0JQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | N2 | doub | 1.28Å | 1.20Å | Aromatic |
| N1 | C2 | sing | 1.34Å | 1.32Å | Aromatic |
| C11 | O2 | sing | 1.43Å | 1.43Å | |
| N2 | C7 | sing | 1.32Å | 1.30Å | Aromatic |
| C5 | C2 | doub | 1.40Å | 1.38Å | Aromatic |
| C5 | C9 | sing | 1.37Å | 1.37Å | Aromatic |
| C2 | C1 | sing | 1.42Å | 1.37Å | Aromatic |
| O2 | C9 | sing | 1.36Å | 1.31Å | |
| C7 | C4 | doub | 1.39Å | 1.36Å | Aromatic |
| C9 | C6 | doub | 1.40Å | 1.36Å | Aromatic |
| C1 | C4 | sing | 1.42Å | 1.35Å | Aromatic |
| C1 | C3 | doub | 1.40Å | 1.37Å | Aromatic |
| C4 | C8 | sing | 1.48Å | 1.37Å | |
| C6 | C3 | sing | 1.37Å | 1.37Å | Aromatic |
| C6 | O1 | sing | 1.36Å | 1.33Å | |
| C8 | C15 | doub | 1.39Å | 1.35Å | Aromatic |
| C8 | C12 | sing | 1.40Å | 1.36Å | Aromatic |
| O1 | C10 | sing | 1.43Å | 1.44Å | |
| C15 | N3 | sing | 1.32Å | 1.29Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.37Å | Aromatic |
| N3 | C14 | doub | 1.33Å | 1.30Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.37Å | Aromatic |
| C13 | C16 | sing | 1.51Å | 1.52Å | |
| C14 | N4 | sing | 1.39Å | 1.38Å | |
| C24 | N4 | sing | 1.47Å | 1.43Å | |
| C24 | C23 | sing | 1.53Å | 1.52Å | |
| N4 | C20 | sing | 1.47Å | 1.44Å | |
| C20 | C21 | sing | 1.53Å | 1.51Å | |
| C23 | C22 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.49Å | |
| C22 | C18 | sing | 1.53Å | 1.54Å | |
| O3 | C18 | sing | 1.43Å | 1.41Å | |
| C18 | C19 | sing | 1.53Å | 1.50Å | |
| C18 | C17 | sing | 1.53Å | 1.49Å | |
| C11 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.08Å | 1.08Å | |
| C7 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.08Å | 1.08Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| O3 | H30 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | N1 | C2 | 120.7° | 121.9° |
| N1 | N2 | C7 | 123.8° | 123.5° |
| N1 | C2 | C5 | 120.5° | 121.6° |
| N1 | C2 | C1 | 119.6° | 119.2° |
| C11 | O2 | C9 | 118.4° | 117.0° |
| O2 | C11 | H1 | 109.5° | 109.5° |
| O2 | C11 | H2 | 109.4° | 109.5° |
| O2 | C11 | H3 | 109.5° | 109.4° |
| N2 | C7 | C4 | 121.0° | 120.4° |
| N2 | C7 | H9 | 119.5° | 119.8° |
| C2 | C5 | C9 | 119.7° | 119.7° |
| C5 | C2 | C1 | 119.8° | 119.2° |
| C2 | C5 | H4 | 120.1° | 120.2° |
| C5 | C9 | O2 | 123.1° | 119.5° |
| C5 | C9 | C6 | 120.1° | 121.0° |
| C9 | C5 | H4 | 120.1° | 120.2° |
| C2 | C1 | C4 | 118.7° | 117.9° |
| C2 | C1 | C3 | 119.9° | 120.0° |
| O2 | C9 | C6 | 116.8° | 119.5° |
| C7 | C4 | C1 | 114.7° | 117.2° |
| C7 | C4 | C8 | 121.5° | 121.4° |
