0WR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | N9 | sing | 1.47Å | 1.47Å | |
| C28 | N9 | sing | 1.47Å | 1.47Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| N9 | C26 | sing | 1.38Å | 1.38Å | |
| C8 | C7 | sing | 1.53Å | 1.50Å | |
| C8 | C4 | sing | 1.53Å | 1.43Å | |
| C7 | N1 | sing | 1.47Å | 1.45Å | |
| C2 | C4 | sing | 1.53Å | 1.58Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | O2 | sing | 1.43Å | 1.38Å | |
| C26 | N8 | doub | 1.31Å | 1.31Å | Aromatic |
| C26 | N7 | sing | 1.37Å | 1.37Å | Aromatic |
| C4 | C5 | sing | 1.53Å | 1.48Å | |
| N8 | C25 | sing | 1.36Å | 1.36Å | Aromatic |
| C13 | N3 | sing | 1.47Å | 1.43Å | |
| N1 | C9 | sing | 1.47Å | 1.51Å | |
| N1 | C6 | sing | 1.47Å | 1.45Å | |
| N7 | C14 | sing | 1.39Å | 1.41Å | |
| N7 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| N4 | C14 | doub | 1.32Å | 1.34Å | Aromatic |
| N4 | C12 | sing | 1.33Å | 1.40Å | Aromatic |
| C25 | C24 | doub | 1.40Å | 1.40Å | Aromatic |
| C25 | C20 | sing | 1.40Å | 1.40Å | Aromatic |
| N3 | C12 | sing | 1.37Å | 1.43Å | Aromatic |
| N3 | C10 | sing | 1.36Å | 1.34Å | Aromatic |
| C14 | N5 | sing | 1.33Å | 1.36Å | Aromatic |
| C12 | C11 | doub | 1.41Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.51Å | 1.54Å | |
| C10 | N2 | doub | 1.30Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.53Å | 1.49Å | |
| C24 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
| N5 | C15 | doub | 1.33Å | 1.36Å | Aromatic |
| C20 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | N2 | sing | 1.35Å | 1.41Å | Aromatic |
| C11 | C15 | sing | 1.41Å | 1.45Å | Aromatic |
| C15 | N6 | sing | 1.38Å | 1.43Å | |
| N6 | C19 | sing | 1.47Å | 1.41Å | |
| N6 | C16 | sing | 1.47Å | 1.41Å | |
| C23 | C22 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.53Å | 1.49Å | |
| C21 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.53Å | 1.49Å | |
| C18 | O1 | sing | 1.43Å | 1.41Å | |
| C17 | O1 | sing | 1.43Å | 1.40Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| O2 | H5 | sing | 0.97Å | 0.95Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C5 | H11 | sing | 1.09Å | 1.10Å | |
| C6 | H12 | sing | 1.09Å | 1.10Å | |
| C6 | H13 | sing | 1.09Å | 1.10Å | |
| C7 | H14 | sing | 1.09Å | 1.10Å | |
| C7 | H15 | sing | 1.09Å | 1.10Å | |
| C8 | H16 | sing | 1.09Å | 1.10Å | |
| C8 | H17 | sing | 1.09Å | 1.10Å | |
| C9 | H18 | sing | 1.09Å | 1.10Å | |
| C9 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.09Å | 1.10Å | |
| C13 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.08Å | 1.08Å | |
| C22 | H32 | sing | 1.08Å | 1.08Å | |
| C23 | H33 | sing | 1.08Å | 1.08Å | |
