YXD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | N3 | sing | 1.47Å | 1.46Å | |
| N3 | N4 | sing | 1.40Å | 1.35Å | Aromatic |
| N3 | C20 | sing | 1.35Å | 1.34Å | Aromatic |
| N4 | C22 | doub | 1.31Å | 1.32Å | Aromatic |
| C20 | C19 | doub | 1.36Å | 1.38Å | Aromatic |
| C22 | C19 | sing | 1.41Å | 1.40Å | Aromatic |
| F2 | C4 | sing | 1.40Å | 1.33Å | |
| F1 | C4 | sing | 1.40Å | 1.33Å | |
| C19 | C18 | sing | 1.48Å | 1.48Å | |
| C4 | F | sing | 1.40Å | 1.34Å | |
| C4 | C3 | sing | 1.51Å | 1.52Å | |
| C18 | C17 | doub | 1.40Å | 1.39Å | Aromatic |
| C18 | N5 | sing | 1.32Å | 1.34Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.38Å | Aromatic |
| N5 | C | doub | 1.33Å | 1.34Å | Aromatic |
| N1 | C3 | doub | 1.32Å | 1.34Å | Aromatic |
| N1 | C5 | sing | 1.32Å | 1.34Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.41Å | Aromatic |
| C16 | C15 | doub | 1.39Å | 1.38Å | Aromatic |
| C | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C | C1 | sing | 1.48Å | 1.50Å | |
| N | C2 | sing | 1.40Å | 1.41Å | |
| N | C1 | sing | 1.35Å | 1.35Å | |
| C5 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C2 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
| C1 | O | doub | 1.22Å | 1.23Å | |
| C14 | C6 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | N2 | sing | 1.40Å | 1.41Å | |
| N2 | C7 | sing | 1.48Å | 1.46Å | |
| N2 | C13 | sing | 1.47Å | 1.46Å | |
| C7 | C8 | sing | 1.55Å | 1.53Å | |
| C13 | C9 | sing | 1.54Å | 1.52Å | |
| C8 | C9 | sing | 1.55Å | 1.55Å | |
| C9 | C10 | sing | 1.53Å | 1.55Å | |
| O1 | C10 | sing | 1.43Å | 1.44Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | C12 | sing | 1.53Å | 1.52Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.08Å | 1.08Å | |
| C17 | H9 | sing | 1.08Å | 1.08Å | |
| C20 | H10 | sing | 1.08Å | 1.08Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.08Å | 1.08Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| O1 | H19 | sing | 0.97Å | 0.95Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.08Å | 1.08Å | |
| N | H24 | sing | 0.97Å | 1.00Å | |
| C16 | H25 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | N3 | N4 | 120.1° | 125.9° |
| C21 | N3 | C20 | 127.7° | 125.9° |
| N3 | C21 | H11 | 109.5° | 109.4° |
| N3 | C21 | H12 | 109.5° | 109.4° |
| N3 | C21 | H13 | 109.5° | 109.5° |
| N4 | N3 | C20 | 112.2° | 108.2° |
| N3 | N4 | C22 | 104.5° | 108.6° |
| N3 | C20 | C19 | 107.1° | 107.6° |
| N3 | C20 | H10 | 126.4° | 126.2° |
