O7T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C46 | C47 | doub | 1.38Å | 1.40Å | Aromatic |
| C46 | C45 | sing | 1.38Å | 1.40Å | Aromatic |
| C47 | C42 | sing | 1.40Å | 1.40Å | Aromatic |
| C45 | C44 | doub | 1.38Å | 1.40Å | Aromatic |
| N40 | C35 | sing | 1.36Å | 1.38Å | Aromatic |
| N40 | C41 | doub | 1.31Å | 1.31Å | Aromatic |
| C36 | C35 | doub | 1.40Å | 1.41Å | Aromatic |
| C36 | C37 | sing | 1.37Å | 1.41Å | Aromatic |
| C42 | C41 | sing | 1.48Å | 1.46Å | |
| C42 | C43 | doub | 1.40Å | 1.40Å | Aromatic |
| C35 | C34 | sing | 1.41Å | 1.39Å | Aromatic |
| C41 | N33 | sing | 1.37Å | 1.38Å | Aromatic |
| C37 | C38 | doub | 1.39Å | 1.40Å | Aromatic |
| C44 | C43 | sing | 1.38Å | 1.40Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.41Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.40Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.41Å | Aromatic |
| C34 | N33 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | C39 | doub | 1.39Å | 1.41Å | Aromatic |
| N33 | C25 | sing | 1.47Å | 1.46Å | |
| C38 | C39 | sing | 1.38Å | 1.40Å | Aromatic |
| C24 | C19 | doub | 1.38Å | 1.41Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C32 | C31 | sing | 1.53Å | 1.53Å | |
| C32 | C27 | sing | 1.53Å | 1.55Å | |
| C19 | C18 | sing | 1.51Å | 1.50Å | |
| C25 | C27 | sing | 1.53Å | 1.52Å | |
| C25 | C1 | sing | 1.53Å | 1.54Å | |
| C31 | N30 | sing | 1.47Å | 1.48Å | |
| C18 | N17 | sing | 1.47Å | 1.45Å | |
| C27 | C28 | sing | 1.53Å | 1.55Å | |
| C1 | O2 | sing | 1.43Å | 1.44Å | |
| N30 | C29 | sing | 1.47Å | 1.49Å | |
| O2 | C3 | sing | 1.36Å | 1.41Å | |
| N17 | C16 | sing | 1.38Å | 1.38Å | Aromatic |
| N17 | C9 | sing | 1.37Å | 1.37Å | Aromatic |
| C3 | C4 | doub | 1.39Å | 1.40Å | Aromatic |
| C3 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
| C15 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C28 | C29 | sing | 1.53Å | 1.54Å | |
| C4 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C7 | doub | 1.38Å | 1.41Å | Aromatic |
| C5 | C6 | doub | 1.40Å | 1.40Å | Aromatic |
| C7 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C16 | C11 | sing | 1.41Å | 1.40Å | Aromatic |
| C6 | C9 | sing | 1.48Å | 1.45Å | |
| C9 | N10 | doub | 1.31Å | 1.32Å | Aromatic |
| C14 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | N10 | sing | 1.36Å | 1.38Å | Aromatic |
| C11 | C12 | doub | 1.40Å | 1.41Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.41Å | Aromatic |
| C45 | H1 | sing | 1.08Å | 1.08Å | |
| C22 | H2 | sing | 1.08Å | 1.08Å | |
| C44 | H3 | sing | 1.08Å | 1.08Å | |
| C46 | H4 | sing | 1.08Å | 1.08Å | |
| C21 | H5 | sing | 1.08Å | 1.08Å | |
| C23 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C37 | H8 | sing | 1.08Å | 1.08Å | |
| C14 | H9 | sing | 1.08Å | 1.08Å | |
| C38 | H10 | sing | 1.08Å | 1.08Å | |
| C43 | H11 | sing | 1.08Å | 1.08Å | |