| C24 | H34 | sing | 1.08Å | 1.08Å | |
| C27 | H35 | sing | 1.09Å | 1.10Å | |
| C27 | H36 | sing | 1.09Å | 1.10Å | |
| C27 | H37 | sing | 1.09Å | 1.10Å | |
| C28 | H38 | sing | 1.09Å | 1.10Å | |
| C28 | H39 | sing | 1.09Å | 1.10Å | |
| C28 | H40 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | N9 | C28 | 111.4° | 111.0° |
| C27 | N9 | C26 | 111.8° | 111.0° |
| N9 | C27 | H35 | 109.5° | 109.5° |
| N9 | C27 | H36 | 109.5° | 109.5° |
| N9 | C27 | H37 | 109.5° | 109.4° |
| C28 | N9 | C26 | 111.8° | 111.0° |
| N9 | C28 | H38 | 109.5° | 109.5° |
| N9 | C28 | H39 | 109.4° | 109.5° |
| N9 | C28 | H40 | 109.5° | 109.5° |
| C1 | C2 | C4 | 110.5° | 109.5° |
| C1 | C2 | C3 | 109.5° | 109.5° |
| C1 | C2 | O2 | 108.4° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| N9 | C26 | N8 | 125.0° | 125.1° |
| N9 | C26 | N7 | 125.4° | 125.1° |
| C7 | C8 | C4 | 112.2° | 109.2° |
| C8 | C7 | N1 | 111.8° | 109.5° |
| C8 | C7 | H14 | 108.9° | 109.5° |
| C8 | C7 | H15 | 108.9° | 109.4° |
| C7 | C8 | H16 | 108.8° | 109.5° |
| C7 | C8 | H17 | 108.8° | 109.5° |
| C8 | C4 | C2 | 111.2° | 109.5° |
| C8 | C4 | C5 | 112.5° | 109.2° |
| C8 | C4 | H9 | 108.1° | 109.6° |
| C4 | C8 | H16 | 108.8° | 109.5° |
| C4 | C8 | H17 | 108.8° | 109.6° |
| C7 | N1 | C9 | 128.7° | 111.0° |
| C7 | N1 | C6 | 112.6° | 111.2° |
| N1 | C7 | H14 | 108.9° | 109.5° |
| N1 | C7 | H15 | 108.9° | 109.5° |
| C4 | C2 | C3 | 107.5° | 109.5° |
| C4 | C2 | O2 | 111.8° | 109.4° |
| C2 | C4 | C5 | 110.9° | 109.6° |
| C2 | C4 | H9 | 106.4° | 109.5° |
| C3 | C2 | O2 | 109.1° | 109.5° |
| C2 | C3 | H6 | 109.5° | 109.5° |
| C2 | C3 | H7 | 109.5° | 109.5° |
| C2 | C3 | H8 | 109.4° | 109.4° |
| C2 | O2 | H5 | 109.5° | 114.0° |
| N8 | C26 | N7 | 109.6° | 109.8° |
| C26 | N8 | C25 | 109.9° | 109.7° |
| C26 | N7 | C14 | 127.3° | 126.4° |
| C26 | N7 | C20 | 107.3° | 107.1° |
| C4 | C5 | C6 | 111.3° | 109.3° |
| C5 | C4 | H9 | 107.5° | 109.6° |
| C4 | C5 | H10 | 109.0° | 109.5° |
| C4 | C5 | H11 | 109.0° | 109.5° |
| N8 | C25 | C24 | 133.1° | 133.4° |
| N8 | C25 | C20 | 107.3° | 107.1° |
| C13 | N3 | C12 | 122.1° | 126.2° |
| C13 | N3 | C10 | 129.4° | 126.3° |
| N3 | C13 | H20 | 109.5° | 109.5° |
| N3 | C13 | H21 | 109.5° | 109.5° |
| N3 | C13 | H22 | 109.5° | 109.5° |
| C9 | N1 | C6 | 106.9° | 111.0° |
| N1 | C9 | C10 | 109.6° | 109.5° |
| N1 | C9 | H18 | 109.5° | 109.5° |
| N1 | C9 | H19 | 109.4° | 109.5° |
| N1 | C6 | C5 | 112.8° | 109.5° |
| N1 | C6 | H12 | 108.7° | 109.4° |
| N1 | C6 | H13 | 108.6° | 109.4° |
| C14 | N7 | C20 | 125.4° | 126.5° |
| N7 | C14 | N4 | 119.0° | 118.8° |
