 | C21 | H13 | H14 | 120.0° | 120.1° |
| C21 | C25 | C22 | H15 | 88.9° | 175.0° |
| C21 | C25 | C22 | H16 | 28.6° | 65.0° |
| C21 | C25 | O34 | H30 | 62.4° | 60.0° |
| C22 | C23 | N30 | H26 | 119.9° | 120.0° |
| C22 | C23 | N30 | H27 | 120.0° | 120.0° |
| C22 | C23 | N30 | N27 | 77.9° | 54.9° |
| C22 | C23 | N30 | C8 | 100.9° | 125.0° |
| C23 | C22 | H15 | H16 | 116.0° | 120.0° |
| C22 | C23 | H26 | H27 | 120.1° | 120.0° |
| C23 | N30 | N27 | C8 | 179.0° | 179.9° |
| C23 | N30 | N27 | C11 | 180.0° | 180.0° |
| C23 | N30 | C8 | C9 | 179.8° | 179.9° |
| C23 | N30 | C8 | H5 | 0.2° | 0.0° |
| N30 | C23 | C22 | H15 | 59.5° | 60.0° |
| N30 | C23 | C22 | H16 | 57.9° | 60.0° |
| N30 | C23 | H26 | H27 | 120.1° | 120.0° |
| N30 | N27 | C11 | C4 | 178.2° | 179.9° |
| N30 | N27 | C11 | C9 | 0.8° | 0.0° |
| N27 | N30 | C8 | C9 | 0.9° | 0.0° |
| N27 | N30 | C8 | H5 | 179.1° | 179.9° |
| N27 | N30 | C23 | H26 | 162.1° | 174.9° |
| N27 | N30 | C23 | H27 | 42.0° | 65.1° |
| C11 | N27 | N30 | C8 | 1.0° | 0.0° |
| N27 | C11 | C4 | C9 | 177.2° | 179.9° |
| N27 | C11 | C9 | C8 | 0.2° | 0.0° |
| N27 | C11 | C4 | C10 | 177.7° | 179.7° |
| N27 | C11 | C9 | C3 | 178.1° | 179.9° |
| N27 | C11 | C4 | H17 | 2.4° | 0.1° |
| N30 | C8 | C9 | C11 | 0.4° | 0.0° |
| N30 | C8 | C9 | H5 | 180.0° | 180.0° |
| N30 | C8 | C9 | C3 | 178.8° | 179.9° |
| C8 | N30 | C23 | H26 | 19.0° | 5.0° |
| C8 | N30 | C23 | H27 | 139.1° | 115.0° |
| C4 | C11 | C9 | C8 | 178.0° | 179.9° |
| C11 | C4 | C10 | H17 | 180.0° | 179.8° |
| C4 | C11 | C9 | C3 | 0.3° | 0.0° |
| C11 | C4 | C10 | C24 | 179.2° | 180.0° |
| C11 | C4 | C10 | C13 | 0.1° | 0.5° |
| C11 | C9 | C8 | C3 | 178.4° | 179.9° |
| C9 | C11 | C4 | C10 | 0.4° | 0.3° |
| C11 | C9 | C3 | C13 | 0.3° | 0.0° |
| C11 | C9 | C3 | H3 | 179.7° | 179.7° |
| C11 | C9 | C8 | H5 | 179.7° | 180.0° |
| C9 | C11 | C4 | H17 | 179.6° | 180.0° |
| C8 | C9 | C3 | C13 | 178.4° | 179.9° |
| C8 | C9 | C3 | H3 | 1.6° | 0.4° |
| C4 | C10 | C24 | C13 | 179.3° | 179.5° |
| C4 | C10 | C24 | C19 | 101.7° | 1.4° |
| C4 | C10 | C24 | C18 | 21.3° | 118.5° |
| C4 | C10 | C13 | C3 | 0.8° | 0.5° |
| C4 | C10 | C24 | O33 | 136.2° | 121.5° |
| C4 | C10 | C13 | N31 | 179.8° | 179.4° |
| C9 | C3 | C13 | C10 | 0.8° | 0.2° |
| C9 | C3 | C13 | H3 | 180.0° | 179.7° |
| C9 | C3 | C13 | N31 | 179.8° | 179.7° |
| C3 | C9 | C8 | H5 | 1.2° | 0.1° |
| C10 | C24 | C19 | C18 | 126.7° | 119.9° |
| C10 | C24 | C19 | O33 | 121.6° | 120.0° |
| C10 | C24 | C18 | O33 | 119.1° | 120.0° |
