WBT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F1 | C2 | sing | 1.35Å | 1.36Å | |
| C2 | C3 | doub | 1.38Å | 1.41Å | Aromatic |
| C2 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.41Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.10Å | |
| C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | N28 | sing | 1.40Å | 1.44Å | |
| C5 | C6 | sing | 1.39Å | 1.42Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.10Å | |
| C6 | C7 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C8 | sing | 1.48Å | 1.49Å | |
| C7 | H7 | sing | 1.08Å | 1.10Å | |
| C8 | O9 | doub | 1.22Å | 1.23Å | |
| C8 | N10 | sing | 1.35Å | 1.38Å | |
| N10 | C11 | sing | 1.40Å | 1.40Å | |
| N10 | H10 | sing | 0.97Å | 1.02Å | |
| C11 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.36Å | 1.38Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.10Å | |
| C13 | C14 | doub | 1.40Å | 1.40Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.10Å | |
| C14 | C15 | sing | 1.46Å | 1.47Å | Aromatic |
| C14 | C26 | sing | 1.41Å | 1.43Å | Aromatic |
| C15 | C16 | doub | 1.34Å | 1.36Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.10Å | |
| C16 | N17 | sing | 1.37Å | 1.39Å | Aromatic |
| C16 | H16 | sing | 1.08Å | 1.10Å | |
| N17 | C18 | sing | 1.46Å | 1.48Å | |
| N17 | C26 | sing | 1.38Å | 1.37Å | Aromatic |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C18 | H181 | sing | 1.09Å | 1.11Å | |
| C18 | H182 | sing | 1.09Å | 1.11Å | |
| C19 | C20 | sing | 1.51Å | 1.50Å | |
| C19 | H191 | sing | 1.09Å | 1.12Å | |
| C19 | H192 | sing | 1.09Å | 1.11Å | |
| C20 | C21 | doub | 1.39Å | 1.40Å | Aromatic |
| C20 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.10Å | |
| C22 | N23 | doub | 1.32Å | 1.32Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.10Å | |
| N23 | C24 | sing | 1.32Å | 1.33Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.10Å | |
| C25 | H25 | sing | 1.08Å | 1.10Å | |
| C26 | C27 | doub | 1.39Å | 1.40Å | Aromatic |
| C27 | H27 | sing | 1.08Å | 1.10Å | |
| N28 | C29 | sing | 1.47Å | 1.46Å | |
| N28 | C33 | sing | 1.47Å | 1.47Å | |
| C29 | C30 | sing | 1.53Å | 1.53Å | |
| C29 | H291 | sing | 1.09Å | 1.12Å | |
| C29 | H292 | sing | 1.09Å | 1.12Å | |
| C30 | O31 | sing | 1.43Å | 1.43Å | |
| C30 | H301 | sing | 1.09Å | 1.12Å | |
| C30 | H302 | sing | 1.09Å | 1.11Å | |
| O31 | C32 | sing | 1.43Å | 1.42Å | |
| C32 | C33 | sing | 1.53Å | 1.52Å | |
| C32 | H321 | sing | 1.09Å | 1.11Å | |
| C32 | H322 | sing | 1.09Å | 1.11Å | |
| C33 | H331 | sing | 1.09Å | 1.11Å | |
