UHV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C15 | N2 | doub | 1.32Å | 1.34Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.38Å | Aromatic |
| N2 | C14 | sing | 1.32Å | 1.34Å | Aromatic |
| C16 | C17 | doub | 1.39Å | 1.38Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C | C1 | sing | 1.53Å | 1.52Å | |
| C13 | C3 | sing | 1.51Å | 1.52Å | |
| O1 | C4 | doub | 1.21Å | 1.23Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| O | C2 | doub | 1.21Å | 1.22Å | |
| C2 | N | sing | 1.35Å | 1.40Å | |
| C3 | C4 | sing | 1.51Å | 1.54Å | |
| C3 | N | sing | 1.47Å | 1.49Å | |
| C4 | N1 | sing | 1.35Å | 1.35Å | |
| N | C18 | sing | 1.40Å | 1.44Å | |
| C23 | C21 | sing | 1.53Å | 1.53Å | |
| C20 | C18 | sing | 1.42Å | 1.42Å | Aromatic |
| C20 | C19 | doub | 1.35Å | 1.34Å | Aromatic |
| C18 | N3 | doub | 1.31Å | 1.36Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| N1 | C5 | sing | 1.40Å | 1.41Å | |
| C11 | C9 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.41Å | Aromatic |
| C19 | C21 | sing | 1.51Å | 1.52Å | |
| C19 | O3 | sing | 1.34Å | 1.35Å | Aromatic |
| C21 | C22 | sing | 1.53Å | 1.53Å | |
| C21 | C24 | sing | 1.53Å | 1.53Å | |
| N3 | O3 | sing | 1.21Å | 1.42Å | Aromatic |
| C9 | O2 | sing | 1.36Å | 1.37Å | |
| C9 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.51Å | 1.51Å | |
| O2 | C10 | sing | 1.43Å | 1.43Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.08Å | 1.08Å | |
| C14 | H20 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C1 | H24 | sing | 1.09Å | 1.10Å | |
| C1 | H25 | sing | 1.09Å | 1.10Å | |
| C | H26 | sing | 1.09Å | 1.10Å | |
| C | H27 | sing | 1.09Å | 1.10Å | |
| C | H28 | sing | 1.09Å | 1.10Å | |
| C12 | H29 | sing | 1.08Å | 1.08Å | |
| C11 | H30 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C15 | C16 | 123.4° | 120.8° |
| C15 | N2 | C14 | 117.2° | 121.7° |
| N2 | C15 | H9 | 118.3° | 119.6° |
| C15 | C16 | C17 | 118.1° | 119.2° |
| C16 | C15 | H9 | 118.3° | 119.7° |
| C15 | C16 | H19 | 120.9° | 120.4° |
| N2 | C14 | C13 | 124.2° | 120.8° |
| N2 | C14 | H20 | 117.9° | 119.6° |
| C16 | C17 | C13 | 120.2° | 118.4° |
| C16 | C17 | H10 | 119.9° | 120.8° |
| C17 | C16 | H19 | 121.0° | 120.4° |
| C14 | C13 | C17 | 116.8° | 119.2° |
| C14 | C13 | C3 | 122.0° | 120.5° |
| C13 | C14 | H20 | 117.9° | 119.6° |
| C17 | C13 | C3 | 120.7° | 120.4° |
| C13 | C17 | H10 | 119.9° | 120.8° |