| N4 | C22 | C19 | 112.1° | 108.1° |
| N4 | C22 | H14 | 123.9° | 125.9° |
| C20 | C19 | C22 | 104.0° | 107.5° |
| C20 | C19 | C18 | 127.7° | 126.3° |
| C19 | C20 | H10 | 126.4° | 126.2° |
| C22 | C19 | C18 | 128.2° | 126.2° |
| C19 | C22 | H14 | 124.0° | 126.0° |
| F2 | C4 | F1 | 106.9° | 109.4° |
| F2 | C4 | F | 107.2° | 109.5° |
| F2 | C4 | C3 | 112.7° | 109.4° |
| F1 | C4 | F | 105.2° | 109.5° |
| F1 | C4 | C3 | 112.2° | 109.5° |
| C19 | C18 | C17 | 121.3° | 119.7° |
| C19 | C18 | N5 | 115.9° | 119.6° |
| F | C4 | C3 | 112.1° | 109.5° |
| C4 | C3 | N1 | 116.0° | 119.6° |
| C4 | C3 | C2 | 121.3° | 119.6° |
| C17 | C18 | N5 | 122.7° | 120.7° |
| C18 | C17 | C16 | 118.5° | 119.3° |
| C18 | C17 | H9 | 120.8° | 120.4° |
| C18 | N5 | C | 117.9° | 121.5° |
| C17 | C16 | C15 | 119.5° | 118.6° |
| C16 | C17 | H9 | 120.7° | 120.4° |
| C17 | C16 | H25 | 120.2° | 120.7° |
| N5 | C | C15 | 122.9° | 120.6° |
| N5 | C | C1 | 117.3° | 119.7° |
| C3 | N1 | C5 | 118.3° | 121.9° |
| N1 | C3 | C2 | 122.6° | 120.8° |
| N1 | C5 | C6 | 123.8° | 120.8° |
| N1 | C5 | H1 | 118.1° | 119.6° |
| C3 | C2 | N | 116.4° | 120.5° |
| C3 | C2 | C14 | 118.4° | 119.1° |
| C16 | C15 | C | 118.4° | 119.3° |
| C16 | C15 | H8 | 120.8° | 120.3° |
| C15 | C16 | H25 | 120.2° | 120.7° |
| C15 | C | C1 | 119.8° | 119.7° |
| C | C15 | H8 | 120.8° | 120.4° |
| C | C1 | N | 113.9° | 120.0° |
| C | C1 | O | 121.7° | 120.0° |
| C2 | N | C1 | 130.1° | 120.0° |
| N | C2 | C14 | 125.2° | 120.4° |
| C2 | N | H24 | 114.9° | 120.0° |
| N | C1 | O | 124.4° | 119.9° |
| C1 | N | H24 | 115.0° | 120.0° |
| C5 | C6 | C14 | 117.4° | 119.1° |
| C5 | C6 | N2 | 121.2° | 120.5° |
| C6 | C5 | H1 | 118.1° | 119.6° |
| C2 | C14 | C6 | 119.4° | 118.3° |
| C2 | C14 | H23 | 120.3° | 120.9° |
| C14 | C6 | N2 | 121.4° | 120.5° |
| C6 | C14 | H23 | 120.3° | 120.8° |
| C6 | N2 | C7 | 124.1° | 111.0° |
| C6 | N2 | C13 | 124.6° | 111.0° |
| C7 | N2 | C13 | 110.9° | 108.6° |
| N2 | C7 | C8 | 103.4° | 104.8° |
| N2 | C7 | H2 | 111.0° | 110.4° |
| N2 | C7 | H3 | 111.0° | 110.5° |
| N2 | C13 | C9 | 102.9° | 107.2° |
| N2 | C13 | H6 | 111.1° | 109.9° |
| N2 | C13 | H7 | 111.1° | 110.0° |
| C7 | C8 | C9 | 107.3° | 101.6° |
| C8 | C7 | H2 | 111.0° | 110.4° |
| C8 | C7 | H3 | 111.0° | 110.3° |
| C7 | C8 | H4 | 110.0° | 111.0° |
| C7 | C8 | H5 | 110.0° | 111.0° |
| C13 | C9 | C8 | 103.3° | 103.1° |
| C13 | C9 | C10 | 120.4° | 110.7° |
| C9 | C13 | H6 | 111.1° | 109.9° |