| C33 | H332 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F1 | C2 | C3 | 120.5° | 119.9° |
| F1 | C2 | C7 | 119.2° | 119.9° |
| C3 | C2 | C7 | 120.2° | 120.2° |
| C2 | C3 | C4 | 122.0° | 120.2° |
| C2 | C3 | H3 | 119.0° | 119.9° |
| C2 | C7 | C6 | 119.5° | 120.0° |
| C2 | C7 | H7 | 120.3° | 120.0° |
| C4 | C3 | H3 | 119.0° | 119.9° |
| C3 | C4 | C5 | 116.3° | 120.0° |
| C3 | C4 | N28 | 122.6° | 120.0° |
| C5 | C4 | N28 | 120.9° | 120.0° |
| C4 | C5 | C6 | 122.3° | 119.8° |
| C4 | C5 | H5 | 118.9° | 120.1° |
| C4 | N28 | C29 | 118.3° | 106.7° |
| C4 | N28 | C33 | 114.0° | 106.7° |
| C6 | C5 | H5 | 118.8° | 120.1° |
| C5 | C6 | C7 | 119.6° | 119.8° |
| C5 | C6 | C8 | 119.7° | 120.1° |
| C7 | C6 | C8 | 120.7° | 120.1° |
| C6 | C7 | H7 | 120.2° | 120.0° |
| C6 | C8 | O9 | 118.3° | 120.0° |
| C6 | C8 | N10 | 119.6° | 120.0° |
| O9 | C8 | N10 | 122.1° | 120.0° |
| C8 | N10 | C11 | 124.4° | 120.0° |
| C8 | N10 | H10 | 117.8° | 120.0° |
| C11 | N10 | H10 | 117.8° | 120.0° |
| N10 | C11 | C12 | 119.5° | 119.8° |
| N10 | C11 | C27 | 120.8° | 119.8° |
| C12 | C11 | C27 | 119.6° | 120.5° |
| C11 | C12 | C13 | 123.0° | 120.5° |
| C11 | C12 | H12 | 118.5° | 119.8° |
| C11 | C27 | C26 | 118.5° | 119.7° |
| C11 | C27 | H27 | 120.8° | 120.1° |
| C13 | C12 | H12 | 118.5° | 119.7° |
| C12 | C13 | C14 | 118.3° | 119.9° |
| C12 | C13 | H13 | 120.8° | 120.1° |
| C14 | C13 | H13 | 120.9° | 120.1° |
| C13 | C14 | C15 | 134.1° | 133.9° |
| C13 | C14 | C26 | 119.1° | 120.0° |
| C15 | C14 | C26 | 106.8° | 106.1° |
| C14 | C15 | C16 | 105.2° | 107.0° |
| C14 | C15 | H15 | 127.4° | 126.5° |
| C14 | C26 | N17 | 107.5° | 107.1° |
| C14 | C26 | C27 | 121.4° | 119.4° |
| C16 | C15 | H15 | 127.4° | 126.4° |
| C15 | C16 | N17 | 111.6° | 109.9° |
| C15 | C16 | H16 | 124.2° | 125.1° |
| N17 | C16 | H16 | 124.2° | 125.0° |
| C16 | N17 | C18 | 127.1° | 125.0° |
| C16 | N17 | C26 | 108.9° | 109.9° |
| C18 | N17 | C26 | 124.0° | 125.1° |
| N17 | C18 | C19 | 108.9° | 109.5° |
| N17 | C18 | H181 | 112.4° | 109.4° |
| N17 | C18 | H182 | 112.4° | 109.5° |
| N17 | C26 | C27 | 131.1° | 133.4° |
| C19 | C18 | H181 | 112.4° | 109.5° |
| C19 | C18 | H182 | 112.4° | 109.5° |
| C18 | C19 | C20 | 109.2° | 109.4° |
| C18 | C19 | H191 | 112.3° | 109.4° |
| C18 | C19 | H192 | 112.3° | 109.4° |
| H181 | C18 | H182 | 98.0° | 109.4° |
| C20 | C19 | H191 | 112.3° | 109.5° |
| C20 | C19 | H192 | 112.3° | 109.5° |
| C19 | C20 | C21 | 120.6° | 120.8° |
| C19 | C20 | C25 | 120.7° | 120.8° |
| H191 | C19 | H192 | 98.1° | 109.5° |
| C21 | C20 | C25 | 118.6° | 118.4° |
| C20 | C21 | C22 | 118.6° | 119.2° |
