X8J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | C24 | sing | 1.39Å | 1.38Å | Aromatic |
| C22 | C21 | sing | 1.40Å | 1.39Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| O | C | doub | 1.22Å | 1.22Å | |
| C21 | C | sing | 1.47Å | 1.50Å | |
| C21 | C20 | doub | 1.40Å | 1.40Å | Aromatic |
| C25 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C | N | sing | 1.33Å | 1.37Å | |
| C20 | N6 | sing | 1.39Å | 1.42Å | |
| N | C1 | sing | 1.47Å | 1.47Å | |
| N | C3 | sing | 1.39Å | 1.43Å | |
| N6 | C19 | sing | 1.47Å | 1.46Å | |
| N6 | C4 | sing | 1.39Å | 1.40Å | |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C3 | C4 | doub | 1.40Å | 1.42Å | Aromatic |
| C3 | C18 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | N1 | sing | 1.33Å | 1.34Å | Aromatic |
| C18 | N5 | doub | 1.33Å | 1.34Å | Aromatic |
| N1 | C5 | doub | 1.32Å | 1.34Å | Aromatic |
| C5 | N5 | sing | 1.32Å | 1.34Å | Aromatic |
| C5 | N2 | sing | 1.39Å | 1.36Å | |
| C17 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| N2 | C6 | sing | 1.40Å | 1.40Å | |
| C6 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.53Å | 1.52Å | |
| C15 | N3 | sing | 1.47Å | 1.46Å | |
| C10 | N3 | sing | 1.40Å | 1.39Å | |
| C10 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | N4 | sing | 1.47Å | 1.46Å | |
| N3 | C11 | sing | 1.47Å | 1.47Å | |
| N4 | C13 | sing | 1.47Å | 1.46Å | |
| N4 | C12 | sing | 1.47Å | 1.46Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C7 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C7 | O1 | sing | 1.36Å | 1.37Å | |
| O1 | C8 | sing | 1.43Å | 1.43Å | |
| C8 | H1 | sing | 1.09Å | 1.10Å | |
| C8 | H2 | sing | 1.09Å | 1.10Å | |
| C8 | H3 | sing | 1.09Å | 1.10Å | |
| N2 | H4 | sing | 0.97Å | 1.00Å | |
| C9 | H5 | sing | 1.08Å | 1.08Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H9 | sing | 1.09Å | 1.10Å | |
| C2 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C13 | H18 | sing | 1.09Å | 1.10Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.08Å | 1.08Å | |
| C17 | H24 | sing | 1.08Å | 1.08Å | |
| C18 | H25 | sing | 1.08Å | 1.08Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.08Å | 1.08Å | |
| C23 | H30 | sing | 1.08Å | 1.08Å | |
| C24 | H31 | sing | 1.08Å | 1.08Å | |
| C25 | H32 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C22 | C23 | C24 | 120.4° | 120.3° |