| C47 | H12 | sing | 1.08Å | 1.08Å | |
| C5 | H13 | sing | 1.08Å | 1.08Å | |
| C7 | H14 | sing | 1.08Å | 1.08Å | |
| C20 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H16 | sing | 1.08Å | 1.08Å | |
| C12 | H17 | sing | 1.08Å | 1.08Å | |
| C36 | H18 | sing | 1.08Å | 1.08Å | |
| C15 | H19 | sing | 1.08Å | 1.08Å | |
| C39 | H20 | sing | 1.08Å | 1.08Å | |
| C4 | H21 | sing | 1.08Å | 1.08Å | |
| C8 | H22 | sing | 1.08Å | 1.08Å | |
| C28 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C32 | H25 | sing | 1.09Å | 1.10Å | |
| C32 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| C31 | H29 | sing | 1.09Å | 1.10Å | |
| C31 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C18 | H32 | sing | 1.09Å | 1.10Å | |
| C18 | H33 | sing | 1.09Å | 1.10Å | |
| C1 | H34 | sing | 1.09Å | 1.10Å | |
| C1 | H35 | sing | 1.09Å | 1.10Å | |
| C25 | H36 | sing | 1.09Å | 1.10Å | |
| N30 | H37 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C47 | C46 | C45 | 119.8° | 120.1° |
| C46 | C47 | C42 | 121.4° | 119.9° |
| C47 | C46 | H4 | 120.1° | 119.9° |
| C46 | C47 | H12 | 119.3° | 120.1° |
| C46 | C45 | C44 | 119.5° | 120.3° |
| C46 | C45 | H1 | 120.2° | 119.8° |
| C45 | C46 | H4 | 120.1° | 120.0° |
| C47 | C42 | C41 | 118.3° | 120.1° |
| C47 | C42 | C43 | 118.2° | 119.7° |
| C42 | C47 | H12 | 119.3° | 120.0° |
| C45 | C44 | C43 | 120.2° | 120.2° |
| C44 | C45 | H1 | 120.3° | 119.9° |
| C45 | C44 | H3 | 119.9° | 119.9° |
| C35 | N40 | C41 | 106.3° | 109.6° |
| N40 | C35 | C36 | 130.2° | 133.4° |
| N40 | C35 | C34 | 111.0° | 107.2° |
| N40 | C41 | C42 | 121.0° | 125.1° |
| N40 | C41 | N33 | 110.4° | 109.9° |
| C35 | C36 | C37 | 119.8° | 119.8° |
| C36 | C35 | C34 | 118.8° | 119.5° |
| C35 | C36 | H18 | 120.1° | 120.0° |
| C36 | C37 | C38 | 120.8° | 120.7° |
| C36 | C37 | H8 | 119.6° | 119.6° |
| C37 | C36 | H18 | 120.1° | 120.1° |
| C41 | C42 | C43 | 123.5° | 120.2° |
| C42 | C41 | N33 | 128.3° | 125.1° |
| C42 | C43 | C44 | 120.9° | 119.9° |
| C42 | C43 | H11 | 119.6° | 120.0° |
| C35 | C34 | N33 | 103.5° | 106.2° |
| C35 | C34 | C39 | 121.9° | 119.8° |
| C41 | N33 | C34 | 108.7° | 107.2° |
| C41 | N33 | C25 | 125.0° | 126.4° |
| C37 | C38 | C39 | 119.6° | 120.5° |
| C38 | C37 | H8 | 119.6° | 119.7° |
| C37 | C38 | H10 | 120.2° | 119.7° |
| C43 | C44 | H3 | 119.9° | 120.0° |
| C44 | C43 | H11 | 119.5° | 120.1° |
| C23 | C22 | C21 | 119.4° | 120.0° |
| C22 | C23 | C24 | 120.4° | 120.0° |
| C23 | C22 | H2 | 120.3° | 120.0° |
| C22 | C23 | H6 | 119.8° | 120.0° |
| C22 | C21 | C20 | 119.8° | 120.0° |
| C21 | C22 | H2 | 120.3° | 120.0° |
| C22 | C21 | H5 | 120.1° | 120.0° |
| C23 | C24 | C19 | 120.6° | 120.0° |
| C24 | C23 | H6 | 119.8° | 120.0° |
| C23 | C24 | H16 | 119.7° | 120.0° |
| C21 | C20 | C19 | 121.5° | 120.0° |
| C20 | C21 | H5 | 120.1° | 119.9° |
| C21 | C20 | H15 | 119.2° | 120.0° |