| C9 | C13 | H7 | 111.1° | 109.9° |
| C13 | C9 | H15 | 105.6° | 110.7° |
| C8 | C9 | C10 | 115.7° | 110.7° |
| C9 | C8 | H4 | 110.0° | 110.9° |
| C9 | C8 | H5 | 110.0° | 111.0° |
| C8 | C9 | H15 | 105.3° | 110.7° |
| C9 | C10 | O1 | 108.6° | 109.5° |
| C9 | C10 | C11 | 112.8° | 109.5° |
| C9 | C10 | C12 | 111.7° | 109.4° |
| C10 | C9 | H15 | 105.3° | 110.8° |
| O1 | C10 | C11 | 106.6° | 109.5° |
| O1 | C10 | C12 | 106.4° | 109.5° |
| C10 | O1 | H19 | 109.5° | 114.0° |
| C11 | C10 | C12 | 110.4° | 109.4° |
| C10 | C11 | H20 | 109.5° | 109.5° |
| C10 | C11 | H21 | 109.5° | 109.4° |
| C10 | C11 | H22 | 109.5° | 109.5° |
| C10 | C12 | H16 | 109.5° | 109.5° |
| C10 | C12 | H17 | 109.4° | 109.5° |
| C10 | C12 | H18 | 109.5° | 109.4° |
| H2 | C7 | H3 | 109.5° | 110.4° |
| H4 | C8 | H5 | 109.5° | 110.9° |
| H6 | C13 | H7 | 109.4° | 109.8° |
| H11 | C21 | H12 | 109.5° | 109.5° |
| H11 | C21 | H13 | 109.5° | 109.5° |
| H12 | C21 | H13 | 109.5° | 109.6° |
| H16 | C12 | H17 | 109.5° | 109.5° |
| H16 | C12 | H18 | 109.4° | 109.5° |
| H17 | C12 | H18 | 109.5° | 109.5° |
| H20 | C11 | H21 | 109.4° | 109.4° |
| H20 | C11 | H22 | 109.5° | 109.5° |
| H21 | C11 | H22 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | N3 | N4 | C20 | 179.3° | 179.7° |
| C21 | N3 | N4 | C22 | 179.5° | 179.7° |
| C21 | N3 | C20 | C19 | 178.7° | 179.7° |
| C21 | N3 | C20 | H10 | 1.3° | 0.3° |
| N3 | C21 | H11 | H12 | 120.0° | 119.9° |
| N3 | C21 | H11 | H13 | 120.0° | 120.0° |
| N3 | C21 | H12 | H13 | 120.0° | 120.0° |
| N4 | N3 | C20 | C19 | 0.5° | 0.1° |
| N3 | N4 | C22 | C19 | 0.8° | 0.0° |
| N4 | N3 | C20 | H10 | 179.5° | 180.0° |
| N4 | N3 | C21 | H11 | 0.0° | 90.0° |
| N4 | N3 | C21 | H12 | 120.0° | 150.0° |
| N4 | N3 | C21 | H13 | 120.0° | 29.9° |
| N3 | N4 | C22 | H14 | 179.2° | 180.0° |
| C20 | N3 | N4 | C22 | 0.2° | 0.0° |
| N3 | C20 | C19 | H10 | 180.0° | 180.0° |
| N3 | C20 | C19 | C22 | 1.0° | 0.0° |
| N3 | C20 | C19 | C18 | 178.5° | 180.0° |
| C20 | N3 | C21 | H11 | 179.2° | 90.3° |
| C20 | N3 | C21 | H12 | 59.2° | 29.6° |
| C20 | N3 | C21 | H13 | 60.8° | 149.7° |
| N4 | C22 | C19 | C20 | 1.1° | 0.0° |
| N4 | C22 | C19 | H14 | 180.0° | 180.0° |
| N4 | C22 | C19 | C18 | 178.7° | 180.0° |
| C20 | C19 | C22 | C18 | 177.5° | 180.0° |
| C20 | C19 | C18 | C17 | 165.1° | 180.0° |
| C20 | C19 | C18 | N5 | 18.0° | 0.3° |
| C20 | C19 | C22 | H14 | 178.9° | 180.0° |
| C22 | C19 | C18 | C17 | 11.8° | 0.0° |