| N7 | C14 | N5 | 118.7° | 118.8° |
| N7 | C20 | C25 | 106.0° | 106.2° |
| N7 | C20 | C21 | 133.7° | 133.9° |
| C14 | N4 | C12 | 119.7° | 120.6° |
| N4 | C14 | N5 | 122.3° | 122.3° |
| N4 | C12 | N3 | 131.5° | 134.9° |
| N4 | C12 | C11 | 120.7° | 119.1° |
| C24 | C25 | C20 | 119.6° | 119.5° |
| C25 | C24 | C23 | 119.3° | 119.8° |
| C25 | C24 | H34 | 120.3° | 120.1° |
| C25 | C20 | C21 | 120.3° | 120.0° |
| C12 | N3 | C10 | 108.6° | 107.5° |
| N3 | C12 | C11 | 107.7° | 106.0° |
| N3 | C10 | C9 | 125.7° | 125.0° |
| N3 | C10 | N2 | 108.9° | 110.0° |
| C14 | N5 | C15 | 120.3° | 121.2° |
| C12 | C11 | N2 | 107.0° | 107.1° |
| C12 | C11 | C15 | 117.3° | 118.3° |
| C9 | C10 | N2 | 125.4° | 125.0° |
| C10 | C9 | H18 | 109.4° | 109.4° |
| C10 | C9 | H19 | 109.5° | 109.5° |
| C10 | N2 | C11 | 107.8° | 109.4° |
| C6 | C5 | H10 | 109.0° | 109.5° |
| C6 | C5 | H11 | 109.0° | 109.5° |
| C5 | C6 | H12 | 108.6° | 109.5° |
| C5 | C6 | H13 | 108.7° | 109.5° |
| C24 | C23 | C22 | 120.8° | 120.5° |
| C24 | C23 | H33 | 119.6° | 119.8° |
| C23 | C24 | H34 | 120.3° | 120.1° |
| N5 | C15 | C11 | 119.7° | 118.5° |
| N5 | C15 | N6 | 116.3° | 120.7° |
| C20 | C21 | C22 | 119.4° | 119.9° |
| C20 | C21 | H31 | 120.3° | 120.1° |
| N2 | C11 | C15 | 135.7° | 134.6° |
| C11 | C15 | N6 | 124.0° | 120.8° |
| C15 | N6 | C19 | 115.9° | 111.0° |
| C15 | N6 | C16 | 126.2° | 111.0° |
| C19 | N6 | C16 | 116.3° | 110.8° |
| N6 | C19 | C18 | 111.6° | 109.2° |
| N6 | C19 | H29 | 108.9° | 109.5° |
| N6 | C19 | H30 | 108.9° | 109.5° |
| N6 | C16 | C17 | 112.5° | 109.3° |
| N6 | C16 | H23 | 108.7° | 109.5° |
| N6 | C16 | H24 | 108.7° | 109.5° |
| C23 | C22 | C21 | 120.6° | 120.4° |
| C23 | C22 | H32 | 119.7° | 119.8° |
| C22 | C23 | H33 | 119.6° | 119.7° |
| C19 | C18 | O1 | 109.8° | 109.2° |
| C19 | C18 | H27 | 109.4° | 109.5° |
| C19 | C18 | H28 | 109.4° | 109.6° |
| C18 | C19 | H29 | 108.9° | 109.5° |
| C18 | C19 | H30 | 108.9° | 109.5° |
| C22 | C21 | H31 | 120.3° | 120.0° |
| C21 | C22 | H32 | 119.7° | 119.9° |
| C16 | C17 | O1 | 111.0° | 109.2° |
| C17 | C16 | H23 | 108.7° | 109.5° |
| C17 | C16 | H24 | 108.7° | 109.5° |
| C16 | C17 | H25 | 109.1° | 109.5° |
| C16 | C17 | H26 | 109.1° | 109.6° |
| C18 | O1 | C17 | 111.6° | 113.7° |
| O1 | C18 | H27 | 109.4° | 109.5° |
| O1 | C18 | H28 | 109.4° | 109.5° |
| O1 | C17 | H25 | 109.1° | 109.5° |
| O1 | C17 | H26 | 109.1° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.4° | 109.5° |
| H6 | C3 | H7 | 109.5° | 109.5° |
| H6 | C3 | H8 | 109.4° | 109.4° |
| H7 | C3 | H8 | 109.5° | 109.5° |
| H10 | C5 | H11 | 109.5° | 109.6° |
| H12 | C6 | H13 | 109.5° | 109.5° |