| C23 | C22 | C21 | 120.1° | 120.0° |
| C23 | C22 | H29 | 120.0° | 120.0° |
| C22 | C23 | H30 | 119.8° | 119.9° |
| C23 | C24 | C25 | 120.5° | 120.3° |
| C24 | C23 | H30 | 119.8° | 119.8° |
| C23 | C24 | H31 | 119.8° | 119.9° |
| C22 | C21 | C | 115.7° | 119.8° |
| C22 | C21 | C20 | 119.3° | 119.5° |
| C21 | C22 | H29 | 119.9° | 119.9° |
| C24 | C25 | C20 | 119.8° | 120.1° |
| C25 | C24 | H31 | 119.8° | 119.8° |
| C24 | C25 | H32 | 120.1° | 120.0° |
| O | C | C21 | 119.8° | 117.3° |
| O | C | N | 120.8° | 117.2° |
| C | C21 | C20 | 125.0° | 120.7° |
| C21 | C | N | 119.4° | 125.6° |
| C21 | C20 | C25 | 120.0° | 119.8° |
| C21 | C20 | N6 | 121.4° | 120.6° |
| C25 | C20 | N6 | 118.5° | 119.6° |
| C20 | C25 | H32 | 120.1° | 119.9° |
| C | N | C1 | 117.4° | 116.6° |
| C | N | C3 | 124.6° | 126.9° |
| C20 | N6 | C19 | 118.5° | 120.5° |
| C20 | N6 | C4 | 110.0° | 119.0° |
| C1 | N | C3 | 118.0° | 116.5° |
| N | C1 | C2 | 118.5° | 109.4° |
| N | C1 | H6 | 107.2° | 109.5° |
| N | C1 | H7 | 107.2° | 109.5° |
| N | C3 | C4 | 123.1° | 122.0° |
| N | C3 | C18 | 121.4° | 119.8° |
| C19 | N6 | C4 | 113.5° | 120.5° |
| N6 | C19 | H26 | 109.5° | 109.4° |
| N6 | C19 | H27 | 109.5° | 109.5° |
| N6 | C19 | H28 | 109.4° | 109.4° |
| N6 | C4 | C3 | 119.3° | 120.6° |
| N6 | C4 | N1 | 118.5° | 120.1° |
| C2 | C1 | H6 | 107.2° | 109.4° |
| C2 | C1 | H7 | 107.2° | 109.5° |
| C1 | C2 | H8 | 109.5° | 109.5° |
| C1 | C2 | H9 | 109.5° | 109.4° |
| C1 | C2 | H10 | 109.5° | 109.5° |
| C4 | C3 | C18 | 115.5° | 118.1° |
| C3 | C4 | N1 | 122.2° | 119.3° |
| C3 | C18 | N5 | 123.4° | 119.2° |
| C3 | C18 | H25 | 118.3° | 120.4° |
| C4 | N1 | C5 | 116.3° | 120.6° |
| C18 | N5 | C5 | 115.9° | 121.1° |
| N5 | C18 | H25 | 118.3° | 120.4° |
| N1 | C5 | N5 | 126.7° | 121.6° |
| N1 | C5 | N2 | 116.6° | 119.2° |
| N5 | C5 | N2 | 116.7° | 119.2° |
| C5 | N2 | C6 | 134.0° | 120.0° |
| C5 | N2 | H4 | 113.0° | 120.0° |
| C16 | C17 | C6 | 120.3° | 120.1° |
| C17 | C16 | C10 | 120.9° | 120.1° |
| C17 | C16 | H23 | 119.6° | 119.9° |
| C16 | C17 | H24 | 119.9° | 120.0° |
| C17 | C6 | N2 | 122.6° | 120.0° |
| C17 | C6 | C7 | 119.0° | 119.9° |
| C6 | C17 | H24 | 119.9° | 119.9° |
| C16 | C10 | N3 | 120.5° | 120.0° |
| C16 | C10 | C9 | 118.7° | 120.1° |
| C10 | C16 | H23 | 119.5° | 120.0° |