| N33 | C34 | C39 | 134.6° | 134.0° |
| C34 | N33 | C25 | 125.6° | 126.4° |
| C34 | C39 | C38 | 119.0° | 119.7° |
| C34 | C39 | H20 | 120.5° | 120.1° |
| N33 | C25 | C27 | 113.5° | 109.5° |
| N33 | C25 | C1 | 107.3° | 109.5° |
| N33 | C25 | H36 | 106.7° | 109.4° |
| C39 | C38 | H10 | 120.2° | 119.8° |
| C38 | C39 | H20 | 120.5° | 120.1° |
| C24 | C19 | C20 | 118.4° | 120.0° |
| C24 | C19 | C18 | 120.6° | 120.0° |
| C19 | C24 | H16 | 119.7° | 120.0° |
| C20 | C19 | C18 | 121.0° | 120.0° |
| C19 | C20 | H15 | 119.3° | 120.0° |
| C31 | C32 | C27 | 111.0° | 109.3° |
| C32 | C31 | N30 | 110.9° | 109.5° |
| C31 | C32 | H25 | 109.1° | 109.5° |
| C31 | C32 | H26 | 109.1° | 109.5° |
| C32 | C31 | H29 | 109.1° | 109.5° |
| C32 | C31 | H30 | 109.1° | 109.4° |
| C32 | C27 | C25 | 109.3° | 109.6° |
| C32 | C27 | C28 | 111.6° | 109.2° |
| C27 | C32 | H25 | 109.1° | 109.5° |
| C27 | C32 | H26 | 109.1° | 109.5° |
| C32 | C27 | H31 | 107.4° | 109.5° |
| C19 | C18 | N17 | 111.0° | 109.4° |
| C19 | C18 | H32 | 109.1° | 109.4° |
| C19 | C18 | H33 | 109.1° | 109.5° |
| C27 | C25 | C1 | 116.7° | 109.5° |
| C25 | C27 | C28 | 113.1° | 109.5° |
| C25 | C27 | H31 | 107.8° | 109.5° |
| C27 | C25 | H36 | 106.1° | 109.5° |
| C25 | C1 | O2 | 110.3° | 109.5° |
| C25 | C1 | H34 | 109.3° | 109.5° |
| C25 | C1 | H35 | 109.2° | 109.5° |
| C1 | C25 | H36 | 105.9° | 109.5° |
| C31 | N30 | C29 | 112.9° | 111.2° |
| N30 | C31 | H29 | 109.1° | 109.5° |
| N30 | C31 | H30 | 109.1° | 109.5° |
| C31 | N30 | H37 | 108.6° | 111.0° |
| C18 | N17 | C16 | 124.7° | 126.4° |
| C18 | N17 | C9 | 127.2° | 126.4° |
| N17 | C18 | H32 | 109.1° | 109.5° |
| N17 | C18 | H33 | 109.1° | 109.5° |
| C27 | C28 | C29 | 111.2° | 109.3° |
| C27 | C28 | H23 | 109.0° | 109.5° |
| C27 | C28 | H24 | 109.0° | 109.5° |
| C28 | C27 | H31 | 107.4° | 109.5° |
| C1 | O2 | C3 | 114.2° | 117.0° |
| O2 | C1 | H34 | 109.2° | 109.4° |
| O2 | C1 | H35 | 109.3° | 109.4° |
| N30 | C29 | C28 | 110.3° | 109.5° |
| N30 | C29 | H27 | 109.3° | 109.5° |
| N30 | C29 | H28 | 109.3° | 109.5° |
| C29 | N30 | H37 | 108.6° | 111.0° |
| O2 | C3 | C4 | 115.7° | 120.0° |
| O2 | C3 | C8 | 124.9° | 119.9° |
| C16 | N17 | C9 | 108.0° | 107.2° |
| N17 | C16 | C15 | 133.1° | 133.8° |
| N17 | C16 | C11 | 104.6° | 106.2° |
| N17 | C9 | C6 | 125.6° | 125.1° |
| N17 | C9 | N10 | 111.1° | 109.8° |
| C4 | C3 | C8 | 119.4° | 120.1° |
| C3 | C4 | C5 | 120.5° | 120.1° |
| C3 | C4 | H21 | 119.8° | 119.9° |
| C3 | C8 | C7 | 120.3° | 120.1° |
| C3 | C8 | H22 | 119.8° | 119.9° |
| C16 | C15 | C14 | 117.3° | 119.8° |
| C15 | C16 | C11 | 122.3° | 120.0° |
| C16 | C15 | H19 | 121.4° | 120.1° |
| C15 | C14 | C13 | 121.7° | 120.5° |
| C15 | C14 | H9 | 119.1° | 119.7° |
| C14 | C15 | H19 | 121.4° | 120.0° |
| C29 | C28 | H23 | 109.0° | 109.5° |
| C29 | C28 | H24 | 109.0° | 109.5° |