| C | C1 | C2 | 112.7° | 109.5° |
| C | C1 | H24 | 108.7° | 109.5° |
| C | C1 | H25 | 108.7° | 109.4° |
| C1 | C | H26 | 109.5° | 109.5° |
| C1 | C | H27 | 109.5° | 109.5° |
| C1 | C | H28 | 109.5° | 109.5° |
| C13 | C3 | C4 | 111.8° | 109.4° |
| C13 | C3 | N | 115.0° | 109.4° |
| C13 | C3 | H18 | 104.7° | 109.5° |
| O1 | C4 | C3 | 120.5° | 120.0° |
| O1 | C4 | N1 | 124.2° | 120.0° |
| C1 | C2 | O | 122.0° | 120.0° |
| C1 | C2 | N | 119.0° | 120.0° |
| C2 | C1 | H24 | 108.6° | 109.5° |
| C2 | C1 | H25 | 108.7° | 109.5° |
| O | C2 | N | 118.9° | 120.0° |
| C2 | N | C3 | 121.6° | 119.9° |
| C2 | N | C18 | 119.1° | 120.0° |
| C4 | C3 | N | 114.3° | 109.5° |
| C3 | C4 | N1 | 115.3° | 120.0° |
| C4 | C3 | H18 | 104.6° | 109.5° |
| C3 | N | C18 | 119.1° | 120.0° |
| N | C3 | H18 | 105.1° | 109.5° |
| C4 | N1 | C5 | 126.6° | 120.0° |
| C4 | N1 | H1 | 116.7° | 120.0° |
| N | C18 | C20 | 128.4° | 126.9° |
| N | C18 | N3 | 120.8° | 126.9° |
| C23 | C21 | C19 | 109.7° | 109.5° |
| C23 | C21 | C22 | 109.4° | 109.4° |
| C23 | C21 | C24 | 109.4° | 109.5° |
| C21 | C23 | H21 | 109.5° | 109.5° |
| C21 | C23 | H22 | 109.4° | 109.5° |
| C21 | C23 | H23 | 109.5° | 109.5° |
| C18 | C20 | C19 | 105.2° | 103.9° |
| C20 | C18 | N3 | 110.8° | 106.2° |
| C18 | C20 | H11 | 127.4° | 128.0° |
| C20 | C19 | C21 | 129.5° | 126.7° |
| C20 | C19 | O3 | 110.8° | 106.6° |
| C19 | C20 | H11 | 127.4° | 128.1° |
| C18 | N3 | O3 | 104.3° | 111.5° |
| C11 | C12 | C5 | 119.8° | 120.0° |
| C12 | C11 | C9 | 119.8° | 120.0° |
| C11 | C12 | H29 | 120.1° | 120.0° |
| C12 | C11 | H30 | 120.1° | 120.0° |
| C12 | C5 | N1 | 120.5° | 120.0° |
| C12 | C5 | C6 | 120.7° | 120.0° |
| C5 | C12 | H29 | 120.1° | 120.0° |
| N1 | C5 | C6 | 118.8° | 120.0° |
| C5 | N1 | H1 | 116.7° | 120.0° |
| C11 | C9 | O2 | 114.7° | 120.0° |
| C11 | C9 | C8 | 120.6° | 120.1° |
| C9 | C11 | H30 | 120.1° | 120.0° |
| C5 | C6 | C8 | 118.3° | 120.0° |
| C5 | C6 | C7 | 122.0° | 120.0° |
| C21 | C19 | O3 | 119.6° | 126.7° |
| C19 | C21 | C22 | 109.8° | 109.5° |
| C19 | C21 | C24 | 110.3° | 109.5° |
| C19 | O3 | N3 | 108.9° | 111.8° |
| C22 | C21 | C24 | 108.2° | 109.5° |
| C21 | C22 | H12 | 109.5° | 109.5° |
| C21 | C22 | H13 | 109.5° | 109.5° |
| C21 | C22 | H14 | 109.5° | 109.4° |
| C21 | C24 | H15 | 109.5° | 109.5° |
| C21 | C24 | H16 | 109.5° | 109.5° |
| C21 | C24 | H17 | 109.5° | 109.5° |