| N2 | C6 | C7 | 118.3° | 120.1° |
| C6 | N2 | H4 | 113.0° | 120.0° |
| C6 | C7 | C9 | 120.6° | 120.0° |
| C6 | C7 | O1 | 114.9° | 120.0° |
| C14 | C15 | N3 | 110.6° | 109.4° |
| C15 | C14 | N4 | 110.8° | 109.4° |
| C15 | C14 | H19 | 109.1° | 109.5° |
| C15 | C14 | H20 | 109.1° | 109.5° |
| C14 | C15 | H21 | 109.2° | 109.5° |
| C14 | C15 | H22 | 109.2° | 109.5° |
| C15 | N3 | C10 | 116.7° | 111.0° |
| C15 | N3 | C11 | 111.7° | 110.9° |
| N3 | C15 | H21 | 109.2° | 109.5° |
| N3 | C15 | H22 | 109.2° | 109.5° |
| N3 | C10 | C9 | 120.8° | 119.9° |
| C10 | N3 | C11 | 115.9° | 111.0° |
| C10 | C9 | C7 | 120.5° | 119.9° |
| C10 | C9 | H5 | 119.7° | 120.0° |
| C14 | N4 | C13 | 110.8° | 111.0° |
| C14 | N4 | C12 | 109.3° | 110.8° |
| N4 | C14 | H19 | 109.1° | 109.5° |
| N4 | C14 | H20 | 109.1° | 109.5° |
| N3 | C11 | C12 | 110.6° | 109.3° |
| N3 | C11 | H12 | 109.2° | 109.5° |
| N3 | C11 | H13 | 109.2° | 109.4° |
| C13 | N4 | C12 | 110.8° | 111.0° |
| N4 | C13 | H16 | 109.5° | 109.5° |
| N4 | C13 | H17 | 109.5° | 109.4° |
| N4 | C13 | H18 | 109.5° | 109.4° |
| N4 | C12 | C11 | 110.9° | 109.4° |
| N4 | C12 | H14 | 109.1° | 109.6° |
| N4 | C12 | H15 | 109.1° | 109.4° |
| C12 | C11 | H12 | 109.2° | 109.5° |
| C12 | C11 | H13 | 109.2° | 109.5° |
| C11 | C12 | H14 | 109.1° | 109.5° |
| C11 | C12 | H15 | 109.1° | 109.5° |
| C9 | C7 | O1 | 124.6° | 120.1° |
| C7 | C9 | H5 | 119.7° | 120.0° |
| C7 | O1 | C8 | 117.6° | 117.0° |
| O1 | C8 | H1 | 109.5° | 109.5° |
| O1 | C8 | H2 | 109.5° | 109.5° |
| O1 | C8 | H3 | 109.5° | 109.4° |
| H1 | C8 | H2 | 109.5° | 109.4° |
| H1 | C8 | H3 | 109.4° | 109.5° |
| H2 | C8 | H3 | 109.5° | 109.5° |
| H6 | C1 | H7 | 109.5° | 109.5° |
| H8 | C2 | H9 | 109.5° | 109.5° |
| H8 | C2 | H10 | 109.5° | 109.4° |
| H9 | C2 | H10 | 109.5° | 109.5° |
| H12 | C11 | H13 | 109.5° | 109.5° |
| H14 | C12 | H15 | 109.4° | 109.5° |
| H16 | C13 | H17 | 109.5° | 109.5° |
| H16 | C13 | H18 | 109.5° | 109.5° |
| H17 | C13 | H18 | 109.5° | 109.5° |
| H19 | C14 | H20 | 109.5° | 109.4° |
| H21 | C15 | H22 | 109.5° | 109.5° |
| H26 | C19 | H27 | 109.5° | 109.5° |
| H26 | C19 | H28 | 109.5° | 109.5° |
| H27 | C19 | H28 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C22 | C23 | C24 | H30 | 180.0° | 180.0° |
| C23 | C22 | C21 | H29 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.2° | 0.9° |