| C22 | C19 | C18 | N5 | 165.1° | 179.7° |
| C22 | C19 | C20 | H10 | 179.0° | 180.0° |
| F2 | C4 | F1 | F | 113.8° | 120.0° |
| F2 | C4 | F1 | C3 | 124.0° | 119.9° |
| F2 | C4 | F | C3 | 124.2° | 120.0° |
| F2 | C4 | C3 | N1 | 5.1° | 125.0° |
| F2 | C4 | C3 | C2 | 178.7° | 55.0° |
| F1 | C4 | F | C3 | 122.3° | 120.1° |
| F1 | C4 | C3 | N1 | 125.9° | 115.0° |
| F1 | C4 | C3 | C2 | 57.9° | 65.0° |
| C19 | C18 | C17 | N5 | 176.6° | 179.7° |
| C19 | C18 | C17 | C16 | 179.2° | 180.0° |
| C19 | C18 | N5 | C | 179.2° | 179.8° |
| C19 | C18 | C17 | H9 | 0.8° | 0.6° |
| C18 | C19 | C20 | H10 | 1.5° | 0.0° |
| C18 | C19 | C22 | H14 | 1.3° | 0.1° |
| F | C4 | C3 | N1 | 116.0° | 5.0° |
| F | C4 | C3 | C2 | 60.2° | 175.0° |
| C4 | C3 | N1 | C2 | 176.2° | 180.0° |
| C4 | C3 | N1 | C5 | 174.3° | 180.0° |
| C4 | C3 | C2 | N | 3.7° | 0.0° |
| C4 | C3 | C2 | C14 | 174.5° | 180.0° |
| C18 | C17 | C16 | H9 | 180.0° | 179.4° |
| C17 | C18 | N5 | C | 2.4° | 0.1° |
| C18 | C17 | C16 | C15 | 0.9° | 0.5° |
| C18 | C17 | C16 | H25 | 179.1° | 179.9° |
| N5 | C18 | C17 | C16 | 2.6° | 0.3° |
| C18 | N5 | C | C15 | 0.6° | 0.0° |
| C18 | N5 | C | C1 | 176.0° | 180.0° |
| N5 | C18 | C17 | H9 | 177.4° | 179.7° |
| C17 | C16 | C15 | H25 | 180.0° | 179.5° |
| C17 | C16 | C15 | C | 0.7° | 0.5° |
| C17 | C16 | C15 | H8 | 179.2° | 179.7° |
| N5 | C | C15 | C16 | 0.9° | 0.3° |
| N5 | C | C15 | C1 | 176.5° | 180.0° |
| N5 | C | C1 | N | 2.2° | 0.1° |
| N5 | C | C1 | O | 179.5° | 180.0° |
| N5 | C | C15 | H8 | 179.0° | 180.0° |
| N1 | C3 | C2 | N | 179.7° | 180.0° |
| C3 | N1 | C5 | C6 | 0.4° | 0.1° |
| N1 | C3 | C2 | C14 | 1.4° | 0.0° |
| C3 | N1 | C5 | H1 | 179.7° | 180.0° |
| C5 | N1 | C3 | C2 | 1.8° | 0.0° |
| N1 | C5 | C6 | H1 | 180.0° | 179.9° |
| N1 | C5 | C6 | C14 | 1.4° | 0.1° |
| N1 | C5 | C6 | N2 | 178.2° | 179.9° |
| C3 | C2 | N | C14 | 178.1° | 180.0° |
| C3 | C2 | N | C1 | 160.3° | 154.9° |
| C3 | C2 | C14 | C6 | 0.4° | 0.0° |
| C3 | C2 | C14 | H23 | 179.6° | 180.0° |
| C3 | C2 | N | H24 | 19.6° | 25.1° |
| C16 | C15 | C | H8 | 180.0° | 179.8° |
| C16 | C15 | C | C1 | 177.4° | 179.8° |
| C15 | C16 | C17 | H9 | 179.1° | 179.9° |
| C15 | C | C1 | N | 174.5° | 180.0° |
| C15 | C | C1 | O | 2.8° | 0.0° |
| C | C15 | C16 | H25 | 179.2° | 180.0° |
| C | C1 | N | C2 | 166.5° | 175.8° |
| C | C1 | N | O | 177.3° | 179.9° |
| C1 | C | C15 | H8 | 2.5° | 0.0° |
| C | C1 | N | H24 | 13.5° | 4.3° |
| C2 | N | C1 | H24 | 180.0° | 179.9° |
