XYE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.41Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.37Å | Aromatic |
| C2 | CL9 | sing | 1.74Å | 1.72Å | |
| C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C8 | sing | 1.51Å | 1.50Å | |
| C4 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.42Å | Aromatic |
| C5 | O7 | sing | 1.36Å | 1.36Å | |
| C6 | C10 | sing | 1.51Å | 1.55Å | |
| O7 | C14 | sing | 1.43Å | 1.41Å | |
| C10 | C11 | sing | 1.53Å | 1.54Å | |
| C10 | C12 | sing | 1.53Å | 1.54Å | |
| C10 | C13 | sing | 1.53Å | 1.53Å | |
| C14 | C15 | sing | 1.51Å | 1.51Å | |
| C15 | N16 | doub | 1.31Å | 1.37Å | Aromatic |
| C15 | C18 | sing | 1.39Å | 1.46Å | Aromatic |
| N16 | N17 | sing | 1.40Å | 1.35Å | Aromatic |
| N17 | C19 | sing | 1.34Å | 1.38Å | Aromatic |
| C18 | C19 | doub | 1.36Å | 1.40Å | Aromatic |
| C18 | C23 | sing | 1.51Å | 1.47Å | |
| C19 | C20 | sing | 1.51Å | 1.50Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C21 | N22 | sing | 1.47Å | 1.47Å | |
| N22 | C23 | sing | 1.47Å | 1.47Å | |
| C11 | H36 | sing | 1.09Å | 1.10Å | |
| C11 | H38 | sing | 1.09Å | 1.10Å | |
| C11 | H37 | sing | 1.09Å | 1.10Å | |
| C13 | H43 | sing | 1.09Å | 1.10Å | |
| C13 | H44 | sing | 1.09Å | 1.10Å | |
| C13 | H42 | sing | 1.09Å | 1.10Å | |
| C20 | H49 | sing | 1.09Å | 1.10Å | |
| C20 | H48 | sing | 1.09Å | 1.10Å | |
| C21 | H51 | sing | 1.09Å | 1.10Å | |
| C21 | H50 | sing | 1.09Å | 1.10Å | |
| C23 | H52 | sing | 1.09Å | 1.10Å | |
| C23 | H53 | sing | 1.09Å | 1.10Å | |
| C1 | H31 | sing | 1.08Å | 1.08Å | |
| C4 | H32 | sing | 1.08Å | 1.08Å | |
| C8 | H33 | sing | 1.09Å | 1.10Å | |
| C8 | H34 | sing | 1.09Å | 1.10Å | |
| C8 | H35 | sing | 1.09Å | 1.10Å | |
| C12 | H39 | sing | 1.09Å | 1.10Å | |
| C12 | H40 | sing | 1.09Å | 1.10Å | |
| C12 | H41 | sing | 1.09Å | 1.10Å | |
| C14 | H46 | sing | 1.09Å | 1.10Å | |
| C14 | H45 | sing | 1.09Å | 1.10Å | |
| N17 | H47 | sing | 0.97Å | 1.00Å | |
| N22 | C7 | sing | 1.35Å | 51.66Å | |
| C7 | O2 | sing | 1.35Å | 0.00Å | |
| C7 | O1 | doub | 1.21Å | 0.00Å | |
| O2 | C17 | sing | 1.45Å | 0.00Å | |
| C17 | C22 | sing | 1.53Å | 0.00Å | |
| C17 | C24 | sing | 1.53Å | 0.00Å | |
| C17 | C25 | sing | 1.53Å | 0.00Å | |
| C22 | H1 | sing | 1.09Å | 0.00Å | |
| C22 | H2 | sing | 1.09Å | 0.00Å | |
| C22 | H3 | sing | 1.09Å | 0.00Å | |
| C24 | H4 | sing | 1.09Å | 0.00Å | |
| C24 | H5 | sing | 1.09Å | 0.00Å | |
| C24 | H6 | sing | 1.09Å | 0.00Å | |
| C25 | H7 | sing | 1.09Å | 0.00Å | |
| C25 | H8 | sing | 1.09Å | 0.00Å | |
| C25 | H9 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 121.8° | 120.1° |
| C1 | C2 | C3 | 123.4° | 120.0° |
| C1 | C2 | CL9 | 117.7° | 120.0° |
| C2 | C1 | H31 | 119.1° | 119.9° |
