J4R
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C31 | N5 | sing | 1.47Å | 1.47Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C4 | N5 | sing | 1.47Å | 1.48Å | |
| C3 | N2 | sing | 1.47Å | 1.46Å | |
| C21 | C19 | sing | 1.51Å | 1.51Å | |
| N5 | C6 | sing | 1.47Å | 1.47Å | |
| N20 | C19 | sing | 1.34Å | 1.36Å | Aromatic |
| N20 | C16 | sing | 1.38Å | 1.35Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.50Å | Aromatic |
| C12 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| N13 | C11 | sing | 1.38Å | 1.34Å | Aromatic |
| N13 | C14 | sing | 1.37Å | 1.34Å | Aromatic |
| N2 | C7 | sing | 1.40Å | 1.40Å | |
| N2 | C1 | sing | 1.47Å | 1.46Å | |
| C6 | C1 | sing | 1.53Å | 1.53Å | |
| C11 | C10 | sing | 1.41Å | 1.49Å | Aromatic |
| C7 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C14 | sing | 1.47Å | 1.49Å | |
| C16 | C17 | doub | 1.38Å | 1.47Å | Aromatic |
| C18 | C22 | sing | 1.46Å | 1.49Å | |
| C18 | C17 | sing | 1.47Å | 1.47Å | Aromatic |
| C14 | N15 | doub | 1.31Å | 1.34Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.50Å | |
| C22 | O24 | doub | 1.21Å | 1.22Å | |
| C17 | C25 | sing | 1.48Å | 1.49Å | |
| C10 | N15 | sing | 1.36Å | 1.35Å | Aromatic |
| C10 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.37Å | 1.39Å | Aromatic |
| C29 | C25 | doub | 1.37Å | 1.38Å | Aromatic |
| C29 | N28 | sing | 1.35Å | 1.34Å | Aromatic |
| C25 | C26 | sing | 1.41Å | 1.38Å | Aromatic |
| N28 | C30 | sing | 1.46Å | 1.49Å | |
| N28 | N27 | sing | 1.40Å | 1.41Å | Aromatic |
| C26 | N27 | doub | 1.31Å | 1.35Å | Aromatic |
| C12 | H1 | sing | 1.08Å | 1.08Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C21 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C23 | H7 | sing | 1.09Å | 1.10Å | |
| C23 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.08Å | 1.08Å | |
| C29 | H11 | sing | 1.08Å | 1.08Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H13 | sing | 1.09Å | 1.10Å | |
| C30 | H14 | sing | 1.09Å | 1.10Å | |
| C30 | H15 | sing | 1.09Å | 1.10Å | |
| C30 | H16 | sing | 1.09Å | 1.10Å | |
| C31 | H17 | sing | 1.09Å | 1.10Å | |
| C31 | H18 | sing | 1.09Å | 1.10Å | |
| C31 | H19 | sing | 1.09Å | 1.10Å | |
| C4 | H20 | sing | 1.09Å | 1.10Å | |
| C4 | H21 | sing | 1.09Å | 1.10Å | |
| C6 | H22 | sing | 1.09Å | 1.10Å | |
| C6 | H23 | sing | 1.09Å | 1.10Å | |
| C8 | H24 | sing | 1.08Å | 1.08Å | |
| C9 | H25 | sing | 1.08Å | 1.08Å | |
| N13 | H26 | sing | 0.97Å | 1.00Å | |
| N20 | H28 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C31 | N5 | C4 | 109.1° | 111.0° |