| C2 | N | C1 | O | 10.8° | 4.2° |
| N | C2 | C14 | C6 | 177.7° | 180.0° |
| N | C2 | C14 | H23 | 2.4° | 0.0° |
| C1 | N | C2 | C14 | 21.5° | 25.1° |
| C5 | C6 | C14 | C2 | 1.7° | 0.0° |
| C5 | C6 | C14 | N2 | 179.6° | 180.0° |
| C5 | C6 | N2 | C7 | 12.4° | 24.8° |
| C5 | C6 | N2 | C13 | 175.0° | 145.7° |
| C5 | C6 | C14 | H23 | 178.3° | 179.9° |
| C2 | C14 | C6 | H23 | 180.0° | 180.0° |
| C2 | C14 | C6 | N2 | 177.9° | 180.0° |
| C14 | C2 | N | H24 | 158.5° | 154.9° |
| O | C1 | N | H24 | 169.2° | 175.8° |
| C14 | C6 | N2 | C7 | 167.2° | 155.2° |
| C14 | C6 | N2 | C13 | 5.4° | 34.3° |
| C14 | C6 | C5 | H1 | 178.6° | 180.0° |
| C6 | N2 | C7 | C13 | 173.4° | 122.3° |
| C6 | N2 | C7 | C8 | 151.0° | 146.4° |
| C6 | N2 | C13 | C9 | 138.0° | 123.3° |
| N2 | C6 | C5 | H1 | 1.8° | 0.0° |
| C6 | N2 | C7 | H2 | 90.0° | 27.6° |
| C6 | N2 | C7 | H3 | 32.0° | 94.8° |
| C6 | N2 | C13 | H6 | 19.0° | 3.8° |
| C6 | N2 | C13 | H7 | 103.0° | 117.3° |
| N2 | C6 | C14 | H23 | 2.1° | 0.0° |
| N2 | C7 | C8 | H2 | 119.0° | 118.8° |
| N2 | C7 | C8 | H3 | 119.0° | 118.9° |
| C7 | N2 | C13 | C9 | 35.4° | 1.0° |
| N2 | C7 | C8 | C9 | 0.4° | 37.1° |
| N2 | C7 | H2 | H3 | 122.8° | 122.5° |
| N2 | C7 | C8 | H4 | 120.1° | 81.0° |
| N2 | C7 | C8 | H5 | 119.3° | 155.2° |
| C7 | N2 | C13 | H6 | 154.4° | 118.4° |
| C7 | N2 | C13 | H7 | 83.6° | 120.5° |
| C13 | N2 | C7 | C8 | 22.4° | 24.1° |
| N2 | C13 | C9 | H6 | 119.0° | 119.5° |
| N2 | C13 | C9 | H7 | 118.9° | 119.6° |
| N2 | C13 | C9 | C8 | 32.3° | 22.3° |
| N2 | C13 | C9 | C10 | 163.2° | 140.6° |
| C13 | N2 | C7 | H2 | 96.6° | 94.7° |
| C13 | N2 | C7 | H3 | 141.4° | 142.9° |
| N2 | C13 | H6 | H7 | 123.0° | 121.2° |
| N2 | C13 | C9 | H15 | 78.0° | 96.1° |
| C7 | C8 | C9 | C13 | 19.9° | 35.6° |
| C7 | C8 | C9 | H4 | 119.7° | 118.1° |
| C7 | C8 | C9 | H5 | 119.7° | 118.1° |
| C7 | C8 | C9 | C10 | 153.5° | 154.0° |
| C8 | C7 | H2 | H3 | 122.8° | 122.2° |
| C7 | C8 | H4 | H5 | 121.0° | 123.9° |
| C7 | C8 | C9 | H15 | 90.7° | 82.8° |
| C13 | C9 | C8 | C10 | 133.7° | 118.4° |
| C13 | C9 | C8 | H15 | 110.6° | 118.4° |
| C13 | C9 | C10 | H15 | 118.9° | 123.2° |
| C13 | C9 | C10 | O1 | 22.7° | 55.0° |
| C13 | C9 | C10 | C11 | 95.2° | 175.1° |
| C13 | C9 | C10 | C12 | 139.8° | 64.9° |
| C13 | C9 | C8 | H4 | 99.8° | 82.4° |
| C13 | C9 | C8 | H5 | 139.5° | 153.7° |
| C9 | C13 | H6 | H7 | 123.1° | 121.0° |
| C8 | C9 | C10 | H15 | 115.8° | 123.2° |