| C28 | C29 | H27 | 109.3° | 109.4° |
| C28 | C29 | H28 | 109.2° | 109.5° |
| C4 | C5 | C6 | 120.1° | 119.9° |
| C4 | C5 | H13 | 120.0° | 120.1° |
| C5 | C4 | H21 | 119.8° | 119.9° |
| C8 | C7 | C6 | 119.6° | 119.9° |
| C8 | C7 | H14 | 120.2° | 120.1° |
| C7 | C8 | H22 | 119.8° | 120.0° |
| C5 | C6 | C7 | 120.1° | 119.8° |
| C5 | C6 | C9 | 119.0° | 120.1° |
| C6 | C5 | H13 | 119.9° | 120.0° |
| C7 | C6 | C9 | 120.9° | 120.1° |
| C6 | C7 | H14 | 120.2° | 120.0° |
| C16 | C11 | N10 | 110.0° | 107.2° |
| C16 | C11 | C12 | 119.9° | 119.4° |
| C6 | C9 | N10 | 123.3° | 125.1° |
| C9 | N10 | C11 | 106.2° | 109.6° |
| C14 | C13 | C12 | 120.0° | 120.5° |
| C14 | C13 | H7 | 120.0° | 119.7° |
| C13 | C14 | H9 | 119.1° | 119.8° |
| N10 | C11 | C12 | 130.0° | 133.4° |
| C11 | C12 | C13 | 118.7° | 119.8° |
| C11 | C12 | H17 | 120.6° | 120.1° |
| C12 | C13 | H7 | 120.0° | 119.7° |
| C13 | C12 | H17 | 120.6° | 120.1° |
| H23 | C28 | H24 | 109.5° | 109.5° |
| H25 | C32 | H26 | 109.5° | 109.5° |
| H27 | C29 | H28 | 109.5° | 109.4° |
| H29 | C31 | H30 | 109.5° | 109.5° |
| H32 | C18 | H33 | 109.5° | 109.5° |
| H34 | C1 | H35 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C47 | C46 | C45 | H4 | 180.0° | 179.9° |
| C46 | C47 | C42 | H12 | 180.0° | 179.4° |
| C47 | C46 | C45 | C44 | 1.1° | 0.1° |
| C46 | C47 | C42 | C41 | 177.4° | 180.0° |
| C46 | C47 | C42 | C43 | 0.7° | 0.9° |
| C47 | C46 | C45 | H1 | 178.8° | 179.7° |
| C45 | C46 | C47 | C42 | 0.0° | 0.6° |
| C46 | C45 | C44 | H1 | 180.0° | 179.8° |
| C46 | C45 | C44 | C43 | 1.6° | 0.3° |
| C46 | C45 | C44 | H3 | 178.4° | 179.8° |
| C45 | C46 | C47 | H12 | 180.0° | 180.0° |
| C47 | C42 | C41 | N40 | 11.1° | 22.2° |
| C47 | C42 | C41 | C43 | 178.0° | 179.1° |
| C47 | C42 | C41 | N33 | 163.5° | 157.8° |
| C47 | C42 | C43 | C44 | 0.2° | 0.5° |
| C42 | C47 | C46 | H4 | 180.0° | 179.5° |
| C47 | C42 | C43 | H11 | 179.8° | 179.4° |
| C45 | C44 | C43 | C42 | 0.9° | 0.0° |
| C45 | C44 | C43 | H3 | 180.0° | 179.9° |
| C44 | C45 | C46 | H4 | 178.9° | 180.0° |
| C45 | C44 | C43 | H11 | 179.1° | 180.0° |
| N40 | C35 | C36 | C34 | 178.7° | 179.5° |
| N40 | C35 | C36 | C37 | 179.9° | 180.0° |
| C35 | N40 | C41 | C42 | 174.9° | 179.7° |
| C35 | N40 | C41 | N33 | 0.5° | 0.3° |
| N40 | C35 | C34 | N33 | 1.2° | 0.4° |
| N40 | C35 | C34 | C39 | 178.5° | 179.7° |
| N40 | C35 | C36 | H18 | 0.1° | 0.1° |
| C41 | N40 | C35 | C36 | 179.3° | 180.0° |
| N40 | C41 | C42 | N33 | 174.6° | 179.9° |
| N40 | C41 | C42 | C43 | 170.9° | 156.9° |
| C41 | N40 | C35 | C34 | 0.5° | 0.5° |
| N40 | C41 | N33 | C34 | 1.3° | 0.1° |
| N40 | C41 | N33 | C25 | 169.9° | 179.7° |
| C35 | C36 | C37 | H18 | 180.0° | 180.0° |
| C35 | C36 | C37 | C38 | 2.1° | 0.1° |
| C36 | C35 | C34 | N33 | 179.8° | 180.0° |
| C36 | C35 | C34 | C39 | 0.5° | 0.8° |
| C35 | C36 | C37 | H8 | 177.9° | 179.8° |