| C31 | N5 | C6 | 109.2° | 111.0° |
| N5 | C31 | H17 | 109.5° | 109.4° |
| N5 | C31 | H18 | 109.5° | 109.5° |
| N5 | C31 | H19 | 109.5° | 109.5° |
| C3 | C4 | N5 | 112.2° | 109.4° |
| C4 | C3 | N2 | 104.7° | 109.4° |
| C4 | C3 | H12 | 110.7° | 109.5° |
| C4 | C3 | H13 | 110.7° | 109.5° |
| C3 | C4 | H20 | 108.8° | 109.5° |
| C3 | C4 | H21 | 108.8° | 109.5° |
| C4 | N5 | C6 | 112.1° | 110.9° |
| N5 | C4 | H20 | 108.8° | 109.5° |
| N5 | C4 | H21 | 108.8° | 109.5° |
| C3 | N2 | C7 | 119.8° | 111.0° |
| C3 | N2 | C1 | 120.3° | 110.9° |
| N2 | C3 | H12 | 110.7° | 109.5° |
| N2 | C3 | H13 | 110.6° | 109.5° |
| C21 | C19 | N20 | 124.6° | 125.5° |
| C21 | C19 | C18 | 126.1° | 125.5° |
| C19 | C21 | H4 | 109.5° | 109.5° |
| C19 | C21 | H5 | 109.5° | 109.5° |
| C19 | C21 | H6 | 109.5° | 109.5° |
| N5 | C6 | C1 | 111.0° | 109.4° |
| N5 | C6 | H22 | 109.1° | 109.5° |
| N5 | C6 | H23 | 109.1° | 109.5° |
| C19 | N20 | C16 | 110.1° | 110.6° |
| N20 | C19 | C18 | 109.3° | 109.0° |
| C19 | N20 | H28 | 124.9° | 124.7° |
| N20 | C16 | C14 | 121.0° | 125.8° |
| N20 | C16 | C17 | 111.6° | 108.3° |
| C16 | N20 | H28 | 125.0° | 124.7° |
| C19 | C18 | C22 | 126.0° | 126.9° |
| C19 | C18 | C17 | 104.9° | 106.2° |
| C11 | C12 | C7 | 119.7° | 119.7° |
| C12 | C11 | N13 | 133.2° | 133.8° |
| C12 | C11 | C10 | 119.7° | 119.9° |
| C11 | C12 | H1 | 120.2° | 120.1° |
| C12 | C7 | N2 | 118.8° | 119.8° |
| C12 | C7 | C8 | 120.8° | 120.3° |
| C7 | C12 | H1 | 120.1° | 120.2° |
| C11 | N13 | C14 | 104.4° | 107.2° |
| N13 | C11 | C10 | 107.1° | 106.3° |
| C11 | N13 | H26 | 127.8° | 126.5° |
| N13 | C14 | C16 | 118.9° | 125.2° |
| N13 | C14 | N15 | 116.8° | 109.7° |
| C14 | N13 | H26 | 127.8° | 126.4° |
| C7 | N2 | C1 | 119.9° | 111.0° |
| N2 | C7 | C8 | 120.4° | 119.8° |
| N2 | C1 | C6 | 106.0° | 109.4° |
| N2 | C1 | H2 | 110.4° | 109.5° |
| N2 | C1 | H3 | 110.3° | 109.4° |
| C6 | C1 | H2 | 110.3° | 109.5° |
| C6 | C1 | H3 | 110.3° | 109.5° |
| C1 | C6 | H22 | 109.1° | 109.5° |
| C1 | C6 | H23 | 109.1° | 109.5° |
| C11 | C10 | N15 | 107.4° | 107.2° |
| C11 | C10 | C9 | 118.5° | 119.6° |
| C7 | C8 | C9 | 121.6° | 120.6° |
| C7 | C8 | H24 | 119.2° | 119.7° |
| C14 | C16 | C17 | 127.5° | 125.9° |
| C16 | C14 | N15 | 124.3° | 125.1° |
| C16 | C17 | C18 | 104.1° | 105.8° |
| C16 | C17 | C25 | 128.1° | 127.1° |
| C22 | C18 | C17 | 129.1° | 126.9° |
| C18 | C22 | C23 | 117.6° | 119.9° |
| C18 | C22 | O24 | 120.2° | 120.0° |
| C18 | C17 | C25 | 127.7° | 127.1° |
| C14 | N15 | C10 | 104.3° | 109.6° |