| H14 | C7 | H15 | 109.5° | 109.4° |
| H16 | C8 | H17 | 109.5° | 109.5° |
| H18 | C9 | H19 | 109.5° | 109.4° |
| H20 | C13 | H21 | 109.4° | 109.4° |
| H20 | C13 | H22 | 109.5° | 109.5° |
| H21 | C13 | H22 | 109.5° | 109.4° |
| H23 | C16 | H24 | 109.4° | 109.6° |
| H25 | C17 | H26 | 109.5° | 109.5° |
| H27 | C18 | H28 | 109.5° | 109.5° |
| H29 | C19 | H30 | 109.5° | 109.5° |
| H35 | C27 | H36 | 109.4° | 109.5° |
| H35 | C27 | H37 | 109.5° | 109.4° |
| H36 | C27 | H37 | 109.5° | 109.5° |
| H38 | C28 | H39 | 109.5° | 109.5° |
| H38 | C28 | H40 | 109.4° | 109.5° |
| H39 | C28 | H40 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | N9 | C28 | C26 | 126.0° | 124.0° |
| C27 | N9 | C26 | N8 | 117.0° | 55.2° |
| C27 | N9 | C26 | N7 | 63.6° | 124.2° |
| N9 | C27 | H35 | H36 | 120.0° | 120.1° |
| N9 | C27 | H35 | H37 | 120.0° | 119.9° |
| N9 | C27 | H36 | H37 | 120.0° | 120.0° |
| C27 | N9 | C28 | H38 | 180.0° | 171.2° |
| C27 | N9 | C28 | H39 | 60.0° | 51.2° |
| C27 | N9 | C28 | H40 | 60.0° | 68.8° |
| C28 | N9 | C26 | N8 | 8.8° | 68.7° |
| C28 | N9 | C26 | N7 | 170.6° | 111.8° |
| C28 | N9 | C27 | H35 | 180.0° | 64.0° |
| C28 | N9 | C27 | H36 | 60.0° | 56.1° |
| C28 | N9 | C27 | H37 | 60.0° | 176.0° |
| N9 | C28 | H38 | H39 | 120.0° | 120.1° |
| N9 | C28 | H38 | H40 | 120.0° | 120.0° |
| N9 | C28 | H39 | H40 | 120.0° | 120.0° |
| C1 | C2 | C4 | C8 | 45.4° | 55.3° |
| C1 | C2 | C4 | C3 | 119.5° | 120.1° |
| C1 | C2 | C4 | O2 | 120.8° | 120.0° |
| C1 | C2 | C3 | O2 | 118.5° | 120.0° |
| C1 | C2 | C4 | C5 | 171.4° | 175.0° |
| C2 | C1 | H1 | H2 | 120.0° | 119.9° |
| C2 | C1 | H1 | H3 | 120.0° | 120.1° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C1 | C2 | O2 | H5 | 180.0° | 180.0° |
| C1 | C2 | C3 | H6 | 180.0° | 60.0° |
| C1 | C2 | C3 | H7 | 60.0° | 180.0° |
| C1 | C2 | C3 | H8 | 60.0° | 60.0° |
| C1 | C2 | C4 | H9 | 72.1° | 64.8° |
| N9 | C26 | N8 | N7 | 179.5° | 179.5° |
| N9 | C26 | N8 | C25 | 179.7° | 180.0° |
| N9 | C26 | N7 | C14 | 1.6° | 0.3° |
| N9 | C26 | N7 | C20 | 180.0° | 180.0° |
| C26 | N9 | C27 | H35 | 54.0° | 60.0° |
| C26 | N9 | C27 | H36 | 174.0° | 180.0° |
| C26 | N9 | C27 | H37 | 66.0° | 60.0° |
| C26 | N9 | C28 | H38 | 54.0° | 64.8° |
| C26 | N9 | C28 | H39 | 66.0° | 175.2° |
| C26 | N9 | C28 | H40 | 174.0° | 55.2° |
| C7 | C8 | C4 | H16 | 120.4° | 119.9° |
| C7 | C8 | C4 | H17 | 120.4° | 120.0° |
| C8 | C7 | N1 | H14 | 120.4° | 120.0° |
| C8 | C7 | N1 | H15 | 120.4° | 120.0° |
| C7 | C8 | C4 | C2 | 178.5° | 177.6° |
| C7 | C8 | C4 | C5 | 53.5° | 57.6° |
| C8 | C7 | N1 | C9 | 170.0° | 174.2° |
| C8 | C7 | N1 | C6 | 52.3° | 61.7° |