| C37 | C36 | C35 | C34 | 1.4° | 0.5° |
| C36 | C37 | C38 | H8 | 180.0° | 179.9° |
| C36 | C37 | C38 | C39 | 0.9° | 0.2° |
| C36 | C37 | C38 | H10 | 179.0° | 179.8° |
| C41 | C42 | C43 | C44 | 177.7° | 179.7° |
| C42 | C41 | N33 | C34 | 173.7° | 180.0° |
| C42 | C41 | N33 | C25 | 15.0° | 0.2° |
| C41 | C42 | C43 | H11 | 2.2° | 0.3° |
| C41 | C42 | C47 | H12 | 2.6° | 0.6° |
| C43 | C42 | C41 | N33 | 14.5° | 23.0° |
| C42 | C43 | C44 | H11 | 180.0° | 180.0° |
| C42 | C43 | C44 | H3 | 179.1° | 180.0° |
| C43 | C42 | C47 | H12 | 179.3° | 179.8° |
| C35 | C34 | N33 | C41 | 1.5° | 0.2° |
| C35 | C34 | N33 | C39 | 179.6° | 179.1° |
| C35 | C34 | N33 | C25 | 169.7° | 180.0° |
| C35 | C34 | C39 | C38 | 1.6° | 0.5° |
| C34 | C35 | C36 | H18 | 178.6° | 179.5° |
| C35 | C34 | C39 | H20 | 178.4° | 179.6° |
| C41 | N33 | C34 | C25 | 171.2° | 179.8° |
| C41 | N33 | C34 | C39 | 178.1° | 179.3° |
| C41 | N33 | C25 | C27 | 129.3° | 173.3° |
| C41 | N33 | C25 | C1 | 100.2° | 66.7° |
| C41 | N33 | C25 | H36 | 12.8° | 53.3° |
| C37 | C38 | C39 | C34 | 0.9° | 0.0° |
| C37 | C38 | C39 | H10 | 180.0° | 180.0° |
| C38 | C37 | C36 | H18 | 177.9° | 180.0° |
| C37 | C38 | C39 | H20 | 179.1° | 179.9° |
| C43 | C44 | C45 | H1 | 178.4° | 180.0° |
| C23 | C22 | C21 | H2 | 180.0° | 179.6° |
| C22 | C23 | C24 | H6 | 180.0° | 179.9° |
| C23 | C22 | C21 | C20 | 0.2° | 0.1° |
| C22 | C23 | C24 | C19 | 1.1° | 0.1° |
| C23 | C22 | C21 | H5 | 179.9° | 180.0° |
| C22 | C23 | C24 | H16 | 178.9° | 179.9° |
| C21 | C22 | C23 | C24 | 0.7° | 0.2° |
| C22 | C21 | C20 | H5 | 180.0° | 179.8° |
| C22 | C21 | C20 | C19 | 0.0° | 0.1° |
| C21 | C22 | C23 | H6 | 179.3° | 179.9° |
| C22 | C21 | C20 | H15 | 180.0° | 179.9° |
| C23 | C24 | C19 | H16 | 180.0° | 180.0° |
| C23 | C24 | C19 | C20 | 0.9° | 0.1° |
| C23 | C24 | C19 | C18 | 179.2° | 180.0° |
| C24 | C23 | C22 | H2 | 179.3° | 179.7° |
| C21 | C20 | C19 | C24 | 0.4° | 0.0° |
| C21 | C20 | C19 | H15 | 180.0° | 180.0° |
| C21 | C20 | C19 | C18 | 178.7° | 180.0° |
| C20 | C21 | C22 | H2 | 179.8° | 179.7° |
| N33 | C34 | C39 | C38 | 178.8° | 179.5° |
| C34 | N33 | C25 | C27 | 60.8° | 6.5° |
| C34 | N33 | C25 | C1 | 69.6° | 113.5° |
| N33 | C34 | C39 | H20 | 1.2° | 0.6° |
| C34 | N33 | C25 | H36 | 177.3° | 126.5° |
| C39 | C34 | N33 | C25 | 10.7° | 0.9° |
| C34 | C39 | C38 | H20 | 180.0° | 179.9° |
| C34 | C39 | C38 | H10 | 179.1° | 180.0° |
| N33 | C25 | C27 | C32 | 53.9° | 66.0° |
| N33 | C25 | C27 | C1 | 125.6° | 120.0° |
| N33 | C25 | C27 | H36 | 116.8° | 120.0° |
| N33 | C25 | C1 | H36 | 113.6° | 120.0° |
| N33 | C25 | C27 | C28 | 178.8° | 174.3° |
| N33 | C25 | C1 | O2 | 80.7° | 55.7° |
| N33 | C25 | C27 | H31 | 62.6° | 54.2° |
| N33 | C25 | C1 | H34 | 39.4° | 64.3° |
| N33 | C25 | C1 | H35 | 159.1° | 175.6° |
| C39 | C38 | C37 | H8 | 179.1° | 180.0° |