| C23 | C22 | O24 | 122.2° | 120.0° |
| C22 | C23 | H7 | 109.5° | 109.5° |
| C22 | C23 | H8 | 109.5° | 109.4° |
| C22 | C23 | H9 | 109.5° | 109.4° |
| C17 | C25 | C29 | 123.0° | 126.3° |
| C17 | C25 | C26 | 122.2° | 126.2° |
| N15 | C10 | C9 | 134.1° | 133.2° |
| C10 | C9 | C8 | 119.7° | 120.0° |
| C10 | C9 | H25 | 120.1° | 120.0° |
| C9 | C8 | H24 | 119.2° | 119.7° |
| C8 | C9 | H25 | 120.1° | 120.0° |
| C25 | C29 | N28 | 101.5° | 107.6° |
| C29 | C25 | C26 | 114.7° | 107.5° |
| C25 | C29 | H11 | 129.2° | 126.2° |
| C29 | N28 | C30 | 132.9° | 125.9° |
| C29 | N28 | N27 | 112.6° | 108.2° |
| N28 | C29 | H11 | 129.2° | 126.2° |
| C25 | C26 | N27 | 103.9° | 108.1° |
| C25 | C26 | H10 | 128.0° | 126.0° |
| C30 | N28 | N27 | 114.5° | 125.9° |
| N28 | C30 | H14 | 109.5° | 109.5° |
| N28 | C30 | H15 | 109.5° | 109.5° |
| N28 | C30 | H16 | 109.5° | 109.5° |
| N28 | N27 | C26 | 107.2° | 108.6° |
| N27 | C26 | H10 | 128.0° | 125.9° |
| H2 | C1 | H3 | 109.5° | 109.6° |
| H4 | C21 | H5 | 109.4° | 109.5° |
| H4 | C21 | H6 | 109.4° | 109.4° |
| H5 | C21 | H6 | 109.5° | 109.4° |
| H7 | C23 | H8 | 109.5° | 109.5° |
| H7 | C23 | H9 | 109.5° | 109.4° |
| H8 | C23 | H9 | 109.5° | 109.5° |
| H12 | C3 | H13 | 109.5° | 109.5° |
| H14 | C30 | H15 | 109.5° | 109.5° |
| H14 | C30 | H16 | 109.4° | 109.5° |
| H15 | C30 | H16 | 109.5° | 109.4° |
| H17 | C31 | H18 | 109.5° | 109.5° |
| H17 | C31 | H19 | 109.5° | 109.5° |
| H18 | C31 | H19 | 109.5° | 109.5° |
| H20 | C4 | H21 | 109.5° | 109.5° |
| H22 | C6 | H23 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C31 | N5 | C4 | C3 | 104.8° | 176.8° |
| C31 | N5 | C4 | C6 | 121.1° | 123.8° |
| C31 | N5 | C6 | C1 | 167.0° | 176.8° |
| N5 | C31 | H17 | H18 | 120.0° | 120.0° |
| N5 | C31 | H17 | H19 | 120.0° | 120.0° |
| N5 | C31 | H18 | H19 | 120.0° | 120.1° |
| C31 | N5 | C4 | H20 | 15.6° | 63.2° |
| C31 | N5 | C4 | H21 | 134.8° | 56.9° |
| C31 | N5 | C6 | H22 | 46.8° | 56.9° |
| C31 | N5 | C6 | H23 | 72.8° | 63.2° |
| C3 | C4 | N5 | H20 | 120.4° | 119.9° |
| C3 | C4 | N5 | H21 | 120.4° | 120.0° |
| C4 | C3 | N2 | H12 | 119.3° | 120.0° |
| C4 | C3 | N2 | H13 | 119.2° | 120.0° |
| C3 | C4 | N5 | C6 | 16.3° | 59.3° |
| C4 | C3 | N2 | C7 | 133.7° | 176.8° |
| C4 | C3 | N2 | C1 | 45.7° | 59.3° |
| C4 | C3 | H12 | H13 | 122.2° | 120.1° |
| C3 | C4 | H20 | H21 | 118.8° | 120.1° |
| N5 | C4 | C3 | N2 | 61.0° | 58.4° |
| C4 | N5 | C6 | C1 | 45.9° | 59.3° |
| N5 | C4 | C3 | H12 | 179.8° | 61.6° |
| N5 | C4 | C3 | H13 | 58.3° | 178.4° |
| C4 | N5 | C31 | H17 | 180.0° | 60.0° |