| O2 | C9 | C8 | 124.8° | 119.9° |
| C9 | O2 | C10 | 119.0° | 117.0° |
| C9 | C8 | C6 | 120.7° | 120.0° |
| C9 | C8 | H5 | 119.6° | 120.0° |
| C8 | C6 | C7 | 119.5° | 120.0° |
| C6 | C8 | H5 | 119.7° | 120.0° |
| C6 | C7 | H2 | 109.5° | 109.5° |
| C6 | C7 | H3 | 109.5° | 109.5° |
| C6 | C7 | H4 | 109.4° | 109.5° |
| O2 | C10 | H6 | 109.5° | 109.5° |
| O2 | C10 | H7 | 109.5° | 109.5° |
| O2 | C10 | H8 | 109.5° | 109.4° |
| H2 | C7 | H3 | 109.5° | 109.5° |
| H2 | C7 | H4 | 109.4° | 109.4° |
| H3 | C7 | H4 | 109.5° | 109.4° |
| H6 | C10 | H7 | 109.5° | 109.5° |
| H6 | C10 | H8 | 109.4° | 109.5° |
| H7 | C10 | H8 | 109.5° | 109.4° |
| H12 | C22 | H13 | 109.4° | 109.5° |
| H12 | C22 | H14 | 109.5° | 109.5° |
| H13 | C22 | H14 | 109.5° | 109.5° |
| H15 | C24 | H16 | 109.5° | 109.4° |
| H15 | C24 | H17 | 109.5° | 109.4° |
| H16 | C24 | H17 | 109.5° | 109.4° |
| H21 | C23 | H22 | 109.5° | 109.5° |
| H21 | C23 | H23 | 109.5° | 109.5° |
| H22 | C23 | H23 | 109.5° | 109.5° |
| H24 | C1 | H25 | 109.5° | 109.5° |
| H26 | C | H27 | 109.5° | 109.4° |
| H26 | C | H28 | 109.5° | 109.5° |
| H27 | C | H28 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C15 | C16 | H9 | 180.0° | 179.6° |
| N2 | C15 | C16 | C17 | 0.3° | 0.4° |
| C15 | N2 | C14 | C13 | 0.6° | 0.1° |
| N2 | C15 | C16 | H19 | 179.7° | 179.7° |
| C15 | N2 | C14 | H20 | 179.4° | 179.9° |
| C16 | C15 | N2 | C14 | 0.4° | 0.4° |
| C15 | C16 | C17 | H19 | 180.0° | 180.0° |
| C15 | C16 | C17 | C13 | 0.7° | 0.0° |
| C15 | C16 | C17 | H10 | 179.3° | 180.0° |
| N2 | C14 | C13 | H20 | 180.0° | 180.0° |
| N2 | C14 | C13 | C17 | 1.5° | 0.3° |
| N2 | C14 | C13 | C3 | 170.8° | 180.0° |
| C14 | N2 | C15 | H9 | 179.6° | 180.0° |
| C16 | C17 | C13 | C14 | 1.5° | 0.3° |
| C16 | C17 | C13 | H10 | 180.0° | 180.0° |
| C16 | C17 | C13 | C3 | 170.9° | 180.0° |
| C17 | C16 | C15 | H9 | 179.7° | 179.9° |
| C14 | C13 | C17 | C3 | 172.4° | 179.7° |
| C14 | C13 | C3 | C4 | 77.2° | 107.2° |
| C14 | C13 | C3 | N | 55.3° | 12.8° |
| C14 | C13 | C17 | H10 | 178.5° | 179.7° |
| C14 | C13 | C3 | H18 | 170.1° | 132.8° |
| C17 | C13 | C3 | C4 | 94.7° | 73.1° |
| C17 | C13 | C3 | N | 132.7° | 166.9° |
| C17 | C13 | C3 | H18 | 17.9° | 46.9° |
| C13 | C17 | C16 | H19 | 179.3° | 180.0° |
| C17 | C13 | C14 | H20 | 178.5° | 179.7° |
| C | C1 | C2 | H24 | 120.5° | 120.0° |
| C | C1 | C2 | H25 | 120.5° | 120.0° |