| C20 | C21 | H21 | 120.7° | 120.4° |
| C20 | C25 | C24 | 119.1° | 119.2° |
| C20 | C25 | H25 | 120.5° | 120.4° |
| C22 | C21 | H21 | 120.7° | 120.4° |
| C21 | C22 | N23 | 121.1° | 120.7° |
| C21 | C22 | H22 | 119.4° | 119.6° |
| N23 | C22 | H22 | 119.4° | 119.6° |
| C22 | N23 | C24 | 121.5° | 121.8° |
| N23 | C24 | C25 | 121.0° | 120.7° |
| N23 | C24 | H24 | 119.5° | 119.6° |
| C25 | C24 | H24 | 119.5° | 119.7° |
| C24 | C25 | H25 | 120.4° | 120.4° |
| C26 | C27 | H27 | 120.7° | 120.2° |
| C29 | N28 | C33 | 113.3° | 106.7° |
| N28 | C29 | C30 | 107.3° | 109.5° |
| N28 | C29 | H291 | 113.0° | 109.5° |
| N28 | C29 | H292 | 113.0° | 109.6° |
| N28 | C33 | C32 | 114.1° | 109.5° |
| N28 | C33 | H331 | 110.5° | 109.5° |
| N28 | C33 | H332 | 110.5° | 109.4° |
| C30 | C29 | H291 | 113.0° | 109.4° |
| C30 | C29 | H292 | 113.0° | 109.4° |
| C29 | C30 | O31 | 111.5° | 109.7° |
| C29 | C30 | H301 | 111.5° | 109.4° |
| C29 | C30 | H302 | 111.5° | 109.4° |
| H291 | C29 | H292 | 97.5° | 109.5° |
| O31 | C30 | H301 | 111.5° | 109.4° |
| O31 | C30 | H302 | 111.5° | 109.4° |
| C30 | O31 | C32 | 112.1° | 107.2° |
| H301 | C30 | H302 | 98.9° | 109.4° |
| O31 | C32 | C33 | 114.3° | 109.7° |
| O31 | C32 | H321 | 110.5° | 109.4° |
| O31 | C32 | H322 | 110.5° | 109.4° |
| C33 | C32 | H321 | 110.5° | 109.4° |
| C33 | C32 | H322 | 110.4° | 109.4° |
| C32 | C33 | H331 | 110.5° | 109.5° |
| C32 | C33 | H332 | 110.5° | 109.4° |
| H321 | C32 | H322 | 99.8° | 109.4° |
| H331 | C33 | H332 | 99.8° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F1 | C2 | C3 | C7 | 178.5° | 179.8° |
| F1 | C2 | C3 | C4 | 179.5° | 179.9° |
| F1 | C2 | C3 | H3 | 0.4° | 0.0° |
| F1 | C2 | C7 | C6 | 179.2° | 179.7° |
| F1 | C2 | C7 | H7 | 0.8° | 0.2° |
| C2 | C3 | C4 | H3 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 2.3° | 0.0° |
| C2 | C3 | C4 | N28 | 177.9° | 180.0° |
| C3 | C2 | C7 | C6 | 0.6° | 0.6° |
| C3 | C2 | C7 | H7 | 179.4° | 180.0° |
| C7 | C2 | C3 | C4 | 1.9° | 0.3° |
| C7 | C2 | C3 | H3 | 178.1° | 179.7° |
| C2 | C7 | C6 | C5 | 0.2° | 0.5° |
| C2 | C7 | C6 | H7 | 180.0° | 179.5° |
| C2 | C7 | C6 | C8 | 179.2° | 179.6° |
| C3 | C4 | C5 | N28 | 175.7° | 179.9° |
| C3 | C4 | C5 | C6 | 1.4° | 0.1° |
| C3 | C4 | C5 | H5 | 178.6° | 179.9° |
| C3 | C4 | N28 | C29 | 144.2° | 0.0° |
| C3 | C4 | N28 | C33 | 7.2° | 113.8° |
| H3 | C3 | C4 | C5 | 177.8° | 179.9° |
| H3 | C3 | C4 | N28 | 2.1° | 0.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.8° |
| C4 | C5 | C6 | C7 | 0.2° | 0.1° |
| C4 | C5 | C6 | C8 | 178.7° | 180.0° |
| C5 | C4 | N28 | C29 | 40.4° | 180.0° |