| C24 | C19 | C20 | C18 | 178.3° | 179.9° |
| C24 | C19 | C18 | N17 | 102.6° | 85.1° |
| C19 | C24 | C23 | H6 | 179.0° | 180.0° |
| C24 | C19 | C20 | H15 | 179.6° | 180.0° |
| C24 | C19 | C18 | H32 | 137.2° | 34.9° |
| C24 | C19 | C18 | H33 | 17.6° | 154.9° |
| C20 | C19 | C18 | N17 | 79.1° | 95.0° |
| C19 | C20 | C21 | H5 | 180.0° | 179.9° |
| C20 | C19 | C24 | H16 | 179.1° | 180.0° |
| C20 | C19 | C18 | H32 | 41.2° | 145.1° |
| C20 | C19 | C18 | H33 | 160.7° | 25.0° |
| C31 | C32 | C27 | H25 | 120.3° | 119.9° |
| C31 | C32 | C27 | H26 | 120.2° | 120.0° |
| C31 | C32 | C27 | C25 | 176.8° | 177.6° |
| C32 | C31 | N30 | H29 | 120.2° | 120.0° |
| C32 | C31 | N30 | H30 | 120.2° | 120.0° |
| C31 | C32 | C27 | C28 | 51.0° | 57.6° |
| C32 | C31 | N30 | C29 | 59.9° | 61.7° |
| C31 | C32 | H25 | H26 | 119.3° | 120.0° |
| C32 | C31 | H29 | H30 | 119.3° | 120.0° |
| C31 | C32 | C27 | H31 | 66.5° | 62.3° |
| C32 | C31 | N30 | H37 | 60.6° | 62.4° |
| C32 | C27 | C25 | C28 | 124.9° | 119.7° |
| C32 | C27 | C25 | H31 | 116.5° | 120.2° |
| C32 | C27 | C25 | C1 | 179.4° | 174.0° |
| C27 | C32 | C31 | N30 | 54.7° | 59.2° |
| C32 | C27 | C28 | H31 | 117.5° | 119.9° |
| C32 | C27 | C28 | C29 | 51.0° | 57.6° |
| C32 | C27 | C28 | H23 | 171.3° | 62.3° |
| C32 | C27 | C28 | H24 | 69.3° | 177.6° |
| C27 | C32 | H25 | H26 | 119.3° | 120.1° |
| C27 | C32 | C31 | H29 | 174.9° | 179.2° |
| C27 | C32 | C31 | H30 | 65.6° | 60.8° |
| C32 | C27 | C25 | H36 | 63.0° | 54.0° |
| C19 | C18 | N17 | H32 | 120.2° | 119.9° |
| C19 | C18 | N17 | H33 | 120.2° | 120.0° |
| C19 | C18 | N17 | C16 | 96.3° | 87.0° |
| C19 | C18 | N17 | C9 | 80.7° | 92.3° |
| C18 | C19 | C20 | H15 | 1.3° | 0.0° |
| C18 | C19 | C24 | H16 | 0.8° | 0.1° |
| C19 | C18 | H32 | H33 | 119.3° | 120.0° |
| C27 | C25 | C1 | H36 | 117.7° | 120.0° |
| C25 | C27 | C28 | H31 | 118.8° | 120.1° |
| C27 | C25 | C1 | O2 | 47.9° | 64.3° |
| C25 | C27 | C28 | C29 | 174.7° | 177.6° |
| C25 | C27 | C28 | H23 | 65.1° | 57.6° |
| C25 | C27 | C28 | H24 | 54.4° | 62.4° |
| C25 | C27 | C32 | H25 | 63.0° | 62.5° |
| C25 | C27 | C32 | H26 | 56.6° | 57.6° |
| C27 | C25 | C1 | H34 | 168.0° | 175.7° |
| C27 | C25 | C1 | H35 | 72.2° | 55.6° |
| C1 | C25 | C27 | C28 | 55.7° | 54.3° |
| C25 | C1 | O2 | H34 | 120.1° | 120.0° |
| C25 | C1 | O2 | H35 | 120.1° | 120.0° |
| C25 | C1 | O2 | C3 | 145.1° | 179.9° |
| C1 | C25 | C27 | H31 | 62.9° | 65.8° |
| C25 | C1 | H34 | H35 | 119.6° | 120.1° |
| C31 | N30 | C29 | H37 | 120.5° | 124.1° |
| C31 | N30 | C29 | C28 | 59.4° | 61.7° |
| N30 | C31 | C32 | H25 | 174.9° | 179.1° |
| N30 | C31 | C32 | H26 | 65.6° | 60.8° |
| C31 | N30 | C29 | H27 | 179.5° | 58.3° |
| C31 | N30 | C29 | H28 | 60.8° | 178.2° |
| N30 | C31 | H29 | H30 | 119.3° | 120.0° |
| C18 | N17 | C16 | C9 | 177.5° | 179.5° |
| C18 | N17 | C16 | C15 | 6.3° | 0.0° |