| C23 | C22 | C21 | C | 179.8° | 178.0° |
| C23 | C22 | C21 | C20 | 0.2° | 1.5° |
| C22 | C23 | C24 | H31 | 179.8° | 179.1° |
| C24 | C23 | C22 | C21 | 0.2° | 0.1° |
| C23 | C24 | C25 | H31 | 180.0° | 180.0° |
| C23 | C24 | C25 | C20 | 0.1° | 0.1° |
| C24 | C23 | C22 | H29 | 179.9° | 179.9° |
| C23 | C24 | C25 | H32 | 179.9° | 179.9° |
| C22 | C21 | C | O | 34.2° | 38.2° |
| C22 | C21 | C | C20 | 179.6° | 179.6° |
| C22 | C21 | C20 | C25 | 0.4° | 2.4° |
| C22 | C21 | C | N | 145.5° | 141.7° |
| C22 | C21 | C20 | N6 | 177.6° | 177.1° |
| C21 | C22 | C23 | H30 | 179.8° | 179.9° |
| C24 | C25 | C20 | C21 | 0.4° | 1.6° |
| C24 | C25 | C20 | H32 | 180.0° | 180.0° |
| C24 | C25 | C20 | N6 | 177.7° | 177.9° |
| C25 | C24 | C23 | H30 | 179.8° | 179.1° |
| O | C | C21 | N | 179.7° | 180.0° |
| O | C | C21 | C20 | 146.2° | 141.3° |
| O | C | N | C1 | 12.6° | 0.0° |
| O | C | N | C3 | 167.7° | 179.9° |
| C | C21 | C20 | C25 | 179.9° | 177.2° |
| C | C21 | C20 | N6 | 2.0° | 3.3° |
| C21 | C | N | C1 | 167.7° | 180.0° |
| C21 | C | N | C3 | 12.0° | 0.1° |
| C | C21 | C22 | H29 | 0.2° | 1.9° |
| C21 | C20 | C25 | N6 | 178.1° | 179.5° |
| C20 | C21 | C | N | 34.1° | 38.7° |
| C21 | C20 | N6 | C19 | 160.6° | 118.9° |
| C21 | C20 | N6 | C4 | 66.4° | 61.0° |
| C20 | C21 | C22 | H29 | 179.8° | 178.5° |
| C21 | C20 | C25 | H32 | 179.6° | 178.4° |
| C25 | C20 | N6 | C19 | 21.3° | 61.6° |
| C25 | C20 | N6 | C4 | 111.7° | 118.5° |
| C20 | C25 | C24 | H31 | 179.9° | 179.9° |
| C | N | C1 | C3 | 179.7° | 179.9° |
| C | N | C1 | C2 | 71.1° | 85.3° |
| C | N | C3 | C4 | 51.0° | 40.5° |
| C | N | C3 | C18 | 129.3° | 141.6° |
| C | N | C1 | H6 | 50.2° | 34.7° |
| C | N | C1 | H7 | 167.6° | 154.7° |
| C20 | N6 | C19 | C4 | 131.4° | 180.0° |
| C20 | N6 | C4 | C3 | 66.9° | 59.8° |
| C20 | N6 | C4 | N1 | 110.6° | 118.0° |
| C20 | N6 | C19 | H26 | 180.0° | 90.0° |
| C20 | N6 | C19 | H27 | 60.0° | 150.0° |
| C20 | N6 | C19 | H28 | 60.0° | 29.9° |
| N6 | C20 | C25 | H32 | 2.3° | 2.0° |
| N | C1 | C2 | H6 | 121.3° | 120.0° |
| N | C1 | C2 | H7 | 121.3° | 120.0° |
| C1 | N | C3 | C4 | 128.7° | 139.6° |
| C1 | N | C3 | C18 | 51.0° | 38.3° |
| N | C1 | H6 | H7 | 115.9° | 120.0° |
| N | C1 | C2 | H8 | 180.0° | 64.9° |
| N | C1 | C2 | H9 | 60.0° | 175.1° |