| C4 | C7 | H9 | 119.5° | 119.8° |
| C9 | C6 | C3 | 120.2° | 120.6° |
| C9 | C6 | O1 | 117.5° | 119.7° |
| C4 | C1 | C3 | 119.6° | 122.0° |
| C1 | C4 | C8 | 121.9° | 121.4° |
| C1 | C3 | C6 | 119.7° | 119.6° |
| C1 | C3 | H8 | 120.1° | 120.2° |
| C4 | C8 | C15 | 119.2° | 120.5° |
| C4 | C8 | C12 | 123.6° | 120.5° |
| C3 | C6 | O1 | 122.2° | 119.7° |
| C6 | C3 | H8 | 120.1° | 120.2° |
| C6 | O1 | C10 | 113.0° | 117.0° |
| C15 | C8 | C12 | 115.3° | 119.0° |
| C8 | C15 | N3 | 122.8° | 120.7° |
| C8 | C15 | H14 | 118.6° | 119.6° |
| C8 | C12 | C13 | 120.4° | 118.4° |
| C8 | C12 | H10 | 119.8° | 120.8° |
| O1 | C10 | H5 | 109.5° | 109.5° |
| O1 | C10 | H6 | 109.5° | 109.5° |
| O1 | C10 | H7 | 109.4° | 109.5° |
| C15 | N3 | C14 | 122.3° | 121.8° |
| N3 | C15 | H14 | 118.6° | 119.7° |
| C12 | C13 | C14 | 119.4° | 119.3° |
| C12 | C13 | C16 | 119.9° | 120.4° |
| C13 | C12 | H10 | 119.8° | 120.8° |
| N3 | C14 | C13 | 117.9° | 120.8° |
| N3 | C14 | N4 | 118.7° | 119.6° |
| C14 | C13 | C16 | 120.7° | 120.3° |
| C13 | C14 | N4 | 123.3° | 119.6° |
| C13 | C16 | H11 | 109.5° | 109.5° |
| C13 | C16 | H12 | 109.5° | 109.5° |
| C13 | C16 | H13 | 109.4° | 109.5° |
| C14 | N4 | C24 | 121.4° | 111.0° |
| C14 | N4 | C20 | 116.6° | 111.1° |
| N4 | C24 | C23 | 113.5° | 109.5° |
| C24 | N4 | C20 | 117.4° | 111.2° |
| N4 | C24 | H15 | 108.5° | 109.5° |
| N4 | C24 | H16 | 108.5° | 109.5° |
| C24 | C23 | C22 | 112.1° | 109.3° |
| C23 | C24 | H15 | 108.4° | 109.5° |
| C23 | C24 | H16 | 108.4° | 109.5° |
| C24 | C23 | H17 | 108.8° | 109.5° |
| C24 | C23 | H18 | 108.8° | 109.5° |
| N4 | C20 | C21 | 115.6° | 109.6° |
| N4 | C20 | H19 | 107.9° | 109.5° |
| N4 | C20 | H20 | 107.9° | 109.5° |
| C20 | C21 | C22 | 108.3° | 109.3° |
| C21 | C20 | H19 | 107.9° | 109.4° |
| C21 | C20 | H20 | 107.9° | 109.5° |
| C20 | C21 | H21 | 109.7° | 109.5° |
| C20 | C21 | H22 | 109.8° | 109.5° |
| C23 | C22 | C21 | 102.1° | 109.1° |
| C23 | C22 | C18 | 110.9° | 109.5° |
| C22 | C23 | H17 | 108.8° | 109.4° |
| C22 | C23 | H18 | 108.8° | 109.5° |
| C23 | C22 | H23 | 109.5° | 109.5° |
| C21 | C22 | C18 | 114.7° | 109.5° |
| C22 | C21 | H21 | 109.7° | 109.5° |
| C22 | C21 | H22 | 109.8° | 109.5° |
| C21 | C22 | H23 | 110.0° | 109.6° |
| C22 | C18 | O3 | 105.6° | 109.5° |
| C22 | C18 | C19 | 111.5° | 109.4° |
| C22 | C18 | C17 | 114.3° | 109.5° |
| C18 | C22 | H23 | 109.4° | 109.6° |
| O3 | C18 | C19 | 104.5° | 109.4° |
| O3 | C18 | C17 | 112.7° | 109.5° |
| C18 | O3 | H30 | 109.5° | 114.0° |