| C1 | C6 | C5 | 114.0° | 120.0° |
| C1 | C6 | C10 | 121.2° | 120.0° |
| C6 | C1 | H31 | 119.1° | 120.0° |
| C3 | C2 | CL9 | 118.9° | 120.0° |
| C2 | C3 | C4 | 116.3° | 120.1° |
| C2 | C3 | C8 | 122.5° | 120.0° |
| C4 | C3 | C8 | 121.2° | 120.0° |
| C3 | C4 | C5 | 121.7° | 120.0° |
| C3 | C4 | H32 | 119.2° | 120.0° |
| C3 | C8 | H33 | 109.5° | 109.5° |
| C3 | C8 | H34 | 109.5° | 109.5° |
| C3 | C8 | H35 | 109.5° | 109.5° |
| C4 | C5 | C6 | 122.7° | 119.9° |
| C4 | C5 | O7 | 121.1° | 120.1° |
| C5 | C4 | H32 | 119.2° | 120.0° |
| C6 | C5 | O7 | 116.2° | 120.0° |
| C5 | C6 | C10 | 124.8° | 120.0° |
| C5 | O7 | C14 | 118.0° | 117.0° |
| C6 | C10 | C11 | 111.6° | 109.5° |
| C6 | C10 | C12 | 110.7° | 109.5° |
| C6 | C10 | C13 | 112.6° | 109.5° |
| O7 | C14 | C15 | 112.0° | 109.5° |
| O7 | C14 | H46 | 108.8° | 109.4° |
| O7 | C14 | H45 | 108.8° | 109.5° |
| C11 | C10 | C12 | 106.3° | 109.5° |
| C11 | C10 | C13 | 105.3° | 109.5° |
| C10 | C11 | H36 | 109.5° | 109.5° |
| C10 | C11 | H38 | 109.5° | 109.4° |
| C10 | C11 | H37 | 109.5° | 109.5° |
| C12 | C10 | C13 | 110.0° | 109.5° |
| C10 | C12 | H39 | 109.5° | 109.5° |
| C10 | C12 | H40 | 109.5° | 109.5° |
| C10 | C12 | H41 | 109.5° | 109.5° |
| C10 | C13 | H43 | 109.5° | 109.5° |
| C10 | C13 | H44 | 109.5° | 109.5° |
| C10 | C13 | H42 | 109.4° | 109.4° |
| C14 | C15 | N16 | 118.9° | 126.0° |
| C14 | C15 | C18 | 131.4° | 126.0° |
| C15 | C14 | H46 | 108.8° | 109.4° |
| C15 | C14 | H45 | 108.8° | 109.5° |
| N16 | C15 | C18 | 109.7° | 108.0° |
| C15 | N16 | N17 | 104.8° | 108.3° |
| C15 | C18 | C19 | 105.6° | 108.1° |
| C15 | C18 | C23 | 134.7° | 128.1° |
| N16 | N17 | C19 | 114.6° | 107.8° |
| N16 | N17 | H47 | 122.7° | 126.1° |
| N17 | C19 | C18 | 105.2° | 107.7° |
| N17 | C19 | C20 | 129.1° | 127.8° |
| C19 | N17 | H47 | 122.7° | 126.1° |
| C19 | C18 | C23 | 119.7° | 123.8° |
| C18 | C19 | C20 | 125.6° | 124.5° |
| C18 | C23 | N22 | 113.3° | 107.3° |
| C18 | C23 | H52 | 108.5° | 109.9° |
| C18 | C23 | H53 | 108.5° | 109.9° |
| C19 | C20 | C21 | 108.5° | 108.8° |
| C19 | C20 | H49 | 109.7° | 109.6° |
| C19 | C20 | H48 | 109.7° | 109.6° |
| C20 | C21 | N22 | 110.6° | 109.2° |
| C21 | C20 | H49 | 109.7° | 109.6° |
| C21 | C20 | H48 | 109.7° | 109.6° |
| C20 | C21 | H51 | 109.2° | 109.5° |
| C20 | C21 | H50 | 109.2° | 109.6° |
| C21 | N22 | C23 | 117.3° | 118.4° |
| N22 | C21 | H51 | 109.2° | 109.5° |
| N22 | C21 | H50 | 109.2° | 109.5° |
| C21 | N22 | C7 | 113.7° | 120.8° |
| N22 | C23 | H52 | 108.5° | 109.9° |
| N22 | C23 | H53 | 108.5° | 110.0° |
| C23 | N22 | C7 | 45.6° | 120.8° |
| H36 | C11 | H38 | 109.4° | 109.4° |
| H36 | C11 | H37 | 109.4° | 109.5° |
| H38 | C11 | H37 | 109.5° | 109.5° |
| H43 | C13 | H44 | 109.5° | 109.5° |