| C18 | N17 | C16 | C11 | 176.0° | 179.8° |
| C18 | N17 | C9 | C6 | 5.0° | 0.6° |
| C18 | N17 | C9 | N10 | 175.4° | 179.9° |
| N17 | C18 | H32 | H33 | 119.3° | 120.0° |
| C27 | C28 | C29 | N30 | 54.2° | 59.1° |
| C27 | C28 | C29 | H23 | 120.3° | 120.0° |
| C27 | C28 | C29 | H24 | 120.3° | 120.0° |
| C27 | C28 | H23 | H24 | 119.2° | 120.1° |
| C28 | C27 | C32 | H25 | 171.3° | 177.6° |
| C28 | C27 | C32 | H26 | 69.2° | 62.3° |
| C27 | C28 | C29 | H27 | 174.3° | 60.9° |
| C27 | C28 | C29 | H28 | 66.0° | 179.2° |
| C28 | C27 | C25 | H36 | 61.9° | 65.7° |
| C1 | O2 | C3 | C4 | 155.8° | 180.0° |
| C1 | O2 | C3 | C8 | 27.3° | 0.1° |
| O2 | C1 | H34 | H35 | 119.6° | 119.9° |
| O2 | C1 | C25 | H36 | 165.6° | 175.6° |
| N30 | C29 | C28 | H27 | 120.1° | 120.0° |
| N30 | C29 | C28 | H28 | 120.1° | 120.1° |
| N30 | C29 | C28 | H23 | 174.4° | 60.8° |
| N30 | C29 | C28 | H24 | 66.1° | 179.1° |
| N30 | C29 | H27 | H28 | 119.6° | 120.0° |
| C29 | N30 | C31 | H29 | 179.9° | 178.3° |
| C29 | N30 | C31 | H30 | 60.4° | 58.3° |
| O2 | C3 | C4 | C8 | 177.1° | 179.9° |
| O2 | C3 | C4 | C5 | 178.8° | 179.9° |
| O2 | C3 | C8 | C7 | 177.5° | 179.7° |
| O2 | C3 | C4 | H21 | 1.2° | 0.0° |
| O2 | C3 | C8 | H22 | 2.4° | 0.2° |
| C3 | O2 | C1 | H34 | 25.0° | 60.0° |
| C3 | O2 | C1 | H35 | 94.8° | 59.9° |
| N17 | C16 | C15 | C11 | 177.4° | 179.7° |
| N17 | C16 | C15 | C14 | 178.7° | 180.0° |
| C16 | N17 | C9 | C6 | 177.6° | 180.0° |
| C16 | N17 | C9 | N10 | 2.0° | 0.6° |
| N17 | C16 | C11 | N10 | 0.5° | 0.0° |
| N17 | C16 | C11 | C12 | 178.1° | 179.7° |
| N17 | C16 | C15 | H19 | 1.3° | 0.3° |
| C16 | N17 | C18 | H32 | 23.9° | 153.0° |
| C16 | N17 | C18 | H33 | 143.5° | 33.0° |
| C9 | N17 | C16 | C15 | 176.2° | 179.4° |
| N17 | C9 | C6 | C5 | 99.9° | 145.0° |
| N17 | C9 | C6 | C7 | 81.2° | 35.0° |
| C9 | N17 | C16 | C11 | 1.5° | 0.3° |
| N17 | C9 | C6 | N10 | 179.6° | 179.3° |
| N17 | C9 | N10 | C11 | 1.6° | 0.6° |
| C9 | N17 | C18 | H32 | 159.1° | 27.6° |
| C9 | N17 | C18 | H33 | 39.5° | 147.7° |
| C3 | C4 | C5 | H21 | 180.0° | 180.0° |
| C4 | C3 | C8 | C7 | 0.7° | 0.2° |
| C3 | C4 | C5 | C6 | 0.8° | 0.0° |
| C3 | C4 | C5 | H13 | 179.2° | 179.7° |
| C4 | C3 | C8 | H22 | 179.3° | 179.7° |
| C8 | C3 | C4 | C5 | 1.7° | 0.0° |
| C3 | C8 | C7 | H22 | 180.0° | 179.5° |
| C3 | C8 | C7 | C6 | 1.2° | 0.5° |
| C3 | C8 | C7 | H14 | 178.8° | 180.0° |
| C8 | C3 | C4 | H21 | 178.4° | 180.0° |
| C16 | C15 | C14 | H19 | 180.0° | 179.7° |
| C16 | C15 | C14 | C13 | 0.9° | 0.0° |
| C15 | C16 | C11 | N10 | 177.5° | 179.8° |
| C15 | C16 | C11 | C12 | 0.1° | 0.5° |
| C16 | C15 | C14 | H9 | 179.1° | 180.0° |
| C14 | C15 | C16 | C11 | 1.3° | 0.3° |
| C15 | C14 | C13 | H9 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 0.7° | 0.0° |
| C15 | C14 | C13 | H7 | 179.3° | 179.7° |
| C29 | C28 | H23 | H24 | 119.2° | 120.1° |