| C19 | C18 | C17 | 107.8° | 109.5° |
| C18 | C19 | H27 | 109.5° | 109.5° |
| C18 | C19 | H28 | 109.5° | 109.5° |
| C18 | C19 | H29 | 109.5° | 109.4° |
| C18 | C17 | H24 | 109.5° | 109.4° |
| C18 | C17 | H25 | 109.5° | 109.4° |
| C18 | C17 | H26 | 109.5° | 109.5° |
| H1 | C11 | H2 | 109.5° | 109.5° |
| H1 | C11 | H3 | 109.5° | 109.5° |
| H2 | C11 | H3 | 109.5° | 109.5° |
| H5 | C10 | H6 | 109.4° | 109.5° |
| H5 | C10 | H7 | 109.5° | 109.4° |
| H6 | C10 | H7 | 109.5° | 109.5° |
| H11 | C16 | H12 | 109.5° | 109.5° |
| H11 | C16 | H13 | 109.5° | 109.5° |
| H12 | C16 | H13 | 109.5° | 109.4° |
| H15 | C24 | H16 | 109.5° | 109.4° |
| H17 | C23 | H18 | 109.5° | 109.5° |
| H19 | C20 | H20 | 109.5° | 109.4° |
| H21 | C21 | H22 | 109.5° | 109.5° |
| H24 | C17 | H25 | 109.5° | 109.5° |
| H24 | C17 | H26 | 109.5° | 109.5° |
| H25 | C17 | H26 | 109.5° | 109.5° |
| H27 | C19 | H28 | 109.5° | 109.5° |
| H27 | C19 | H29 | 109.5° | 109.5° |
| H28 | C19 | H29 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | N1 | C2 | C5 | 179.7° | 180.0° |
| N2 | N1 | C2 | C1 | 3.1° | 0.0° |
| N1 | N2 | C7 | C4 | 4.5° | 0.0° |
| N1 | N2 | C7 | H9 | 175.5° | 180.0° |
| C2 | N1 | N2 | C7 | 0.1° | 0.0° |
| N1 | C2 | C5 | C1 | 176.6° | 180.0° |
| N1 | C2 | C5 | C9 | 179.6° | 180.0° |
| N1 | C2 | C1 | C4 | 10.7° | 0.0° |
| N1 | C2 | C1 | C3 | 175.7° | 179.7° |
| N1 | C2 | C5 | H4 | 0.4° | 0.1° |
| C11 | O2 | C9 | C5 | 3.6° | 0.3° |
| C11 | O2 | C9 | C6 | 178.6° | 180.0° |
| O2 | C11 | H1 | H2 | 120.0° | 120.0° |
| O2 | C11 | H1 | H3 | 120.0° | 119.9° |
| O2 | C11 | H2 | H3 | 120.0° | 119.9° |
| N2 | C7 | C4 | H9 | 180.0° | 180.0° |
| N2 | C7 | C4 | C1 | 11.6° | 0.0° |
| N2 | C7 | C4 | C8 | 176.3° | 179.8° |
| C2 | C5 | C9 | H4 | 180.0° | 179.9° |
| C2 | C5 | C9 | O2 | 178.1° | 180.0° |
| C2 | C5 | C9 | C6 | 0.3° | 0.3° |
| C5 | C2 | C1 | C4 | 172.6° | 180.0° |
| C5 | C2 | C1 | C3 | 7.6° | 0.3° |
| C9 | C5 | C2 | C1 | 3.8° | 0.0° |
| C5 | C9 | O2 | C6 | 177.8° | 179.7° |
| C5 | C9 | C6 | C3 | 0.6° | 0.3° |
| C5 | C9 | C6 | O1 | 178.7° | 179.7° |
| C2 | C1 | C4 | C7 | 14.3° | 0.0° |
| C2 | C1 | C4 | C3 | 165.0° | 179.7° |
| C2 | C1 | C4 | C8 | 179.0° | 179.7° |
| C2 | C1 | C3 | C6 | 7.4° | 0.3° |
| C1 | C2 | C5 | H4 | 176.2° | 179.9° |
| C2 | C1 | C3 | H8 | 172.7° | 179.7° |
| O2 | C9 | C6 | C3 | 178.5° | 180.0° |
| O2 | C9 | C6 | O1 | 0.8° | 0.0° |
| C9 | O2 | C11 | H1 | 180.0° | 60.0° |
| C9 | O2 | C11 | H2 | 60.0° | 180.0° |
| C9 | O2 | C11 | H3 | 60.0° | 60.0° |
| O2 | C9 | C5 | H4 | 1.9° | 0.1° |