| C | C1 | C2 | O | 31.3° | 3.0° |
| C | C1 | C2 | N | 150.6° | 177.1° |
| C | C1 | H24 | H25 | 118.6° | 119.9° |
| C1 | C | H26 | H27 | 120.0° | 120.0° |
| C1 | C | H26 | H28 | 120.0° | 120.1° |
| C1 | C | H27 | H28 | 120.0° | 120.0° |
| C13 | C3 | C4 | O1 | 72.1° | 125.4° |
| C13 | C3 | N | C2 | 36.7° | 114.0° |
| C13 | C3 | C4 | N | 132.9° | 119.9° |
| C13 | C3 | C4 | H18 | 112.8° | 120.0° |
| C13 | C3 | N | H18 | 114.6° | 120.0° |
| C13 | C3 | C4 | N1 | 105.9° | 54.6° |
| C13 | C3 | N | C18 | 148.7° | 66.1° |
| C3 | C13 | C17 | H10 | 9.1° | 0.0° |
| C3 | C13 | C14 | H20 | 9.2° | 0.0° |
| O1 | C4 | C3 | N1 | 177.9° | 180.0° |
| O1 | C4 | C3 | N | 60.8° | 5.5° |
| O1 | C4 | N1 | C5 | 3.9° | 3.4° |
| O1 | C4 | N1 | H1 | 176.1° | 176.8° |
| O1 | C4 | C3 | H18 | 175.2° | 114.6° |
| C1 | C2 | O | N | 178.1° | 179.9° |
| C1 | C2 | N | C3 | 154.7° | 5.3° |
| C1 | C2 | N | C18 | 30.8° | 174.7° |
| C2 | C1 | H24 | H25 | 118.5° | 120.1° |
| C2 | C1 | C | H26 | 180.0° | 60.0° |
| C2 | C1 | C | H27 | 60.0° | 60.0° |
| C2 | C1 | C | H28 | 60.0° | 180.0° |
| O | C2 | N | C3 | 27.1° | 174.8° |
| O | C2 | N | C18 | 147.4° | 5.1° |
| O | C2 | C1 | H24 | 89.2° | 123.0° |
| O | C2 | C1 | H25 | 151.8° | 117.0° |
| C2 | N | C3 | C4 | 168.1° | 126.1° |
| C2 | N | C3 | C18 | 174.5° | 179.9° |
| C2 | N | C18 | C20 | 96.8° | 172.8° |
| C2 | N | C18 | N3 | 86.7° | 7.4° |
| C2 | N | C3 | H18 | 77.8° | 6.0° |
| N | C2 | C1 | H24 | 88.9° | 57.2° |
| N | C2 | C1 | H25 | 30.1° | 62.9° |
| C4 | C3 | N | H18 | 114.1° | 120.0° |
| C4 | C3 | N | C18 | 17.4° | 53.8° |
| C3 | C4 | N1 | C5 | 178.3° | 176.6° |
| C3 | C4 | N1 | H1 | 1.7° | 3.2° |
| N | C3 | C4 | N1 | 121.2° | 174.5° |
| C3 | N | C18 | C20 | 88.5° | 7.1° |
| C3 | N | C18 | N3 | 87.9° | 172.7° |
| C4 | N1 | C5 | C12 | 105.3° | 28.7° |
| C4 | N1 | C5 | H1 | 180.0° | 179.8° |
| C4 | N1 | C5 | C6 | 74.9° | 151.5° |
| N1 | C4 | C3 | H18 | 6.9° | 65.4° |
| N | C18 | C20 | N3 | 176.7° | 179.9° |
| N | C18 | C20 | C19 | 176.0° | 179.9° |
| N | C18 | N3 | O3 | 176.5° | 179.9° |
| N | C18 | C20 | H11 | 4.0° | 0.1° |
| C18 | N | C3 | H18 | 96.7° | 173.9° |
| C23 | C21 | C19 | C20 | 17.0° | 60.0° |
| C23 | C21 | C19 | C22 | 120.2° | 120.0° |
| C23 | C21 | C19 | C24 | 120.5° | 120.0° |
| C23 | C21 | C19 | O3 | 164.3° | 120.0° |
| C23 | C21 | C22 | C24 | 119.1° | 120.0° |
| C23 | C21 | C22 | H12 | 180.0° | 60.0° |