| C28 | C29 | H27 | H28 | 119.6° | 120.0° |
| C29 | C28 | C27 | H31 | 66.5° | 62.3° |
| C28 | C29 | N30 | H37 | 61.1° | 62.4° |
| C4 | C5 | C6 | H13 | 180.0° | 179.7° |
| C4 | C5 | C6 | C7 | 1.1° | 0.3° |
| C4 | C5 | C6 | C9 | 180.0° | 179.8° |
| C8 | C7 | C6 | C5 | 2.1° | 0.6° |
| C8 | C7 | C6 | H14 | 180.0° | 179.5° |
| C8 | C7 | C6 | C9 | 179.1° | 179.5° |
| C5 | C6 | C7 | C9 | 178.8° | 179.9° |
| C5 | C6 | C9 | N10 | 80.5° | 35.7° |
| C5 | C6 | C7 | H14 | 177.9° | 180.0° |
| C6 | C5 | C4 | H21 | 179.3° | 180.0° |
| C7 | C6 | C9 | N10 | 98.3° | 144.3° |
| C7 | C6 | C5 | H13 | 178.9° | 180.0° |
| C6 | C7 | C8 | H22 | 178.8° | 180.0° |
| C16 | C11 | N10 | C9 | 0.7° | 0.4° |
| C16 | C11 | N10 | C12 | 177.2° | 179.6° |
| C16 | C11 | C12 | C13 | 1.6° | 0.4° |
| C16 | C11 | C12 | H17 | 178.4° | 179.5° |
| C11 | C16 | C15 | H19 | 178.7° | 180.0° |
| C6 | C9 | N10 | C11 | 178.0° | 180.0° |
| C9 | C6 | C5 | H13 | 0.0° | 0.0° |
| C9 | C6 | C7 | H14 | 0.9° | 0.0° |
| C9 | N10 | C11 | C12 | 176.6° | 180.0° |
| C14 | C13 | C12 | C11 | 2.0° | 0.2° |
| C14 | C13 | C12 | H7 | 180.0° | 179.7° |
| C14 | C13 | C12 | H17 | 178.0° | 179.7° |
| C13 | C14 | C15 | H19 | 179.1° | 179.7° |
| N10 | C11 | C12 | C13 | 178.6° | 179.9° |
| N10 | C11 | C12 | H17 | 1.4° | 0.1° |
| C11 | C12 | C13 | H17 | 180.0° | 179.9° |
| C11 | C12 | C13 | H7 | 178.0° | 179.9° |
| C12 | C13 | C14 | H9 | 179.3° | 180.0° |
| H1 | C45 | C44 | H3 | 1.6° | 0.0° |
| H1 | C45 | C46 | H4 | 1.2° | 0.2° |
| H2 | C22 | C21 | H5 | 0.1° | 0.5° |
| H2 | C22 | C23 | H6 | 0.7° | 0.3° |
| H3 | C44 | C43 | H11 | 0.9° | 0.1° |
| H4 | C46 | C47 | H12 | 0.0° | 0.1° |
| H5 | C21 | C20 | H15 | 0.0° | 0.1° |
| H6 | C23 | C24 | H16 | 1.1° | 0.0° |
| H7 | C13 | C14 | H9 | 0.7° | 0.3° |
| H7 | C13 | C12 | H17 | 2.0° | 0.0° |
| H8 | C37 | C38 | H10 | 0.9° | 0.1° |
| H8 | C37 | C36 | H18 | 2.1° | 0.2° |
| H9 | C14 | C15 | H19 | 0.9° | 0.3° |
| H10 | C38 | C39 | H20 | 0.8° | 0.1° |
| H13 | C5 | C4 | H21 | 0.7° | 0.3° |
| H14 | C7 | C8 | H22 | 1.2° | 0.5° |
| H23 | C28 | C29 | H27 | 65.4° | 179.2° |
| H23 | C28 | C29 | H28 | 54.3° | 59.2° |
| H23 | C28 | C27 | H31 | 53.8° | 177.8° |
| H24 | C28 | C29 | H27 | 54.0° | 59.1° |
| H24 | C28 | C29 | H28 | 173.7° | 60.8° |
| H24 | C28 | C27 | H31 | 173.2° | 57.7° |
| H25 | C32 | C31 | H29 | 64.9° | 60.8° |
| H25 | C32 | C31 | H30 | 54.7° | 59.1° |
| H25 | C32 | C27 | H31 | 53.8° | 57.7° |
| H26 | C32 | C31 | H29 | 54.7° | 59.2° |
| H26 | C32 | C31 | H30 | 174.2° | 179.2° |
| H26 | C32 | C27 | H31 | 173.3° | 177.8° |
| H27 | C29 | N30 | H37 | 59.0° | 177.6° |
| H28 | C29 | N30 | H37 | 178.7° | 57.7° |
| H29 | C31 | N30 | H37 | 59.6° | 57.6° |
| H30 | C31 | N30 | H37 | 179.1° | 177.6° |
| H31 | C27 | C25 | H36 | 179.5° | 174.1° |
| H34 | C1 | C25 | H36 | 74.2° | 55.7° |
| H35 | C1 | C25 | H36 | 45.5° | 64.4° |