| C5 | C4 | N28 | C33 | 177.4° | 66.1° |
| N28 | C4 | C5 | C6 | 177.1° | 179.9° |
| N28 | C4 | C5 | H5 | 2.9° | 0.2° |
| C4 | N28 | C29 | C33 | 137.3° | 113.8° |
| C4 | N28 | C29 | C30 | 168.4° | 173.1° |
| C4 | N28 | C29 | H291 | 66.3° | 53.1° |
| C4 | N28 | C29 | H292 | 43.2° | 66.9° |
| C4 | N28 | C33 | C32 | 175.7° | 173.0° |
| C4 | N28 | C33 | H331 | 50.5° | 66.9° |
| C4 | N28 | C33 | H332 | 59.0° | 53.1° |
| C5 | C6 | C7 | C8 | 178.9° | 179.9° |
| C5 | C6 | C7 | H7 | 179.8° | 179.9° |
| C5 | C6 | C8 | O9 | 22.9° | 0.1° |
| C5 | C6 | C8 | N10 | 157.5° | 180.0° |
| H5 | C5 | C6 | C7 | 179.8° | 179.7° |
| H5 | C5 | C6 | C8 | 1.2° | 0.2° |
| C7 | C6 | C8 | O9 | 158.2° | 179.8° |
| C7 | C6 | C8 | N10 | 21.4° | 0.1° |
| C8 | C6 | C7 | H7 | 0.8° | 0.2° |
| C6 | C8 | O9 | N10 | 179.6° | 179.9° |
| C6 | C8 | N10 | C11 | 175.4° | 174.6° |
| C6 | C8 | N10 | H10 | 4.5° | 5.4° |
| O9 | C8 | N10 | C11 | 5.0° | 5.5° |
| O9 | C8 | N10 | H10 | 175.0° | 174.5° |
| C8 | N10 | C11 | H10 | 180.0° | 179.9° |
| C8 | N10 | C11 | C12 | 121.6° | 146.5° |
| C8 | N10 | C11 | C27 | 61.7° | 33.8° |
| N10 | C11 | C12 | C27 | 176.8° | 179.7° |
| N10 | C11 | C12 | C13 | 179.6° | 179.9° |
| N10 | C11 | C12 | H12 | 0.4° | 0.0° |
| N10 | C11 | C27 | C26 | 179.4° | 179.8° |
| N10 | C11 | C27 | H27 | 0.7° | 0.1° |
| H10 | N10 | C11 | C12 | 58.4° | 33.6° |
| H10 | N10 | C11 | C27 | 118.4° | 146.1° |
| C11 | C12 | C13 | H12 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 2.8° | 0.1° |
| C11 | C12 | C13 | H13 | 177.2° | 179.9° |
| C12 | C11 | C27 | C26 | 2.7° | 0.5° |
| C12 | C11 | C27 | H27 | 177.4° | 179.6° |
| C27 | C11 | C12 | C13 | 3.6° | 0.2° |
| C27 | C11 | C12 | H12 | 176.4° | 179.7° |
| C11 | C27 | C26 | C14 | 1.2° | 0.5° |
| C11 | C27 | C26 | N17 | 179.0° | 179.8° |
| C11 | C27 | C26 | H27 | 180.0° | 179.9° |
| C12 | C13 | C14 | H13 | 180.0° | 179.8° |
| C12 | C13 | C14 | C15 | 179.0° | 179.9° |
| C12 | C13 | C14 | C26 | 1.1° | 0.1° |
| H12 | C12 | C13 | C14 | 177.2° | 180.0° |
| H12 | C12 | C13 | H13 | 2.8° | 0.1° |
| C13 | C14 | C15 | C26 | 179.9° | 180.0° |
| C13 | C14 | C15 | C16 | 179.9° | 180.0° |
| C13 | C14 | C15 | H15 | 0.1° | 0.0° |
| C13 | C14 | C26 | N17 | 179.8° | 180.0° |
| C13 | C14 | C26 | C27 | 0.4° | 0.3° |
| H13 | C13 | C14 | C15 | 1.0° | 0.1° |
| H13 | C13 | C14 | C26 | 178.9° | 179.9° |
| C14 | C15 | C16 | H15 | 180.0° | 180.0° |
| C14 | C15 | C16 | N17 | 0.1° | 0.0° |
| C14 | C15 | C16 | H16 | 179.9° | 179.9° |
| C15 | C14 | C26 | N17 | 0.2° | 0.0° |
| C15 | C14 | C26 | C27 | 179.7° | 179.8° |