| C24 | C10 | C13 | C3 | 178.5° | 180.0° |
| C24 | C10 | C13 | N31 | 0.6° | 0.1° |
| C10 | C24 | C19 | H6 | 180.0° | 57.5° |
| C10 | C24 | C19 | H7 | 60.0° | 177.6° |
| C10 | C24 | C19 | H8 | 60.0° | 62.5° |
| C24 | C10 | C4 | H17 | 0.8° | 0.2° |
| C10 | C24 | C18 | H23 | 180.0° | 66.0° |
| C10 | C24 | C18 | H24 | 60.0° | 174.0° |
| C10 | C24 | C18 | H25 | 60.0° | 54.0° |
| C10 | C24 | O33 | H29 | 180.0° | 60.1° |
| C13 | C10 | C24 | C19 | 79.0° | 179.1° |
| C13 | C10 | C24 | C18 | 157.9° | 61.0° |
| C10 | C13 | C3 | N31 | 179.0° | 179.9° |
| C13 | C10 | C24 | O33 | 43.0° | 59.0° |
| C10 | C13 | N31 | C16 | 165.1° | 146.7° |
| C10 | C13 | C3 | H3 | 179.2° | 180.0° |
| C13 | C10 | C4 | H17 | 179.9° | 179.7° |
| C10 | C13 | N31 | H28 | 14.9° | 33.4° |
| C19 | C24 | C18 | O33 | 117.0° | 120.0° |
| C24 | C19 | H6 | H7 | 120.0° | 120.1° |
| C24 | C19 | H6 | H8 | 120.0° | 119.9° |
| C24 | C19 | H7 | H8 | 120.0° | 119.9° |
| C19 | C24 | C18 | H23 | 56.1° | 174.1° |
| C19 | C24 | C18 | H24 | 63.9° | 54.1° |
| C19 | C24 | C18 | H25 | 176.1° | 65.9° |
| C19 | C24 | O33 | H29 | 58.2° | 59.9° |
| C18 | C24 | C19 | H6 | 53.3° | 62.4° |
| C18 | C24 | C19 | H7 | 173.3° | 57.7° |
| C18 | C24 | C19 | H8 | 66.7° | 177.6° |
| C24 | C18 | H23 | H24 | 120.0° | 119.9° |
| C24 | C18 | H23 | H25 | 120.0° | 120.0° |
| C24 | C18 | H24 | H25 | 120.0° | 120.0° |
| C18 | C24 | O33 | H29 | 57.3° | 179.9° |
| C3 | C13 | N31 | C16 | 15.8° | 33.3° |
| C3 | C13 | N31 | H28 | 164.2° | 146.7° |
| O33 | C24 | C19 | H6 | 58.4° | 177.5° |
| O33 | C24 | C19 | H7 | 61.6° | 62.4° |
| O33 | C24 | C19 | H8 | 178.4° | 57.6° |
| O33 | C24 | C18 | H23 | 60.9° | 54.0° |
| O33 | C24 | C18 | H24 | 179.1° | 65.9° |
| O33 | C24 | C18 | H25 | 59.1° | 174.0° |
| C13 | N31 | C16 | H28 | 180.0° | 180.0° |
| C13 | N31 | C16 | O32 | 7.2° | 4.9° |
| C13 | N31 | C16 | C14 | 175.9° | 175.1° |
| N31 | C13 | C3 | H3 | 0.1° | 0.1° |
| N31 | C16 | O32 | C14 | 176.8° | 180.0° |
| N31 | C16 | C14 | N28 | 17.7° | 0.0° |
| N31 | C16 | C14 | C2 | 161.6° | 179.7° |
| O32 | C16 | C14 | N28 | 165.1° | 180.0° |
| O32 | C16 | C14 | C2 | 15.7° | 0.4° |
| O32 | C16 | N31 | H28 | 172.8° | 175.1° |
| C16 | C14 | N28 | C2 | 179.4° | 179.7° |
| C16 | C14 | N28 | N29 | 179.5° | 180.0° |
| C16 | C14 | C2 | C7 | 179.5° | 179.8° |
| C16 | C14 | C2 | H2 | 0.5° | 0.0° |
| C14 | C16 | N31 | H28 | 4.1° | 5.0° |
| N28 | C14 | C2 | C7 | 0.1° | 0.0° |
| C14 | N28 | N29 | C12 | 177.6° | 180.0° |
| C14 | N28 | N29 | C7 | 0.0° | 0.4° |