| N | C1 | C2 | H10 | 60.0° | 55.1° |
| N | C3 | C4 | N6 | 3.7° | 6.5° |
| C3 | N | C1 | C2 | 108.6° | 94.8° |
| N | C3 | C4 | C18 | 179.7° | 177.9° |
| N | C3 | C4 | N1 | 178.8° | 175.7° |
| N | C3 | C18 | N5 | 179.5° | 176.5° |
| C3 | N | C1 | H6 | 130.1° | 145.3° |
| C3 | N | C1 | H7 | 12.7° | 25.2° |
| N | C3 | C18 | H25 | 0.5° | 3.5° |
| C19 | N6 | C4 | C3 | 157.6° | 120.1° |
| C19 | N6 | C4 | N1 | 24.8° | 62.1° |
| N6 | C19 | H26 | H27 | 120.0° | 120.0° |
| N6 | C19 | H26 | H28 | 120.0° | 119.9° |
| N6 | C19 | H27 | H28 | 120.0° | 120.0° |
| N6 | C4 | C3 | N1 | 177.4° | 177.8° |
| N6 | C4 | C3 | C18 | 176.6° | 175.6° |
| N6 | C4 | N1 | C5 | 176.6° | 176.3° |
| C4 | N6 | C19 | H26 | 48.6° | 90.0° |
| C4 | N6 | C19 | H27 | 71.4° | 30.0° |
| C4 | N6 | C19 | H28 | 168.6° | 150.0° |
| C2 | C1 | H6 | H7 | 115.9° | 120.0° |
| C1 | C2 | H8 | H9 | 120.0° | 120.0° |
| C1 | C2 | H8 | H10 | 120.0° | 120.0° |
| C1 | C2 | H9 | H10 | 120.0° | 120.0° |
| C4 | C3 | C18 | N5 | 0.2° | 1.5° |
| C3 | C4 | N1 | C5 | 0.8° | 1.6° |
| C4 | C3 | C18 | H25 | 179.8° | 178.6° |
| C18 | C3 | C4 | N1 | 0.9° | 2.2° |
| C3 | C18 | N5 | H25 | 180.0° | 179.9° |
| C3 | C18 | N5 | C5 | 0.4° | 0.0° |
| C4 | N1 | C5 | N5 | 0.1° | 0.0° |
| C4 | N1 | C5 | N2 | 179.1° | 180.0° |
| C18 | N5 | C5 | N1 | 0.5° | 0.8° |
| C18 | N5 | C5 | N2 | 178.5° | 179.2° |
| N1 | C5 | N5 | N2 | 179.0° | 180.0° |
| N1 | C5 | N2 | C6 | 1.1° | 173.9° |
| N1 | C5 | N2 | H4 | 178.9° | 6.0° |
| N5 | C5 | N2 | C6 | 178.0° | 6.1° |
| N5 | C5 | N2 | H4 | 2.0° | 174.0° |
| C5 | N5 | C18 | H25 | 179.6° | 179.9° |
| C5 | N2 | C6 | C17 | 45.1° | 30.8° |
| C5 | N2 | C6 | H4 | 180.0° | 180.0° |
| C5 | N2 | C6 | C7 | 133.1° | 149.2° |
| C16 | C17 | C6 | H24 | 180.0° | 179.2° |
| C17 | C16 | C10 | H23 | 180.0° | 179.4° |
| C16 | C17 | C6 | N2 | 177.2° | 179.5° |
| C16 | C17 | C6 | C7 | 1.0° | 0.5° |
| C17 | C16 | C10 | N3 | 177.7° | 179.5° |
| C17 | C16 | C10 | C9 | 0.8° | 0.6° |
| C6 | C17 | C16 | C10 | 0.1° | 0.8° |
| C17 | C6 | N2 | C7 | 178.2° | 180.0° |
| C17 | C6 | C7 | C9 | 0.9° | 0.0° |
| C17 | C6 | C7 | O1 | 179.3° | 179.7° |
| C17 | C6 | N2 | H4 | 134.9° | 149.1° |
| C6 | C17 | C16 | H23 | 179.9° | 179.8° |
| C16 | C10 | N3 | C15 | 39.2° | 123.7° |
| C16 | C10 | N3 | C9 | 178.5° | 180.0° |
| C16 | C10 | N3 | C11 | 95.6° | 0.0° |