| C7 | C4 | C1 | C8 | 164.7° | 179.7° |
| C7 | C4 | C1 | C3 | 179.3° | 179.7° |
| C7 | C4 | C8 | C15 | 50.0° | 129.6° |
| C7 | C4 | C8 | C12 | 113.3° | 50.0° |
| C9 | C6 | C3 | C1 | 3.2° | 0.0° |
| C9 | C6 | C3 | O1 | 179.3° | 180.0° |
| C9 | C6 | O1 | C10 | 169.4° | 180.0° |
| C6 | C9 | C5 | H4 | 179.7° | 179.8° |
| C9 | C6 | C3 | H8 | 176.8° | 180.0° |
| C4 | C1 | C3 | C6 | 172.2° | 180.0° |
| C1 | C4 | C8 | C15 | 146.4° | 50.1° |
| C1 | C4 | C8 | C12 | 50.3° | 130.3° |
| C4 | C1 | C3 | H8 | 7.8° | 0.0° |
| C1 | C4 | C7 | H9 | 168.5° | 180.0° |
| C3 | C1 | C4 | C8 | 16.0° | 0.1° |
| C1 | C3 | C6 | H8 | 180.0° | 180.0° |
| C1 | C3 | C6 | O1 | 177.5° | 180.0° |
| C4 | C8 | C15 | C12 | 164.7° | 179.6° |
| C4 | C8 | C15 | N3 | 179.0° | 180.0° |
| C4 | C8 | C12 | C13 | 175.3° | 180.0° |
| C8 | C4 | C7 | H9 | 3.7° | 0.2° |
| C4 | C8 | C12 | H10 | 4.7° | 0.0° |
| C4 | C8 | C15 | H14 | 1.0° | 0.1° |
| C3 | C6 | O1 | C10 | 11.3° | 0.0° |
| C6 | O1 | C10 | H5 | 180.0° | 180.0° |
| C6 | O1 | C10 | H6 | 60.0° | 60.0° |
| C6 | O1 | C10 | H7 | 60.0° | 60.1° |
| O1 | C6 | C3 | H8 | 2.5° | 0.0° |
| C8 | C15 | N3 | H14 | 180.0° | 179.9° |
| C15 | C8 | C12 | C13 | 11.3° | 0.3° |
| C8 | C15 | N3 | C14 | 14.7° | 0.1° |
| C15 | C8 | C12 | H10 | 168.6° | 179.7° |
| C12 | C8 | C15 | N3 | 16.3° | 0.4° |
| C8 | C12 | C13 | H10 | 180.0° | 180.0° |
| C8 | C12 | C13 | C14 | 4.9° | 0.0° |
| C8 | C12 | C13 | C16 | 175.8° | 180.0° |
| C12 | C8 | C15 | H14 | 163.6° | 179.7° |
| O1 | C10 | H5 | H6 | 120.0° | 120.1° |
| O1 | C10 | H5 | H7 | 120.0° | 120.0° |
| O1 | C10 | H6 | H7 | 120.0° | 120.0° |
| C15 | N3 | C14 | C13 | 6.9° | 0.3° |
| C15 | N3 | C14 | N4 | 177.4° | 179.9° |
| C12 | C13 | C14 | N3 | 2.2° | 0.3° |
| C12 | C13 | C14 | C16 | 179.3° | 180.0° |
| C12 | C13 | C14 | N4 | 177.7° | 180.0° |
| C12 | C13 | C16 | H11 | 90.3° | 95.2° |
| C12 | C13 | C16 | H12 | 149.6° | 144.8° |
| C12 | C13 | C16 | H13 | 29.7° | 24.8° |
| N3 | C14 | C13 | N4 | 175.5° | 179.7° |
| N3 | C14 | C13 | C16 | 178.5° | 179.7° |
| N3 | C14 | N4 | C24 | 21.5° | 61.9° |
| N3 | C14 | N4 | C20 | 133.9° | 62.3° |
| C14 | N3 | C15 | H14 | 165.3° | 180.0° |
| C13 | C14 | N4 | C24 | 163.0° | 118.5° |
| C13 | C14 | N4 | C20 | 41.6° | 117.3° |
| C14 | C13 | C12 | H10 | 175.1° | 180.0° |
| C14 | C13 | C16 | H11 | 90.4° | 84.8° |
| C14 | C13 | C16 | H12 | 29.6° | 35.2° |
| C14 | C13 | C16 | H13 | 149.6° | 155.2° |
| C16 | C13 | C14 | N4 | 3.0° | 0.0° |
| C16 | C13 | C12 | H10 | 4.2° | 0.0° |