| N28 | C14 | C2 | H2 | 179.9° | 179.7° |
| C2 | C14 | N28 | N29 | 0.1° | 0.3° |
| C14 | C2 | C7 | H2 | 180.0° | 179.8° |
| C14 | C2 | C7 | N29 | 0.1° | 0.2° |
| C14 | C2 | C7 | H4 | 179.9° | 179.8° |
| N28 | N29 | C12 | C5 | 0.0° | 5.5° |
| N28 | N29 | C7 | C2 | 0.0° | 0.4° |
| N28 | N29 | C12 | C7 | 177.3° | 179.5° |
| N28 | N29 | C12 | C1 | 178.8° | 174.5° |
| N28 | N29 | C7 | H4 | 180.0° | 179.6° |
| C17 | C15 | C5 | N26 | 179.7° | 179.5° |
| C17 | C15 | C5 | C12 | 179.6° | 179.7° |
| C17 | C15 | N26 | C6 | 179.7° | 180.0° |
| C17 | C15 | C5 | H18 | 0.4° | 0.2° |
| C15 | C17 | H20 | H21 | 120.0° | 120.0° |
| C15 | C17 | H20 | H22 | 120.0° | 120.1° |
| C15 | C17 | H21 | H22 | 120.0° | 120.0° |
| C15 | C5 | C12 | H18 | 180.0° | 180.0° |
| C15 | C5 | C12 | N29 | 178.8° | 180.0° |
| C15 | C5 | C12 | C1 | 0.0° | 0.0° |
| C5 | C15 | N26 | C6 | 0.6° | 0.5° |
| C5 | C15 | C17 | H20 | 179.7° | 89.5° |
| C5 | C15 | C17 | H21 | 59.7° | 30.5° |
| C5 | C15 | C17 | H22 | 60.3° | 150.5° |
| C5 | C12 | N29 | C1 | 178.8° | 180.0° |
| C5 | C12 | N29 | C7 | 177.4° | 174.9° |
| C12 | C5 | C15 | N26 | 0.7° | 0.2° |
| C5 | C12 | C1 | C6 | 0.7° | 0.0° |
| C5 | C12 | C1 | H1 | 179.3° | 179.7° |
| C2 | C7 | N29 | C12 | 177.6° | 180.0° |
| C2 | C7 | N29 | H4 | 180.0° | 180.0° |
| N29 | C12 | C1 | C6 | 178.1° | 180.0° |
| N29 | C12 | C1 | H1 | 1.8° | 0.3° |
| C12 | N29 | C7 | H4 | 2.5° | 0.0° |
| N29 | C12 | C5 | H18 | 1.2° | 0.1° |
| C7 | N29 | C12 | C1 | 1.5° | 5.0° |
| N29 | C7 | C2 | H2 | 179.9° | 180.0° |
| C15 | N26 | C6 | C1 | 0.2° | 0.5° |
| N26 | C15 | C5 | H18 | 179.3° | 179.7° |
| C15 | N26 | C6 | H19 | 179.8° | 179.5° |
| N26 | C15 | C17 | H20 | 0.0° | 90.0° |
| N26 | C15 | C17 | H21 | 120.0° | 150.0° |
| N26 | C15 | C17 | H22 | 120.0° | 30.1° |
| C12 | C1 | C6 | N26 | 0.8° | 0.2° |
| C12 | C1 | C6 | H1 | 180.0° | 179.7° |
| C1 | C12 | C5 | H18 | 180.0° | 180.0° |
| C12 | C1 | C6 | H19 | 179.2° | 179.7° |
| N26 | C6 | C1 | H19 | 180.0° | 180.0° |
| N26 | C6 | C1 | H1 | 179.2° | 179.9° |
| H1 | C1 | C6 | H19 | 0.8° | 0.1° |
| H2 | C2 | C7 | H4 | 0.1° | 0.0° |
| H6 | C19 | H7 | H8 | 120.0° | 120.0° |
| H9 | C20 | H10 | H11 | 120.0° | 120.0° |
| H12 | C21 | H13 | H14 | 120.0° | 120.0° |
| H15 | C22 | C23 | H26 | 179.5° | 60.0° |
| H15 | C22 | C23 | H27 | 60.4° | NaN° |
| H16 | C22 | C23 | H26 | 62.0° | NaN° |
| H16 | C22 | C23 | H27 | 177.9° | 60.0° |
| H20 | C17 | H21 | H22 | 120.0° | 120.0° |
| H23 | C18 | H24 | H25 | 120.0° | 120.0° |