| C16 | C10 | C9 | C7 | 0.9° | 0.0° |
| C16 | C10 | C9 | H5 | 179.1° | 180.0° |
| C10 | C16 | C17 | H24 | 179.9° | 180.0° |
| N2 | C6 | C7 | C9 | 177.4° | 180.0° |
| N2 | C6 | C7 | O1 | 2.5° | 0.3° |
| N2 | C6 | C17 | H24 | 2.8° | 0.3° |
| C6 | C7 | C9 | C10 | 0.0° | 0.3° |
| C6 | C7 | C9 | O1 | 179.8° | 179.7° |
| C6 | C7 | O1 | C8 | 179.5° | 179.7° |
| C7 | C6 | N2 | H4 | 46.9° | 30.8° |
| C6 | C7 | C9 | H5 | 179.9° | 179.7° |
| C7 | C6 | C17 | H24 | 179.1° | 179.7° |
| C14 | C15 | N3 | H21 | 120.2° | 120.0° |
| C14 | C15 | N3 | H22 | 120.2° | 120.0° |
| C14 | C15 | N3 | C10 | 168.9° | 176.9° |
| C15 | C14 | N4 | H19 | 120.2° | 120.0° |
| C15 | C14 | N4 | H20 | 120.2° | 120.0° |
| C14 | C15 | N3 | C11 | 54.4° | 59.3° |
| C15 | C14 | N4 | C13 | 178.5° | 176.9° |
| C15 | C14 | N4 | C12 | 59.2° | 59.3° |
| C15 | C14 | H19 | H20 | 119.4° | 120.0° |
| C14 | C15 | H21 | H22 | 119.5° | 120.0° |
| C15 | N3 | C10 | C11 | 134.8° | 123.8° |
| C15 | N3 | C10 | C9 | 142.3° | 56.2° |
| N3 | C15 | C14 | N4 | 56.9° | 58.4° |
| C15 | N3 | C11 | C12 | 54.5° | 59.3° |
| C15 | N3 | C11 | H12 | 65.6° | 60.6° |
| C15 | N3 | C11 | H13 | 174.7° | 179.3° |
| N3 | C15 | C14 | H19 | 63.3° | 178.4° |
| N3 | C15 | C14 | H20 | 177.1° | 61.6° |
| N3 | C15 | H21 | H22 | 119.5° | 120.1° |
| C10 | N3 | C11 | C12 | 168.4° | 176.8° |
| N3 | C10 | C9 | C7 | 177.6° | 180.0° |
| N3 | C10 | C9 | H5 | 2.4° | 0.0° |
| C10 | N3 | C11 | H12 | 71.4° | 63.2° |
| C10 | N3 | C11 | H13 | 48.2° | 56.8° |
| C10 | N3 | C15 | H21 | 70.9° | 56.9° |
| C10 | N3 | C15 | H22 | 48.7° | 63.2° |
| N3 | C10 | C16 | H23 | 2.3° | 0.1° |
| C9 | C10 | N3 | C11 | 82.9° | 180.0° |
| C10 | C9 | C7 | H5 | 180.0° | 180.0° |
| C10 | C9 | C7 | O1 | 179.8° | 180.0° |
| C9 | C10 | C16 | H23 | 179.2° | 179.9° |
| C14 | N4 | C13 | C12 | 121.5° | 123.7° |
| C14 | N4 | C12 | C11 | 59.4° | 59.4° |
| C14 | N4 | C12 | H14 | 60.9° | 60.7° |
| C14 | N4 | C12 | H15 | 179.6° | 179.3° |
| C14 | N4 | C13 | H16 | 180.0° | 63.8° |
| C14 | N4 | C13 | H17 | 60.0° | 56.2° |
| C14 | N4 | C13 | H18 | 60.0° | 176.2° |
| N4 | C14 | H19 | H20 | 119.4° | 120.0° |
| N4 | C14 | C15 | H21 | 63.3° | 178.4° |
| N4 | C14 | C15 | H22 | 177.1° | 61.6° |
| N3 | C11 | C12 | N4 | 57.2° | 58.5° |
| N3 | C11 | C12 | H12 | 120.2° | 119.9° |