| C4 | N5 | C31 | H18 | 60.0° | 180.0° |
| C4 | N5 | C31 | H19 | 60.0° | 60.0° |
| N5 | C4 | H20 | H21 | 118.7° | 120.1° |
| C4 | N5 | C6 | H22 | 74.3° | 179.3° |
| C4 | N5 | C6 | H23 | 166.2° | 60.7° |
| C3 | N2 | C7 | C12 | 38.6° | 180.0° |
| C3 | N2 | C7 | C1 | 179.4° | 123.8° |
| C3 | N2 | C1 | C6 | 12.0° | 59.3° |
| C3 | N2 | C7 | C8 | 142.1° | 0.2° |
| C3 | N2 | C1 | H2 | 107.4° | 179.2° |
| C3 | N2 | C1 | H3 | 131.4° | 60.6° |
| N2 | C3 | H12 | H13 | 122.2° | 120.0° |
| N2 | C3 | C4 | H20 | 178.6° | 61.5° |
| N2 | C3 | C4 | H21 | 59.4° | 178.4° |
| C21 | C19 | N20 | C18 | 179.7° | 179.7° |
| C21 | C19 | N20 | C16 | 179.7° | 179.8° |
| C21 | C19 | C18 | C22 | 0.8° | 0.0° |
| C21 | C19 | C18 | C17 | 179.7° | 180.0° |
| C19 | C21 | H4 | H5 | 120.0° | 120.1° |
| C19 | C21 | H4 | H6 | 120.0° | 120.0° |
| C19 | C21 | H5 | H6 | 120.0° | 120.0° |
| C21 | C19 | N20 | H28 | 0.3° | 0.3° |
| N5 | C6 | C1 | N2 | 60.8° | 58.4° |
| N5 | C6 | C1 | H22 | 120.2° | 120.0° |
| N5 | C6 | C1 | H23 | 120.2° | 120.0° |
| N5 | C6 | C1 | H2 | 58.7° | 178.3° |
| N5 | C6 | C1 | H3 | 179.8° | 61.5° |
| C6 | N5 | C31 | H17 | 57.1° | 176.2° |
| C6 | N5 | C31 | H18 | 62.9° | 56.2° |
| C6 | N5 | C31 | H19 | 177.1° | 63.8° |
| C6 | N5 | C4 | H20 | 136.7° | 60.6° |
| C6 | N5 | C4 | H21 | 104.1° | 179.3° |
| N5 | C6 | H22 | H23 | 119.3° | 120.1° |
| C19 | N20 | C16 | H28 | 180.0° | 179.6° |
| C19 | N20 | C16 | C14 | 179.6° | 179.8° |
| C19 | N20 | C16 | C17 | 0.6° | 0.4° |
| N20 | C19 | C18 | C22 | 179.6° | 179.7° |
| N20 | C19 | C18 | C17 | 0.6° | 0.3° |
| N20 | C19 | C21 | H4 | 90.2° | 85.7° |
| N20 | C19 | C21 | H5 | 149.8° | 34.4° |
| N20 | C19 | C21 | H6 | 29.8° | 154.4° |
| C16 | N20 | C19 | C18 | 0.0° | 0.4° |
| N20 | C16 | C14 | N13 | 10.7° | 0.3° |
| N20 | C16 | C14 | C17 | 178.9° | 179.7° |
| N20 | C16 | C17 | C18 | 0.9° | 0.3° |
| N20 | C16 | C14 | N15 | 169.1° | 179.7° |
| N20 | C16 | C17 | C25 | 179.5° | 179.7° |
| C19 | C18 | C17 | C16 | 0.9° | 0.0° |
| C19 | C18 | C22 | C17 | 178.7° | 179.9° |
| C19 | C18 | C22 | C23 | 137.0° | 87.6° |
| C19 | C18 | C22 | O24 | 42.3° | 92.4° |
| C19 | C18 | C17 | C25 | 179.5° | 180.0° |
| C18 | C19 | C21 | H4 | 90.2° | 94.0° |
| C18 | C19 | C21 | H5 | 29.8° | 145.9° |
| C18 | C19 | C21 | H6 | 149.8° | 26.0° |
| C18 | C19 | N20 | H28 | 180.0° | 180.0° |
| C11 | C12 | C7 | H1 | 180.0° | 179.9° |
| C12 | C11 | N13 | C10 | 179.9° | 180.0° |
| C12 | C11 | N13 | C14 | 180.0° | 180.0° |
| C11 | C12 | C7 | N2 | 179.7° | 180.0° |
| C11 | C12 | C7 | C8 | 0.4° | 0.2° |