| C7 | C8 | C4 | H9 | 65.0° | 62.3° |
| C8 | C7 | H14 | H15 | 118.9° | 119.9° |
| C7 | C8 | H16 | H17 | 118.7° | 120.1° |
| C4 | C8 | C7 | N1 | 53.3° | 59.2° |
| C8 | C4 | C2 | C5 | 125.9° | 119.7° |
| C8 | C4 | C2 | H9 | 117.5° | 120.1° |
| C8 | C4 | C2 | C3 | 164.9° | 64.8° |
| C8 | C4 | C2 | O2 | 75.4° | 175.3° |
| C8 | C4 | C5 | H9 | 118.9° | 120.0° |
| C8 | C4 | C5 | C6 | 52.5° | 57.7° |
| C8 | C4 | C5 | H10 | 172.8° | 177.6° |
| C8 | C4 | C5 | H11 | 67.7° | 62.3° |
| C4 | C8 | C7 | H14 | 173.6° | 60.9° |
| C4 | C8 | C7 | H15 | 67.1° | 179.2° |
| C4 | C8 | H16 | H17 | 118.7° | 120.2° |
| C7 | N1 | C9 | C6 | 139.5° | 124.2° |
| C7 | N1 | C9 | C10 | 71.4° | 65.8° |
| C7 | N1 | C6 | C5 | 52.3° | 61.7° |
| C7 | N1 | C6 | H12 | 172.8° | 178.2° |
| C7 | N1 | C6 | H13 | 68.2° | 58.3° |
| N1 | C7 | H14 | H15 | 118.9° | 120.0° |
| N1 | C7 | C8 | H16 | 173.7° | 60.8° |
| N1 | C7 | C8 | H17 | 67.2° | 179.2° |
| C7 | N1 | C9 | H18 | 48.6° | 54.2° |
| C7 | N1 | C9 | H19 | 168.5° | 174.2° |
| C4 | C2 | C3 | O2 | 121.4° | 119.9° |
| C2 | C4 | C5 | H9 | 115.9° | 120.2° |
| C2 | C4 | C5 | C6 | 177.7° | 177.5° |
| C4 | C2 | C1 | H1 | 180.0° | 60.1° |
| C4 | C2 | C1 | H2 | 60.0° | 180.0° |
| C4 | C2 | C1 | H3 | 60.0° | 60.0° |
| C4 | C2 | O2 | H5 | 58.0° | 60.0° |
| C4 | C2 | C3 | H6 | 59.9° | 60.1° |
| C4 | C2 | C3 | H7 | 60.1° | 60.0° |
| C4 | C2 | C3 | H8 | 179.9° | 180.0° |
| C2 | C4 | C5 | H10 | 62.0° | 62.6° |
| C2 | C4 | C5 | H11 | 57.5° | 57.6° |
| C2 | C4 | C8 | H16 | 61.1° | 57.7° |
| C2 | C4 | C8 | H17 | 58.1° | 62.5° |
| C3 | C2 | C4 | C5 | 69.2° | 54.9° |
| C3 | C2 | C1 | H1 | 61.8° | 59.9° |
| C3 | C2 | C1 | H2 | 58.2° | 60.0° |
| C3 | C2 | C1 | H3 | 178.2° | 180.0° |
| C3 | C2 | O2 | H5 | 60.8° | 60.0° |
| C2 | C3 | H6 | H7 | 120.0° | 120.1° |
| C2 | C3 | H6 | H8 | 120.0° | 119.9° |
| C2 | C3 | H7 | H8 | 120.0° | 120.0° |
| C3 | C2 | C4 | H9 | 47.4° | 175.1° |
| O2 | C2 | C4 | C5 | 50.6° | 65.0° |
| O2 | C2 | C1 | H1 | 57.2° | 180.0° |
| O2 | C2 | C1 | H2 | 177.2° | 60.0° |
| O2 | C2 | C1 | H3 | 62.8° | 60.0° |
| O2 | C2 | C3 | H6 | 61.4° | 180.0° |
| O2 | C2 | C3 | H7 | 178.5° | 59.9° |
| O2 | C2 | C3 | H8 | 58.5° | 60.1° |
| O2 | C2 | C4 | H9 | 167.1° | 55.2° |
| N8 | C26 | N7 | C14 | 178.9° | 179.8° |
| N8 | C26 | N7 | C20 | 0.5° | 0.4° |
| C26 | N8 | C25 | C24 | 179.6° | 179.7° |
| C26 | N8 | C25 | C20 | 0.1° | 0.3° |
| N7 | C26 | N8 | C25 | 0.2° | 0.5° |
| C26 | N7 | C14 | C20 | 178.2° | 179.7° |
| C26 | N7 | C14 | N4 | 31.0° | 5.8° |
| C26 | N7 | C20 | C25 | 0.5° | 0.2° |
| C26 | N7 | C14 | N5 | 146.7° | 174.4° |