| N3 | C11 | C12 | H13 | 120.2° | 119.9° |
| N3 | C11 | H12 | H13 | 119.5° | 120.0° |
| N3 | C11 | C12 | H14 | 63.1° | 61.6° |
| N3 | C11 | C12 | H15 | 177.4° | 178.3° |
| C11 | N3 | C15 | H21 | 65.8° | 179.3° |
| C11 | N3 | C15 | H22 | 174.6° | 60.7° |
| C13 | N4 | C12 | C11 | 178.3° | 176.8° |
| C13 | N4 | C12 | H14 | 61.4° | 63.2° |
| C13 | N4 | C12 | H15 | 58.1° | 56.9° |
| N4 | C13 | H16 | H17 | 120.0° | 120.0° |
| N4 | C13 | H16 | H18 | 120.0° | 120.0° |
| N4 | C13 | H17 | H18 | 120.0° | 119.9° |
| C13 | N4 | C14 | H19 | 61.3° | 56.8° |
| C13 | N4 | C14 | H20 | 58.3° | 63.1° |
| N4 | C12 | C11 | H14 | 120.2° | 120.1° |
| N4 | C12 | C11 | H15 | 120.2° | 119.9° |
| N4 | C12 | C11 | H12 | 63.0° | 61.5° |
| N4 | C12 | C11 | H13 | 177.3° | 178.4° |
| N4 | C12 | H14 | H15 | 119.4° | 120.0° |
| C12 | N4 | C13 | H16 | 58.5° | 59.9° |
| C12 | N4 | C13 | H17 | 61.5° | 180.0° |
| C12 | N4 | C13 | H18 | 178.5° | 60.1° |
| C12 | N4 | C14 | H19 | 61.0° | 179.4° |
| C12 | N4 | C14 | H20 | 179.4° | 60.7° |
| C12 | C11 | H12 | H13 | 119.5° | 120.1° |
| C11 | C12 | H14 | H15 | 119.3° | 120.0° |
| C9 | C7 | O1 | C8 | 0.4° | 0.0° |
| C7 | O1 | C8 | H1 | 180.0° | 60.0° |
| C7 | O1 | C8 | H2 | 60.0° | 60.0° |
| C7 | O1 | C8 | H3 | 60.0° | 180.0° |
| O1 | C7 | C9 | H5 | 0.2° | 0.0° |
| O1 | C8 | H1 | H2 | 120.0° | 120.0° |
| O1 | C8 | H1 | H3 | 120.0° | 120.0° |
| O1 | C8 | H2 | H3 | 120.0° | 120.0° |
| H1 | C8 | H2 | H3 | 120.0° | 120.0° |
| H6 | C1 | C2 | H8 | 58.7° | 175.1° |
| H6 | C1 | C2 | H9 | 178.7° | 55.1° |
| H6 | C1 | C2 | H10 | 61.3° | 64.9° |
| H7 | C1 | C2 | H8 | 58.7° | 55.1° |
| H7 | C1 | C2 | H9 | 61.3° | 64.9° |
| H7 | C1 | C2 | H10 | 178.7° | 175.0° |
| H8 | C2 | H9 | H10 | 120.0° | 120.0° |
| H12 | C11 | C12 | H14 | 176.8° | 178.5° |
| H12 | C11 | C12 | H15 | 57.2° | 58.4° |
| H13 | C11 | C12 | H14 | 57.1° | 58.3° |
| H13 | C11 | C12 | H15 | 62.5° | 61.7° |
| H16 | C13 | H17 | H18 | 120.0° | 120.0° |
| H19 | C14 | C15 | H21 | 176.5° | 61.6° |
| H19 | C14 | C15 | H22 | 56.9° | 58.4° |
| H20 | C14 | C15 | H21 | 56.9° | 58.4° |
| H20 | C14 | C15 | H22 | 62.7° | 178.4° |
| H23 | C16 | C17 | H24 | 0.1° | 0.6° |
| H26 | C19 | H27 | H28 | 120.0° | 120.0° |
| H29 | C22 | C23 | H30 | 0.2° | 0.1° |
| H30 | C23 | C24 | H31 | 0.2° | 0.9° |
| H31 | C24 | C25 | H32 | 0.1° | 0.1° |