| C12 | C11 | C10 | N15 | 179.9° | 180.0° |
| C12 | C11 | C10 | C9 | 0.2° | 0.3° |
| C12 | C11 | N13 | H26 | 0.1° | 0.1° |
| C7 | C12 | C11 | N13 | 179.8° | 180.0° |
| C12 | C7 | N2 | C8 | 179.2° | 179.8° |
| C12 | C7 | N2 | C1 | 140.8° | 56.2° |
| C7 | C12 | C11 | C10 | 0.3° | 0.0° |
| C12 | C7 | C8 | C9 | 0.4° | 0.1° |
| C12 | C7 | C8 | H24 | 179.6° | 180.0° |
| C11 | N13 | C14 | H26 | 180.0° | 179.9° |
| C11 | N13 | C14 | C16 | 179.9° | 180.0° |
| C11 | N13 | C14 | N15 | 0.1° | 0.0° |
| N13 | C11 | C10 | N15 | 0.0° | 0.0° |
| N13 | C11 | C10 | C9 | 179.9° | 179.8° |
| N13 | C11 | C12 | H1 | 0.2° | 0.1° |
| C14 | N13 | C11 | C10 | 0.0° | 0.0° |
| N13 | C14 | C16 | N15 | 179.8° | 180.0° |
| N13 | C14 | C16 | C17 | 168.2° | 179.9° |
| N13 | C14 | N15 | C10 | 0.1° | 0.0° |
| C7 | N2 | C1 | C6 | 168.6° | 176.8° |
| N2 | C7 | C8 | C9 | 179.6° | 179.9° |
| N2 | C7 | C12 | H1 | 0.3° | 0.1° |
| C7 | N2 | C1 | H2 | 71.9° | 56.9° |
| C7 | N2 | C1 | H3 | 49.2° | 63.3° |
| C7 | N2 | C3 | H12 | 14.4° | 63.2° |
| C7 | N2 | C3 | H13 | 107.1° | 56.8° |
| N2 | C7 | C8 | H24 | 0.4° | 0.1° |
| N2 | C1 | C6 | H2 | 119.5° | 119.9° |
| N2 | C1 | C6 | H3 | 119.5° | 119.9° |
| C1 | N2 | C7 | C8 | 38.5° | 123.6° |
| N2 | C1 | H2 | H3 | 121.6° | 120.0° |
| C1 | N2 | C3 | H12 | 164.9° | 60.7° |
| C1 | N2 | C3 | H13 | 73.5° | 179.3° |
| N2 | C1 | C6 | H22 | 59.5° | 178.3° |
| N2 | C1 | C6 | H23 | 179.0° | 61.6° |
| C6 | C1 | H2 | H3 | 121.6° | 120.1° |
| C1 | C6 | H22 | H23 | 119.3° | 120.1° |
| C11 | C10 | N15 | C14 | 0.0° | 0.0° |
| C11 | C10 | N15 | C9 | 179.9° | 179.7° |
| C11 | C10 | C9 | C8 | 0.1° | 0.3° |
| C10 | C11 | C12 | H1 | 179.7° | 179.9° |
| C11 | C10 | C9 | H25 | 179.9° | 179.8° |
| C10 | C11 | N13 | H26 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 0.2° | 0.1° |
| C7 | C8 | C9 | H24 | 180.0° | 179.9° |
| C8 | C7 | C12 | H1 | 179.6° | 179.8° |
| C7 | C8 | C9 | H25 | 179.8° | 180.0° |
| C14 | C16 | C17 | C18 | 179.9° | 180.0° |
| C14 | C16 | C17 | C25 | 1.5° | 0.0° |
| C16 | C14 | N15 | C10 | 179.9° | 180.0° |
| C16 | C14 | N13 | H26 | 0.1° | 0.1° |
| C14 | C16 | N20 | H28 | 0.4° | 0.2° |
| C16 | C17 | C18 | C22 | 179.8° | 180.0° |
| C16 | C17 | C18 | C25 | 178.6° | 180.0° |
| C17 | C16 | C14 | N15 | 12.0° | 0.0° |
| C16 | C17 | C25 | C29 | 55.7° | 65.3° |
| C16 | C17 | C25 | C26 | 124.0° | 115.0° |
| C17 | C16 | N20 | H28 | 179.4° | 180.0° |
| C18 | C22 | C23 | O24 | 179.2° | 180.0° |
| C22 | C18 | C17 | C25 | 1.6° | 0.0° |
| C18 | C22 | C23 | H7 | 179.2° | 5.0° |