| C26 | N7 | C20 | C21 | 179.9° | 179.7° |
| C4 | C5 | C6 | N1 | 51.5° | 59.2° |
| C4 | C5 | C6 | H10 | 120.3° | 119.9° |
| C4 | C5 | C6 | H11 | 120.3° | 119.9° |
| C4 | C5 | H10 | H11 | 119.1° | 120.1° |
| C4 | C5 | C6 | H12 | 172.0° | 179.2° |
| C4 | C5 | C6 | H13 | 69.0° | 60.8° |
| C5 | C4 | C8 | H16 | 173.9° | 62.3° |
| C5 | C4 | C8 | H17 | 66.9° | 177.6° |
| N8 | C25 | C20 | N7 | 0.4° | 0.0° |
| N8 | C25 | C24 | C20 | 179.4° | 180.0° |
| N8 | C25 | C24 | C23 | 179.9° | 179.9° |
| N8 | C25 | C20 | C21 | 179.9° | 180.0° |
| N8 | C25 | C24 | H34 | 0.1° | 0.0° |
| C13 | N3 | C12 | N4 | 0.2° | 0.1° |
| C13 | N3 | C12 | C10 | 179.9° | 179.9° |
| C13 | N3 | C12 | C11 | 179.5° | 180.0° |
| C13 | N3 | C10 | C9 | 0.8° | 0.0° |
| C13 | N3 | C10 | N2 | 179.5° | 179.9° |
| N3 | C13 | H20 | H21 | 120.0° | 120.0° |
| N3 | C13 | H20 | H22 | 120.0° | 120.0° |
| N3 | C13 | H21 | H22 | 120.0° | 120.0° |
| N1 | C9 | C10 | N3 | 141.9° | 90.0° |
| N1 | C9 | C10 | H18 | 120.0° | 120.0° |
| N1 | C9 | C10 | H19 | 120.0° | 120.0° |
| N1 | C9 | C10 | N2 | 38.5° | 89.9° |
| C9 | N1 | C6 | C5 | 161.0° | 174.2° |
| C9 | N1 | C6 | H12 | 40.5° | 54.1° |
| C9 | N1 | C6 | H13 | 78.5° | 65.8° |
| C9 | N1 | C7 | H14 | 49.7° | 65.8° |
| C9 | N1 | C7 | H15 | 69.6° | 54.2° |
| N1 | C9 | H18 | H19 | 119.9° | 120.0° |
| C6 | N1 | C9 | C10 | 149.1° | 170.0° |
| N1 | C6 | C5 | H12 | 120.5° | 120.0° |
| N1 | C6 | C5 | H13 | 120.5° | 119.9° |
| N1 | C6 | C5 | H10 | 171.8° | 179.1° |
| N1 | C6 | C5 | H11 | 68.8° | 60.8° |
| N1 | C6 | H12 | H13 | 118.5° | 119.9° |
| C6 | N1 | C7 | H14 | 172.7° | 58.3° |
| C6 | N1 | C7 | H15 | 68.1° | 178.3° |
| C6 | N1 | C9 | H18 | 90.9° | 70.0° |
| C6 | N1 | C9 | H19 | 29.1° | 50.0° |
| N7 | C14 | N4 | N5 | 177.6° | 179.8° |
| N7 | C14 | N4 | C12 | 178.4° | 180.0° |
| C14 | N7 | C20 | C25 | 179.0° | 180.0° |
| N7 | C14 | N5 | C15 | 178.8° | 180.0° |
| C14 | N7 | C20 | C21 | 1.4° | 0.0° |
| C20 | N7 | C14 | N4 | 150.8° | 174.5° |
| N7 | C20 | C25 | C24 | 179.9° | 180.0° |
| N7 | C20 | C25 | C21 | 179.7° | 180.0° |
| C20 | N7 | C14 | N5 | 31.5° | 5.3° |
| N7 | C20 | C21 | C22 | 179.8° | 179.9° |
| N7 | C20 | C21 | H31 | 0.2° | 0.0° |
| C14 | N4 | C12 | N3 | 179.9° | 180.0° |
| C14 | N4 | C12 | C11 | 0.6° | 0.1° |
| N4 | C14 | N5 | C15 | 1.2° | 0.2° |
| N4 | C12 | N3 | C11 | 179.3° | 179.9° |
| N4 | C12 | N3 | C10 | 179.7° | 180.0° |
| C12 | N4 | C14 | N5 | 0.8° | 0.2° |
| N4 | C12 | C11 | N2 | 179.7° | 180.0° |
| N4 | C12 | C11 | C15 | 0.7° | 0.0° |
| C25 | C24 | C23 | H34 | 180.0° | 180.0° |
| C24 | C25 | C20 | C21 | 0.4° | 0.0° |
| C25 | C24 | C23 | C22 | 0.3° | 0.1° |