| C26 | C14 | C15 | C16 | 0.0° | 0.0° |
| C26 | C14 | C15 | H15 | 180.0° | 180.0° |
| C14 | C26 | N17 | C16 | 0.2° | 0.0° |
| C14 | C26 | N17 | C18 | 179.3° | 179.9° |
| C14 | C26 | N17 | C27 | 179.9° | 179.7° |
| C14 | C26 | C27 | H27 | 178.9° | 179.6° |
| C15 | C16 | N17 | H16 | 180.0° | 179.9° |
| C15 | C16 | N17 | C18 | 179.3° | 179.9° |
| C15 | C16 | N17 | C26 | 0.2° | 0.0° |
| H15 | C15 | C16 | N17 | 179.9° | 179.9° |
| H15 | C15 | C16 | H16 | 0.2° | 0.1° |
| C16 | N17 | C18 | C26 | 179.5° | 179.9° |
| C16 | N17 | C18 | C19 | 100.0° | 89.9° |
| C16 | N17 | C18 | H181 | 25.3° | 150.1° |
| C16 | N17 | C18 | H182 | 134.8° | 30.1° |
| C16 | N17 | C26 | C27 | 179.6° | 179.7° |
| H16 | C16 | N17 | C18 | 0.7° | 0.2° |
| H16 | C16 | N17 | C26 | 179.8° | 179.9° |
| N17 | C18 | C19 | H181 | 125.3° | 120.0° |
| N17 | C18 | C19 | H182 | 125.3° | 120.0° |
| N17 | C18 | H181 | H182 | 118.3° | 119.9° |
| N17 | C18 | C19 | C20 | 63.7° | 180.0° |
| N17 | C18 | C19 | H191 | 171.1° | 60.0° |
| N17 | C18 | C19 | H192 | 61.6° | 60.0° |
| C18 | N17 | C26 | C27 | 0.8° | 0.2° |
| C26 | N17 | C18 | C19 | 79.5° | 90.0° |
| C26 | N17 | C18 | H181 | 155.2° | 30.0° |
| C26 | N17 | C18 | H182 | 45.7° | 150.0° |
| N17 | C26 | C27 | H27 | 1.0° | 0.1° |
| C19 | C18 | H181 | H182 | 118.3° | 120.0° |
| C18 | C19 | C20 | H191 | 125.2° | 120.0° |
| C18 | C19 | C20 | H192 | 125.3° | 119.9° |
| C18 | C19 | H191 | H192 | 118.2° | 120.0° |
| C18 | C19 | C20 | C21 | 78.4° | 90.1° |
| C18 | C19 | C20 | C25 | 99.3° | 90.3° |
| H181 | C18 | C19 | C20 | 61.6° | 60.0° |
| H181 | C18 | C19 | H191 | 63.6° | 180.0° |
| H181 | C18 | C19 | H192 | 173.1° | 60.0° |
| H182 | C18 | C19 | C20 | 171.1° | 60.0° |
| H182 | C18 | C19 | H191 | 45.8° | 60.0° |
| H182 | C18 | C19 | H192 | 63.6° | 180.0° |
| C20 | C19 | H191 | H192 | 118.2° | 120.1° |
| C19 | C20 | C21 | C25 | 177.7° | 179.6° |
| C19 | C20 | C21 | C22 | 178.8° | 179.9° |
| C19 | C20 | C21 | H21 | 1.2° | 0.1° |
| C19 | C20 | C25 | C24 | 178.7° | 179.8° |
| C19 | C20 | C25 | H25 | 1.3° | 0.4° |
| H191 | C19 | C20 | C21 | 46.9° | 29.9° |
| H191 | C19 | C20 | C25 | 135.5° | 149.7° |
| H192 | C19 | C20 | C21 | 156.3° | 150.0° |
| H192 | C19 | C20 | C25 | 26.0° | 29.6° |
| C20 | C21 | C22 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | N23 | 0.1° | 0.0° |
| C20 | C21 | C22 | H22 | 180.0° | 180.0° |
| C21 | C20 | C25 | C24 | 1.0° | 0.6° |
| C21 | C20 | C25 | H25 | 179.0° | 180.0° |
| C25 | C20 | C21 | C22 | 1.1° | 0.3° |
| C25 | C20 | C21 | H21 | 178.9° | 179.8° |
| C20 | C25 | C24 | N23 | 0.3° | 0.6° |