| C13 | C16 | H11 | H12 | 120.0° | 120.0° |
| C13 | C16 | H11 | H13 | 120.0° | 120.0° |
| C13 | C16 | H12 | H13 | 120.0° | 120.0° |
| C14 | N4 | C24 | C20 | 155.2° | 124.2° |
| C14 | N4 | C24 | C23 | 173.2° | 174.1° |
| C14 | N4 | C20 | C21 | 167.8° | 174.2° |
| C14 | N4 | C24 | H15 | 66.3° | 65.9° |
| C14 | N4 | C24 | H16 | 52.6° | 54.1° |
| C14 | N4 | C20 | H19 | 46.9° | 54.1° |
| C14 | N4 | C20 | H20 | 71.3° | 65.8° |
| N4 | C24 | C23 | H15 | 120.6° | 120.0° |
| N4 | C24 | C23 | H16 | 120.6° | 120.0° |
| C24 | N4 | C20 | C21 | 35.7° | 61.7° |
| N4 | C24 | C23 | C22 | 48.7° | 59.2° |
| N4 | C24 | H15 | H16 | 118.2° | 120.0° |
| N4 | C24 | C23 | H17 | 169.1° | 179.1° |
| N4 | C24 | C23 | H18 | 71.6° | 60.8° |
| C24 | N4 | C20 | H19 | 156.6° | 178.2° |
| C24 | N4 | C20 | H20 | 85.2° | 58.3° |
| C23 | C24 | N4 | C20 | 31.6° | 61.7° |
| C24 | C23 | C22 | H17 | 120.4° | 120.0° |
| C24 | C23 | C22 | H18 | 120.4° | 120.0° |
| C24 | C23 | C22 | C21 | 66.2° | 57.7° |
| C24 | C23 | C22 | C18 | 171.1° | 177.5° |
| C23 | C24 | H15 | H16 | 118.1° | 120.0° |
| C24 | C23 | H17 | H18 | 118.8° | 120.1° |
| C24 | C23 | C22 | H23 | 50.3° | 62.2° |
| N4 | C20 | C21 | H19 | 120.9° | 120.0° |
| N4 | C20 | C21 | H20 | 120.9° | 120.1° |
| N4 | C20 | C21 | C22 | 55.5° | 59.2° |
| C20 | N4 | C24 | H15 | 89.0° | 58.3° |
| C20 | N4 | C24 | H16 | 152.2° | 178.2° |
| N4 | C20 | H19 | H20 | 117.2° | 120.0° |
| N4 | C20 | C21 | H21 | 64.3° | 60.7° |
| N4 | C20 | C21 | H22 | 175.3° | 179.2° |
| C20 | C21 | C22 | C23 | 67.5° | 57.6° |
| C20 | C21 | C22 | H21 | 119.8° | 119.9° |
| C20 | C21 | C22 | H22 | 119.8° | 120.0° |
| C20 | C21 | C22 | C18 | 172.5° | 177.5° |
| C21 | C20 | H19 | H20 | 117.2° | 119.9° |
| C20 | C21 | H21 | H22 | 120.5° | 120.1° |
| C20 | C21 | C22 | H23 | 48.8° | 62.2° |
| C23 | C22 | C21 | C18 | 120.0° | 119.9° |
| C23 | C22 | C21 | H23 | 116.2° | 119.9° |
| C23 | C22 | C18 | H23 | 120.9° | 120.2° |
| C23 | C22 | C18 | O3 | 74.0° | 60.1° |
| C23 | C22 | C18 | C19 | 38.8° | 180.0° |
| C23 | C22 | C18 | C17 | 161.4° | 60.0° |
| C22 | C23 | C24 | H15 | 71.9° | 60.8° |
| C22 | C23 | C24 | H16 | 169.3° | 179.2° |
| C22 | C23 | H17 | H18 | 118.8° | 120.1° |
| C23 | C22 | C21 | H21 | 52.3° | 62.3° |
| C23 | C22 | C21 | H22 | 172.7° | 177.6° |
| C21 | C22 | C18 | H23 | 124.1° | 120.2° |
| C21 | C22 | C18 | O3 | 170.9° | 179.7° |
| C21 | C22 | C18 | C19 | 76.2° | 60.4° |
| C21 | C22 | C18 | C17 | 46.4° | 59.7° |
| C21 | C22 | C23 | H17 | 173.4° | 177.6° |
| C21 | C22 | C23 | H18 | 54.2° | 62.3° |