| C25 | C24 | C23 | H33 | 179.7° | 180.0° |
| C20 | C25 | C24 | C23 | 0.4° | 0.1° |
| C25 | C20 | C21 | C22 | 0.2° | 0.0° |
| C25 | C20 | C21 | H31 | 179.8° | 180.0° |
| C20 | C25 | C24 | H34 | 179.5° | 179.9° |
| C12 | N3 | C10 | C9 | 179.3° | 179.9° |
| C12 | N3 | C10 | N2 | 0.4° | 0.0° |
| N3 | C12 | C11 | N2 | 0.2° | 0.1° |
| N3 | C12 | C11 | C15 | 179.9° | 180.0° |
| C12 | N3 | C13 | H20 | 180.0° | 90.0° |
| C12 | N3 | C13 | H21 | 60.0° | 150.1° |
| C12 | N3 | C13 | H22 | 60.0° | 30.1° |
| C10 | N3 | C12 | C11 | 0.4° | 0.0° |
| N3 | C10 | C9 | N2 | 179.7° | 179.9° |
| N3 | C10 | N2 | C11 | 0.2° | 0.0° |
| N3 | C10 | C9 | H18 | 21.9° | 30.0° |
| N3 | C10 | C9 | H19 | 98.1° | 150.0° |
| C10 | N3 | C13 | H20 | 0.1° | 90.0° |
| C10 | N3 | C13 | H21 | 120.1° | 30.0° |
| C10 | N3 | C13 | H22 | 119.9° | 150.0° |
| C14 | N5 | C15 | C11 | 1.3° | 0.1° |
| C14 | N5 | C15 | N6 | 179.2° | 180.0° |
| C12 | C11 | N2 | C10 | 0.0° | 0.1° |
| C12 | C11 | C15 | N5 | 1.0° | 0.1° |
| C12 | C11 | N2 | C15 | 179.6° | 179.9° |
| C12 | C11 | C15 | N6 | 179.5° | 180.0° |
| C9 | C10 | N2 | C11 | 179.5° | 180.0° |
| C10 | C9 | H18 | H19 | 120.0° | 120.0° |
| C10 | N2 | C11 | C15 | 179.6° | 180.0° |
| N2 | C10 | C9 | H18 | 158.5° | 150.0° |
| N2 | C10 | C9 | H19 | 81.5° | 30.1° |
| C6 | C5 | C4 | H9 | 66.4° | 62.3° |
| C6 | C5 | H10 | H11 | 119.2° | 120.1° |
| C5 | C6 | H12 | H13 | 118.5° | 120.0° |
| C24 | C23 | C22 | H33 | 180.0° | 179.9° |
| C24 | C23 | C22 | C21 | 0.1° | 0.0° |
| C24 | C23 | C22 | H32 | 179.9° | 179.9° |
| N5 | C15 | C11 | N2 | 179.4° | 180.0° |
| N5 | C15 | C11 | N6 | 179.5° | 179.9° |
| N5 | C15 | N6 | C19 | 6.9° | 0.1° |
| N5 | C15 | N6 | C16 | 171.8° | 123.6° |
| C20 | C21 | C22 | C23 | 0.0° | 0.1° |
| C20 | C21 | C22 | H31 | 180.0° | 179.9° |
| C20 | C21 | C22 | H32 | 180.0° | 180.0° |
| N2 | C11 | C15 | N6 | 0.1° | 0.1° |
| C11 | C15 | N6 | C19 | 173.5° | 180.0° |
| C11 | C15 | N6 | C16 | 8.7° | 56.3° |
| C15 | N6 | C19 | C16 | 166.4° | 123.8° |
| C15 | N6 | C19 | C18 | 119.9° | 177.6° |
| C15 | N6 | C16 | C17 | 120.8° | 177.6° |
| C15 | N6 | C16 | H23 | 0.3° | 62.5° |
| C15 | N6 | C16 | H24 | 118.7° | 57.7° |
| C15 | N6 | C19 | H29 | 119.8° | 57.6° |
| C15 | N6 | C19 | H30 | 0.5° | 62.5° |
| N6 | C19 | C18 | H29 | 120.3° | 120.0° |
| N6 | C19 | C18 | H30 | 120.3° | 119.9° |
| C19 | N6 | C16 | C17 | 44.0° | 58.6° |
| N6 | C19 | C18 | O1 | 53.5° | 56.8° |
| C19 | N6 | C16 | H23 | 164.5° | 61.3° |
| C19 | N6 | C16 | H24 | 76.4° | 178.5° |
| N6 | C19 | C18 | H27 | 173.6° | 176.7° |
| N6 | C19 | C18 | H28 | 66.5° | 63.1° |