| H43 | C13 | H42 | 109.5° | 109.5° |
| H44 | C13 | H42 | 109.5° | 109.5° |
| H49 | C20 | H48 | 109.5° | 109.7° |
| H51 | C21 | H50 | 109.5° | 109.6° |
| H52 | C23 | H53 | 109.5° | 109.9° |
| H33 | C8 | H34 | 109.4° | 109.5° |
| H33 | C8 | H35 | 109.4° | 109.5° |
| H34 | C8 | H35 | 109.5° | 109.5° |
| H39 | C12 | H40 | 109.4° | 109.5° |
| H39 | C12 | H41 | 109.5° | 109.4° |
| H40 | C12 | H41 | 109.4° | 109.5° |
| H46 | C14 | H45 | 109.5° | 109.5° |
| N22 | C7 | O2 | 90.0° | 120.0° |
| N22 | C7 | O1 | 90.0° | 120.0° |
| O2 | C7 | O1 | 90.0° | 120.0° |
| C7 | O2 | C17 | 90.0° | 117.0° |
| O2 | C17 | C22 | 90.0° | 109.5° |
| O2 | C17 | C24 | 90.0° | 109.5° |
| O2 | C17 | C25 | 90.0° | 109.5° |
| C22 | C17 | C24 | 90.0° | 109.5° |
| C22 | C17 | C25 | 90.0° | 109.5° |
| C17 | C22 | H1 | 90.0° | 109.5° |
| C17 | C22 | H2 | 90.0° | 109.5° |
| C17 | C22 | H3 | 90.0° | 109.5° |
| C24 | C17 | C25 | 90.0° | 109.5° |
| C17 | C24 | H4 | 90.0° | 109.5° |
| C17 | C24 | H5 | 90.0° | 109.4° |
| C17 | C24 | H6 | 90.0° | 109.5° |
| C17 | C25 | H7 | 90.0° | 109.4° |
| C17 | C25 | H8 | 90.0° | 109.5° |
| C17 | C25 | H9 | 90.0° | 109.5° |
| H1 | C22 | H2 | 90.0° | 109.4° |
| H1 | C22 | H3 | 90.0° | 109.4° |
| H2 | C22 | H3 | 90.0° | 109.5° |
| H4 | C24 | H5 | 90.0° | 109.4° |
| H4 | C24 | H6 | 90.0° | 109.5° |
| H5 | C24 | H6 | 90.0° | 109.5° |
| H7 | C25 | H8 | 90.0° | 109.5° |
| H7 | C25 | H9 | 90.0° | 109.5° |
| H8 | C25 | H9 | 90.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H31 | 180.0° | 179.8° |
| C1 | C2 | C3 | CL9 | 179.9° | 180.0° |
| C1 | C2 | C3 | C4 | 1.3° | 0.0° |
| C1 | C2 | C3 | C8 | 179.2° | 180.0° |
| C2 | C1 | C6 | C5 | 0.3° | 0.0° |
| C2 | C1 | C6 | C10 | 179.6° | 180.0° |
| C6 | C1 | C2 | C3 | 1.0° | 0.0° |
| C6 | C1 | C2 | CL9 | 178.9° | 180.0° |
| C1 | C6 | C5 | C4 | 1.2° | 0.0° |
| C1 | C6 | C5 | C10 | 179.9° | 180.0° |
| C1 | C6 | C5 | O7 | 179.9° | 180.0° |
| C1 | C6 | C10 | C11 | 8.2° | 0.0° |
| C1 | C6 | C10 | C12 | 110.0° | 120.0° |
| C1 | C6 | C10 | C13 | 126.4° | 120.0° |
| C2 | C3 | C4 | C8 | 177.9° | 180.0° |
| C2 | C3 | C4 | C5 | 0.4° | 0.0° |
| C3 | C2 | C1 | H31 | 179.0° | 179.8° |
| C2 | C3 | C4 | H32 | 179.6° | 179.9° |
| C2 | C3 | C8 | H33 | 88.8° | 90.0° |
| C2 | C3 | C8 | H34 | 151.2° | 150.0° |
| C2 | C3 | C8 | H35 | 31.1° | 30.0° |
| CL9 | C2 | C3 | C4 | 178.6° | 180.0° |
| CL9 | C2 | C3 | C8 | 0.8° | 0.0° |
| CL9 | C2 | C1 | H31 | 1.1° | 0.3° |
| C3 | C4 | C5 | H32 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 0.9° | 0.0° |
| C3 | C4 | C5 | O7 | 179.6° | 180.0° |
| C4 | C3 | C8 | H33 | 88.9° | 90.0° |
| C4 | C3 | C8 | H34 | 31.1° | 30.0° |
| C4 | C3 | C8 | H35 | 151.1° | 150.0° |
| C8 | C3 | C4 | C5 | 178.3° | 180.0° |