| C20 | C25 | C24 | H25 | 180.0° | 179.4° |
| C20 | C25 | C24 | H24 | 179.7° | 179.7° |
| C21 | C22 | N23 | H22 | 180.0° | 180.0° |
| C21 | C22 | N23 | C24 | 1.4° | 0.0° |
| H21 | C21 | C22 | N23 | 179.9° | 179.9° |
| H21 | C21 | C22 | H22 | 0.0° | 0.1° |
| C22 | N23 | C24 | C25 | 1.5° | 0.3° |
| C22 | N23 | C24 | H24 | 178.5° | 180.0° |
| H22 | C22 | N23 | C24 | 178.6° | 180.0° |
| N23 | C24 | C25 | H24 | 180.0° | 179.7° |
| N23 | C24 | C25 | H25 | 179.7° | 180.0° |
| H24 | C24 | C25 | H25 | 0.3° | 0.3° |
| N28 | C29 | C30 | H291 | 125.2° | 120.0° |
| N28 | C29 | C30 | H292 | 125.3° | 120.1° |
| N28 | C29 | H291 | H292 | 118.9° | 120.1° |
| N28 | C29 | C30 | O31 | 62.5° | 62.8° |
| N28 | C29 | C30 | H301 | 172.3° | 177.1° |
| N28 | C29 | C30 | H302 | 62.8° | 57.2° |
| C29 | N28 | C33 | C32 | 45.1° | 59.3° |
| C29 | N28 | C33 | H331 | 170.4° | 179.3° |
| C29 | N28 | C33 | H332 | 80.2° | 60.7° |
| C33 | N28 | C29 | C30 | 54.2° | 59.2° |
| C33 | N28 | C29 | H291 | 71.0° | 60.7° |
| C33 | N28 | C29 | H292 | 179.5° | 179.3° |
| N28 | C33 | C32 | O31 | 40.8° | 62.9° |
| N28 | C33 | C32 | H331 | 125.2° | 120.1° |
| N28 | C33 | C32 | H332 | 125.3° | 120.0° |
| N28 | C33 | C32 | H321 | 84.5° | 177.1° |
| N28 | C33 | C32 | H322 | 166.0° | 57.2° |
| N28 | C33 | H331 | H332 | 116.3° | 120.0° |
| C30 | C29 | H291 | H292 | 118.9° | 119.9° |
| C29 | C30 | O31 | H301 | 125.2° | 120.1° |
| C29 | C30 | O31 | H302 | 125.3° | 120.1° |
| C29 | C30 | H301 | H302 | 117.4° | 119.8° |
| C29 | C30 | O31 | C32 | 60.3° | 63.1° |
| H291 | C29 | C30 | O31 | 62.8° | 57.1° |
| H291 | C29 | C30 | H301 | 62.5° | 62.9° |
| H291 | C29 | C30 | H302 | 171.9° | 177.2° |
| H292 | C29 | C30 | O31 | 172.3° | 177.1° |
| H292 | C29 | C30 | H301 | 47.0° | 57.0° |
| H292 | C29 | C30 | H302 | 62.4° | 62.9° |
| O31 | C30 | H301 | H302 | 117.4° | 119.9° |
| C30 | O31 | C32 | C33 | 48.4° | 63.2° |
| C30 | O31 | C32 | H321 | 76.9° | 176.8° |
| C30 | O31 | C32 | H322 | 173.6° | 56.9° |
| H301 | C30 | O31 | C32 | 174.5° | 176.8° |
| H302 | C30 | O31 | C32 | 65.0° | 56.9° |
| O31 | C32 | C33 | H321 | 125.3° | 120.0° |
| O31 | C32 | C33 | H322 | 125.3° | 120.1° |
| O31 | C32 | H321 | H322 | 116.3° | 119.8° |
| O31 | C32 | C33 | H331 | 166.0° | 177.1° |
| O31 | C32 | C33 | H332 | 84.5° | 57.1° |
| C33 | C32 | H321 | H322 | 116.3° | 119.9° |
| C32 | C33 | H331 | H332 | 116.4° | 119.9° |
| H321 | C32 | C33 | H331 | 40.7° | 57.0° |
| H321 | C32 | C33 | H332 | 150.2° | 62.9° |
| H322 | C32 | C33 | H331 | 68.7° | 62.8° |
| H322 | C32 | C33 | H332 | 40.7° | 177.2° |