| C22 | C21 | C20 | H19 | 176.3° | 179.2° |
| C22 | C21 | C20 | H20 | 65.5° | 60.9° |
| C22 | C21 | H21 | H22 | 120.6° | 120.1° |
| C22 | C18 | O3 | C19 | 117.7° | 119.9° |
| C22 | C18 | O3 | C17 | 125.5° | 120.0° |
| C22 | C18 | C19 | C17 | 126.3° | 120.0° |
| C18 | C22 | C23 | H17 | 50.8° | 62.5° |
| C18 | C22 | C23 | H18 | 68.5° | 57.6° |
| C18 | C22 | C21 | H21 | 67.7° | 57.6° |
| C18 | C22 | C21 | H22 | 52.7° | 62.5° |
| C22 | C18 | C17 | H24 | 180.0° | 60.0° |
| C22 | C18 | C17 | H25 | 60.0° | 180.0° |
| C22 | C18 | C17 | H26 | 60.0° | 60.0° |
| C22 | C18 | C19 | H27 | 180.0° | 60.0° |
| C22 | C18 | C19 | H28 | 60.0° | 180.0° |
| C22 | C18 | C19 | H29 | 60.0° | 60.1° |
| C22 | C18 | O3 | H30 | 180.0° | 180.0° |
| O3 | C18 | C19 | C17 | 120.1° | 120.0° |
| O3 | C18 | C22 | H23 | 46.9° | 60.1° |
| O3 | C18 | C17 | H24 | 59.3° | 180.0° |
| O3 | C18 | C17 | H25 | 179.3° | 60.0° |
| O3 | C18 | C17 | H26 | 60.7° | 60.0° |
| O3 | C18 | C19 | H27 | 66.4° | 60.0° |
| O3 | C18 | C19 | H28 | 53.7° | 60.1° |
| O3 | C18 | C19 | H29 | 173.6° | 180.0° |
| C19 | C18 | C22 | H23 | 159.7° | 59.8° |
| C19 | C18 | C17 | H24 | 55.4° | 60.0° |
| C19 | C18 | C17 | H25 | 64.6° | 60.0° |
| C19 | C18 | C17 | H26 | 175.4° | 180.0° |
| C18 | C19 | H27 | H28 | 120.0° | 120.0° |
| C18 | C19 | H27 | H29 | 120.0° | 120.0° |
| C18 | C19 | H28 | H29 | 120.0° | 119.9° |
| C19 | C18 | O3 | H30 | 62.3° | 60.1° |
| C17 | C18 | C22 | H23 | 77.7° | 179.9° |
| C18 | C17 | H24 | H25 | 120.0° | 119.9° |
| C18 | C17 | H24 | H26 | 120.0° | 120.0° |
| C18 | C17 | H25 | H26 | 120.0° | 120.0° |
| C17 | C18 | C19 | H27 | 53.8° | 180.0° |
| C17 | C18 | C19 | H28 | 173.8° | 59.9° |
| C17 | C18 | C19 | H29 | 66.3° | 60.0° |
| C17 | C18 | O3 | H30 | 54.5° | 60.0° |
| H1 | C11 | H2 | H3 | 120.0° | 120.0° |
| H5 | C10 | H6 | H7 | 120.0° | 119.9° |
| H11 | C16 | H12 | H13 | 120.0° | 120.0° |
| H15 | C24 | C23 | H17 | 48.5° | 59.1° |
| H15 | C24 | C23 | H18 | 167.7° | 179.2° |
| H16 | C24 | C23 | H17 | 70.3° | 60.9° |
| H16 | C24 | C23 | H18 | 49.0° | 59.3° |
| H17 | C23 | C22 | H23 | 70.0° | 57.7° |
| H18 | C23 | C22 | H23 | 170.7° | 177.8° |
| H19 | C20 | C21 | H21 | 56.5° | 59.3° |
| H19 | C20 | C21 | H22 | 63.8° | 60.8° |
| H20 | C20 | C21 | H21 | 174.7° | 179.2° |
| H20 | C20 | C21 | H22 | 54.4° | 59.1° |
| H21 | C21 | C22 | H23 | 168.6° | 177.8° |
| H22 | C21 | C22 | H23 | 71.1° | 57.7° |
| H24 | C17 | H25 | H26 | 120.0° | 120.1° |
| H27 | C19 | H28 | H29 | 120.0° | 120.0° |