| C18 | C22 | C23 | H8 | 59.2° | 125.1° |
| C18 | C22 | C23 | H9 | 60.8° | 115.0° |
| C17 | C18 | C22 | C23 | 41.8° | 92.4° |
| C17 | C18 | C22 | O24 | 139.0° | 87.5° |
| C18 | C17 | C25 | C29 | 126.1° | 114.8° |
| C18 | C17 | C25 | C26 | 54.3° | 65.0° |
| C14 | N15 | C10 | C9 | 179.8° | 179.7° |
| N15 | C14 | N13 | H26 | 179.9° | 179.9° |
| C22 | C23 | H7 | H8 | 120.0° | 120.0° |
| C22 | C23 | H7 | H9 | 120.0° | 120.0° |
| C22 | C23 | H8 | H9 | 120.0° | 119.9° |
| O24 | C22 | C23 | H7 | 0.0° | 175.0° |
| O24 | C22 | C23 | H8 | 120.0° | 54.9° |
| O24 | C22 | C23 | H9 | 120.0° | 65.0° |
| C17 | C25 | C29 | C26 | 179.6° | 179.8° |
| C17 | C25 | C29 | N28 | 179.9° | 180.0° |
| C17 | C25 | C26 | N27 | 179.9° | 180.0° |
| C17 | C25 | C26 | H10 | 0.1° | 0.1° |
| C17 | C25 | C29 | H11 | 0.1° | 0.0° |
| N15 | C10 | C9 | C8 | 180.0° | 180.0° |
| N15 | C10 | C9 | H25 | 0.0° | 0.1° |
| C10 | C9 | C8 | H25 | 180.0° | 179.9° |
| C10 | C9 | C8 | H24 | 179.8° | 179.8° |
| C25 | C29 | N28 | H11 | 180.0° | 179.9° |
| C25 | C29 | N28 | C30 | 180.0° | 180.0° |
| C25 | C29 | N28 | N27 | 0.1° | 0.1° |
| C29 | C25 | C26 | N27 | 0.3° | 0.2° |
| C29 | C25 | C26 | H10 | 179.7° | 179.8° |
| N28 | C29 | C25 | C26 | 0.3° | 0.2° |
| C29 | N28 | C30 | N27 | 179.9° | 179.9° |
| C29 | N28 | N27 | C26 | 0.0° | 0.0° |
| C29 | N28 | C30 | H14 | 179.9° | 90.0° |
| C29 | N28 | C30 | H15 | 60.1° | 150.0° |
| C29 | N28 | C30 | H16 | 59.9° | 30.1° |
| C25 | C26 | N27 | N28 | 0.2° | 0.2° |
| C25 | C26 | N27 | H10 | 180.0° | 179.9° |
| C26 | C25 | C29 | H11 | 179.7° | 179.7° |
| C30 | N28 | N27 | C26 | 179.9° | 179.9° |
| C30 | N28 | C29 | H11 | 0.1° | 0.1° |
| N28 | C30 | H14 | H15 | 120.0° | 120.0° |
| N28 | C30 | H14 | H16 | 120.0° | 120.0° |
| N28 | C30 | H15 | H16 | 120.0° | 120.0° |
| N28 | N27 | C26 | H10 | 179.8° | 179.9° |
| N27 | N28 | C29 | H11 | 179.8° | 179.8° |
| N27 | N28 | C30 | H14 | 0.0° | 90.1° |
| N27 | N28 | C30 | H15 | 120.0° | 29.9° |
| N27 | N28 | C30 | H16 | 120.0° | 149.9° |
| H2 | C1 | C6 | H22 | 178.9° | 61.7° |
| H2 | C1 | C6 | H23 | 61.6° | 58.3° |
| H3 | C1 | C6 | H22 | 60.0° | 58.4° |
| H3 | C1 | C6 | H23 | 59.5° | 178.5° |
| H4 | C21 | H5 | H6 | 119.9° | 119.9° |
| H7 | C23 | H8 | H9 | 120.0° | 120.0° |
| H12 | C3 | C4 | H20 | 59.4° | 178.5° |
| H12 | C3 | C4 | H21 | 59.8° | 58.4° |
| H13 | C3 | C4 | H20 | 62.1° | 58.4° |
| H13 | C3 | C4 | H21 | 178.6° | 61.7° |
| H14 | C30 | H15 | H16 | 120.0° | 120.0° |
| H17 | C31 | H18 | H19 | 120.0° | 120.0° |
| H24 | C8 | C9 | H25 | 0.2° | 0.1° |