| C23 | C21 | C22 | H13 | 60.0° | 60.0° |
| C23 | C21 | C22 | H14 | 60.0° | 180.0° |
| C23 | C21 | C24 | H15 | 180.0° | 180.0° |
| C23 | C21 | C24 | H16 | 60.0° | 60.0° |
| C23 | C21 | C24 | H17 | 60.0° | 60.0° |
| C21 | C23 | H21 | H22 | 120.0° | 120.0° |
| C21 | C23 | H21 | H23 | 120.0° | 120.0° |
| C21 | C23 | H22 | H23 | 120.0° | 120.0° |
| C18 | C20 | C19 | H11 | 180.0° | 179.9° |
| C18 | C20 | C19 | C21 | 178.2° | 179.9° |
| C18 | C20 | C19 | O3 | 0.7° | 0.0° |
| C20 | C18 | N3 | O3 | 0.5° | 0.0° |
| C19 | C20 | C18 | N3 | 0.7° | 0.0° |
| C20 | C19 | C21 | O3 | 178.8° | 179.9° |
| C20 | C19 | C21 | C22 | 103.3° | 60.0° |
| C20 | C19 | C21 | C24 | 137.5° | 180.0° |
| C20 | C19 | O3 | N3 | 0.4° | 0.0° |
| C18 | N3 | O3 | C19 | 0.1° | 0.0° |
| N3 | C18 | C20 | H11 | 179.2° | 180.0° |
| C11 | C12 | C5 | H29 | 180.0° | 180.0° |
| C11 | C12 | C5 | N1 | 179.7° | 180.0° |
| C12 | C11 | C9 | H30 | 180.0° | 180.0° |
| C11 | C12 | C5 | C6 | 0.5° | 0.2° |
| C12 | C11 | C9 | O2 | 179.0° | 179.9° |
| C12 | C11 | C9 | C8 | 0.5° | 0.3° |
| C12 | C5 | N1 | C6 | 179.8° | 179.8° |
| C5 | C12 | C11 | C9 | 0.2° | 0.0° |
| C12 | C5 | C6 | C8 | 1.1° | 0.2° |
| C12 | C5 | C6 | C7 | 175.2° | 179.7° |
| C12 | C5 | N1 | H1 | 74.6° | 151.5° |
| C5 | C12 | C11 | H30 | 179.8° | 180.0° |
| N1 | C5 | C6 | C8 | 179.1° | 180.0° |
| N1 | C5 | C6 | C7 | 4.6° | 0.1° |
| N1 | C5 | C12 | H29 | 0.3° | 0.1° |
| C11 | C9 | O2 | C8 | 179.5° | 179.8° |
| C11 | C9 | C8 | C6 | 1.1° | 0.3° |
| C11 | C9 | O2 | C10 | 178.9° | 0.0° |
| C11 | C9 | C8 | H5 | 178.9° | 179.7° |
| C9 | C11 | C12 | H29 | 179.8° | 180.0° |
| C5 | C6 | C8 | C9 | 1.4° | 0.1° |
| C5 | C6 | C8 | C7 | 176.3° | 179.9° |
| C6 | C5 | N1 | H1 | 105.2° | 28.3° |
| C5 | C6 | C7 | H2 | 92.0° | 90.0° |
| C5 | C6 | C7 | H3 | 148.0° | 150.0° |
| C5 | C6 | C7 | H4 | 28.0° | 30.1° |
| C5 | C6 | C8 | H5 | 178.7° | 179.9° |
| C6 | C5 | C12 | H29 | 179.5° | 179.7° |
| C19 | C21 | C22 | C24 | 120.5° | 120.0° |
| C21 | C19 | O3 | N3 | 178.6° | 180.0° |
| C21 | C19 | C20 | H11 | 1.8° | 0.0° |
| C19 | C21 | C22 | H12 | 59.6° | 180.0° |
| C19 | C21 | C22 | H13 | 179.6° | 60.0° |
| C19 | C21 | C22 | H14 | 60.4° | 60.0° |
| C19 | C21 | C24 | H15 | 59.3° | 60.0° |
| C19 | C21 | C24 | H16 | 60.7° | 60.0° |
| C19 | C21 | C24 | H17 | 179.3° | 180.0° |
| C19 | C21 | C23 | H21 | 180.0° | 180.0° |
| C19 | C21 | C23 | H22 | 60.0° | 60.0° |