| N6 | C19 | H29 | H30 | 119.0° | 120.1° |
| C16 | N6 | C19 | C18 | 46.6° | 58.6° |
| N6 | C16 | C17 | H23 | 120.5° | 119.9° |
| N6 | C16 | C17 | H24 | 120.5° | 119.9° |
| N6 | C16 | C17 | O1 | 48.8° | 56.8° |
| N6 | C16 | H23 | H24 | 118.6° | 120.1° |
| N6 | C16 | C17 | H25 | 71.4° | 63.1° |
| N6 | C16 | C17 | H26 | 169.1° | 176.8° |
| C16 | N6 | C19 | H29 | 73.7° | 178.5° |
| C16 | N6 | C19 | H30 | 166.9° | 61.3° |
| C23 | C22 | C21 | H32 | 180.0° | 179.9° |
| C23 | C22 | C21 | H31 | 180.0° | 180.0° |
| C22 | C23 | C24 | H34 | 179.7° | 180.0° |
| C19 | C18 | O1 | H27 | 120.0° | 119.9° |
| C19 | C18 | O1 | H28 | 120.0° | 120.0° |
| C19 | C18 | O1 | C17 | 61.1° | 58.7° |
| C19 | C18 | H27 | H28 | 119.9° | 120.1° |
| C18 | C19 | H29 | H30 | 119.0° | 120.1° |
| C21 | C22 | C23 | H33 | 179.9° | 179.9° |
| C16 | C17 | O1 | C18 | 58.8° | 58.7° |
| C16 | C17 | O1 | H25 | 120.2° | 119.9° |
| C16 | C17 | O1 | H26 | 120.2° | 120.0° |
| C17 | C16 | H23 | H24 | 118.6° | 120.1° |
| C16 | C17 | H25 | H26 | 119.3° | 120.2° |
| C18 | O1 | C17 | H25 | 61.4° | 61.3° |
| C18 | O1 | C17 | H26 | 179.0° | 178.7° |
| O1 | C18 | H27 | H28 | 119.9° | 120.1° |
| O1 | C18 | C19 | H29 | 66.8° | 176.8° |
| O1 | C18 | C19 | H30 | 173.9° | 63.1° |
| O1 | C17 | C16 | H23 | 169.3° | 63.1° |
| O1 | C17 | C16 | H24 | 71.7° | 176.8° |
| O1 | C17 | H25 | H26 | 119.3° | 120.1° |
| C17 | O1 | C18 | H27 | 178.8° | 178.6° |
| C17 | O1 | C18 | H28 | 58.9° | 61.3° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H6 | C3 | H7 | H8 | 120.0° | 119.9° |
| H9 | C4 | C5 | H10 | 53.9° | 57.6° |
| H9 | C4 | C5 | H11 | 173.3° | 177.7° |
| H9 | C4 | C8 | H16 | 55.4° | 177.8° |
| H9 | C4 | C8 | H17 | 174.5° | 57.6° |
| H10 | C5 | C6 | H12 | 67.7° | 60.9° |
| H10 | C5 | C6 | H13 | 51.3° | 59.1° |
| H11 | C5 | C6 | H12 | 51.7° | 59.2° |
| H11 | C5 | C6 | H13 | 170.7° | 179.3° |
| H14 | C7 | C8 | H16 | 66.0° | 179.2° |
| H14 | C7 | C8 | H17 | 53.2° | 59.1° |
| H15 | C7 | C8 | H16 | 53.3° | 59.2° |
| H15 | C7 | C8 | H17 | 172.5° | 60.8° |
| H20 | C13 | H21 | H22 | 120.0° | 120.0° |
| H23 | C16 | C17 | H25 | 49.0° | 177.0° |
| H23 | C16 | C17 | H26 | 70.5° | 56.8° |
| H24 | C16 | C17 | H25 | 168.1° | 56.8° |
| H24 | C16 | C17 | H26 | 48.6° | 63.3° |
| H27 | C18 | C19 | H29 | 53.3° | 63.3° |
| H27 | C18 | C19 | H30 | 66.1° | 56.8° |
| H28 | C18 | C19 | H29 | 173.2° | 56.8° |
| H28 | C18 | C19 | H30 | 53.8° | 176.9° |
| H31 | C21 | C22 | H32 | 0.0° | 0.1° |
| H32 | C22 | C23 | H33 | 0.1° | 0.0° |
| H33 | C23 | C24 | H34 | 0.3° | 0.1° |
| H35 | C27 | H36 | H37 | 120.0° | 120.0° |
| H38 | C28 | H39 | H40 | 120.0° | 120.0° |