| C8 | C9 | C10 | O1 | 148.0° | 58.6° |
| C8 | C9 | C10 | C11 | 30.0° | 61.5° |
| C8 | C9 | C10 | C12 | 94.9° | 178.6° |
| C9 | C8 | C7 | H2 | 118.6° | 81.8° |
| C9 | C8 | C7 | H3 | 119.4° | 156.0° |
| C9 | C8 | H4 | H5 | 121.0° | 123.9° |
| C8 | C9 | C13 | H6 | 151.3° | 141.7° |
| C8 | C9 | C13 | H7 | 86.6° | 97.3° |
| C9 | C10 | O1 | C11 | 121.8° | 120.0° |
| C9 | C10 | O1 | C12 | 120.3° | 120.0° |
| C9 | C10 | C11 | C12 | 125.7° | 120.0° |
| C10 | C9 | C8 | H4 | 33.8° | 36.0° |
| C10 | C9 | C8 | H5 | 86.8° | 87.9° |
| C10 | C9 | C13 | H6 | 77.8° | 99.9° |
| C10 | C9 | C13 | H7 | 44.3° | 21.1° |
| C9 | C10 | C12 | H16 | 180.0° | 60.0° |
| C9 | C10 | C12 | H17 | 60.0° | 60.0° |
| C9 | C10 | C12 | H18 | 60.0° | 180.0° |
| C9 | C10 | O1 | H19 | 180.0° | 60.0° |
| C9 | C10 | C11 | H20 | 180.0° | 180.0° |
| C9 | C10 | C11 | H21 | 60.0° | 60.1° |
| C9 | C10 | C11 | H22 | 60.0° | 60.0° |
| O1 | C10 | C11 | C12 | 115.2° | 120.0° |
| O1 | C10 | C9 | H15 | 96.2° | 178.2° |
| O1 | C10 | C12 | H16 | 61.6° | 180.0° |
| O1 | C10 | C12 | H17 | 178.4° | 60.0° |
| O1 | C10 | C12 | H18 | 58.4° | 60.0° |
| O1 | C10 | C11 | H20 | 60.8° | 59.9° |
| O1 | C10 | C11 | H21 | 59.2° | 60.0° |
| O1 | C10 | C11 | H22 | 179.1° | 180.0° |
| C11 | C10 | C9 | H15 | 145.8° | 61.7° |
| C11 | C10 | C12 | H16 | 53.7° | 60.0° |
| C11 | C10 | C12 | H17 | 66.3° | 180.0° |
| C11 | C10 | C12 | H18 | 173.7° | 60.0° |
| C11 | C10 | O1 | H19 | 58.2° | 180.0° |
| C10 | C11 | H20 | H21 | 120.0° | 119.9° |
| C10 | C11 | H20 | H22 | 120.1° | 120.0° |
| C10 | C11 | H21 | H22 | 120.0° | 120.0° |
| C12 | C10 | C9 | H15 | 20.9° | 58.2° |
| C10 | C12 | H16 | H17 | 120.0° | 120.0° |
| C10 | C12 | H16 | H18 | 120.0° | 120.0° |
| C10 | C12 | H17 | H18 | 120.0° | 120.0° |
| C12 | C10 | O1 | H19 | 59.6° | 60.0° |
| C12 | C10 | C11 | H20 | 54.4° | 60.1° |
| C12 | C10 | C11 | H21 | 174.4° | 180.0° |
| C12 | C10 | C11 | H22 | 65.7° | 60.0° |
| H2 | C7 | C8 | H4 | 1.1° | 160.2° |
| H2 | C7 | C8 | H5 | 121.7° | 36.3° |
| H3 | C7 | C8 | H4 | 120.9° | 38.0° |
| H3 | C7 | C8 | H5 | 0.3° | 85.9° |
| H4 | C8 | C9 | H15 | 149.6° | 159.2° |
| H5 | C8 | C9 | H15 | 28.9° | 35.3° |
| H6 | C13 | C9 | H15 | 40.9° | 23.3° |
| H7 | C13 | C9 | H15 | 163.0° | 144.3° |
| H8 | C15 | C16 | H25 | 0.8° | 0.2° |
| H9 | C17 | C16 | H25 | 0.9° | 0.5° |
| H11 | C21 | H12 | H13 | 120.0° | 120.1° |
| H16 | C12 | H17 | H18 | 120.0° | 120.0° |
| H20 | C11 | H21 | H22 | 120.0° | 120.0° |