| C19 | C21 | C23 | H23 | 60.0° | 60.0° |
| O3 | C19 | C21 | C22 | 75.5° | 120.0° |
| O3 | C19 | C21 | C24 | 43.8° | 0.0° |
| O3 | C19 | C20 | H11 | 179.3° | 180.0° |
| C21 | C22 | H12 | H13 | 120.0° | 120.1° |
| C21 | C22 | H12 | H14 | 120.0° | 119.9° |
| C21 | C22 | H13 | H14 | 120.0° | 119.9° |
| C22 | C21 | C24 | H15 | 60.9° | 60.1° |
| C22 | C21 | C24 | H16 | 179.1° | 180.0° |
| C22 | C21 | C24 | H17 | 59.1° | 60.0° |
| C22 | C21 | C23 | H21 | 59.5° | 60.0° |
| C22 | C21 | C23 | H22 | 179.5° | 180.0° |
| C22 | C21 | C23 | H23 | 60.5° | 60.0° |
| C24 | C21 | C22 | H12 | 60.9° | 59.9° |
| C24 | C21 | C22 | H13 | 59.1° | 180.0° |
| C24 | C21 | C22 | H14 | 179.1° | 60.0° |
| C21 | C24 | H15 | H16 | 120.0° | 120.0° |
| C21 | C24 | H15 | H17 | 120.0° | 120.1° |
| C21 | C24 | H16 | H17 | 120.0° | 120.1° |
| C24 | C21 | C23 | H21 | 58.9° | 60.0° |
| C24 | C21 | C23 | H22 | 61.1° | 60.0° |
| C24 | C21 | C23 | H23 | 178.9° | 180.0° |
| O2 | C9 | C8 | C6 | 178.3° | 179.9° |
| O2 | C9 | C8 | H5 | 1.7° | 0.1° |
| C9 | O2 | C10 | H6 | 180.0° | 179.9° |
| C9 | O2 | C10 | H7 | 60.0° | 59.9° |
| C9 | O2 | C10 | H8 | 60.0° | 60.0° |
| O2 | C9 | C11 | H30 | 1.1° | 0.0° |
| C9 | C8 | C6 | H5 | 180.0° | 180.0° |
| C9 | C8 | C6 | C7 | 175.0° | 180.0° |
| C8 | C9 | O2 | C10 | 0.6° | 179.7° |
| C8 | C9 | C11 | H30 | 179.5° | 179.8° |
| C8 | C6 | C7 | H2 | 91.8° | 89.9° |
| C8 | C6 | C7 | H3 | 28.2° | 30.1° |
| C8 | C6 | C7 | H4 | 148.2° | 150.0° |
| C6 | C7 | H2 | H3 | 120.0° | 120.0° |
| C6 | C7 | H2 | H4 | 120.0° | 120.1° |
| C6 | C7 | H3 | H4 | 120.0° | 120.0° |
| C7 | C6 | C8 | H5 | 5.0° | 0.0° |
| O2 | C10 | H6 | H7 | 120.1° | 120.0° |
| O2 | C10 | H6 | H8 | 120.0° | 120.0° |
| O2 | C10 | H7 | H8 | 120.0° | 119.9° |
| H2 | C7 | H3 | H4 | 120.0° | 119.9° |
| H6 | C10 | H7 | H8 | 120.0° | 120.1° |
| H9 | C15 | C16 | H19 | 0.3° | 0.1° |
| H10 | C17 | C16 | H19 | 0.7° | 0.0° |
| H12 | C22 | H13 | H14 | 120.0° | 120.0° |
| H15 | C24 | H16 | H17 | 120.0° | 119.9° |
| H21 | C23 | H22 | H23 | 120.0° | 120.0° |
| H24 | C1 | C | H26 | 59.5° | 180.0° |
| H24 | C1 | C | H27 | 60.5° | 60.0° |
| H24 | C1 | C | H28 | 179.5° | 60.0° |
| H25 | C1 | C | H26 | 59.5° | 60.0° |
| H25 | C1 | C | H27 | 179.6° | 180.0° |
| H25 | C1 | C | H28 | 60.4° | 60.0° |
| H26 | C | H27 | H28 | 120.0° | 119.9° |
| H29 | C12 | C11 | H30 | 0.2° | 0.0° |