| C8 | C3 | C4 | H32 | 1.7° | 0.0° |
| C3 | C8 | H33 | H34 | 120.0° | 120.0° |
| C3 | C8 | H33 | H35 | 120.0° | 120.0° |
| C3 | C8 | H34 | H35 | 120.0° | 120.0° |
| C4 | C5 | C6 | O7 | 178.7° | 180.0° |
| C4 | C5 | C6 | C10 | 178.7° | 180.0° |
| C4 | C5 | O7 | C14 | 0.5° | 0.0° |
| C6 | C5 | O7 | C14 | 179.3° | 179.9° |
| C5 | C6 | C10 | C11 | 171.8° | 180.0° |
| C5 | C6 | C10 | C12 | 70.0° | 60.0° |
| C5 | C6 | C10 | C13 | 53.7° | 60.0° |
| C5 | C6 | C1 | H31 | 179.7° | 179.7° |
| C6 | C5 | C4 | H32 | 179.1° | 179.9° |
| O7 | C5 | C6 | C10 | 0.0° | 0.0° |
| C5 | O7 | C14 | C15 | 172.6° | 180.0° |
| O7 | C5 | C4 | H32 | 0.5° | 0.0° |
| C5 | O7 | C14 | H46 | 67.0° | 60.1° |
| C5 | O7 | C14 | H45 | 52.3° | 60.0° |
| C6 | C10 | C11 | C12 | 120.8° | 120.0° |
| C6 | C10 | C11 | C13 | 122.5° | 120.0° |
| C6 | C10 | C12 | C13 | 125.1° | 120.0° |
| C6 | C10 | C11 | H36 | 180.0° | 60.0° |
| C6 | C10 | C11 | H38 | 60.0° | 60.0° |
| C6 | C10 | C11 | H37 | 60.0° | 180.0° |
| C6 | C10 | C13 | H43 | 180.0° | 60.0° |
| C6 | C10 | C13 | H44 | 60.0° | 60.1° |
| C6 | C10 | C13 | H42 | 60.0° | 180.0° |
| C10 | C6 | C1 | H31 | 0.4° | 0.2° |
| C6 | C10 | C12 | H39 | 180.0° | 180.0° |
| C6 | C10 | C12 | H40 | 60.0° | 60.0° |
| C6 | C10 | C12 | H41 | 60.0° | 60.0° |
| O7 | C14 | C15 | H46 | 120.4° | 119.9° |
| O7 | C14 | C15 | H45 | 120.4° | 120.0° |
| O7 | C14 | C15 | N16 | 125.9° | 90.0° |
| O7 | C14 | C15 | C18 | 57.6° | 90.3° |
| O7 | C14 | H46 | H45 | 118.8° | 120.0° |
| C11 | C10 | C12 | C13 | 113.5° | 120.0° |
| C10 | C11 | H36 | H38 | 120.0° | 120.0° |
| C10 | C11 | H36 | H37 | 120.0° | 120.1° |
| C10 | C11 | H38 | H37 | 120.0° | 120.0° |
| C11 | C10 | C13 | H43 | 58.2° | 60.0° |
| C11 | C10 | C13 | H44 | 178.2° | 180.0° |
| C11 | C10 | C13 | H42 | 61.8° | 60.0° |
| C11 | C10 | C12 | H39 | 58.7° | 60.0° |
| C11 | C10 | C12 | H40 | 61.4° | 180.0° |
| C11 | C10 | C12 | H41 | 178.7° | 60.0° |
| C12 | C10 | C11 | H36 | 59.2° | 60.0° |
| C12 | C10 | C11 | H38 | 179.2° | 180.0° |
| C12 | C10 | C11 | H37 | 60.8° | 60.1° |
| C12 | C10 | C13 | H43 | 56.0° | 180.0° |
| C12 | C10 | C13 | H44 | 64.0° | 60.0° |
| C12 | C10 | C13 | H42 | 176.0° | 60.0° |
| C10 | C12 | H39 | H40 | 120.0° | 120.1° |
| C10 | C12 | H39 | H41 | 120.0° | 120.0° |
| C10 | C12 | H40 | H41 | 120.0° | 120.1° |
| C13 | C10 | C11 | H36 | 57.5° | 180.0° |
| C13 | C10 | C11 | H38 | 62.5° | 60.0° |
| C13 | C10 | C11 | H37 | 177.5° | 60.0° |
| C10 | C13 | H43 | H44 | 120.0° | 120.0° |
| C10 | C13 | H43 | H42 | 120.0° | 120.0° |
| C10 | C13 | H44 | H42 | 120.0° | 119.9° |
| C13 | C10 | C12 | H39 | 54.9° | 60.0° |
| C13 | C10 | C12 | H40 | 174.9° | 60.0° |
| C13 | C10 | C12 | H41 | 65.2° | 180.0° |
| C14 | C15 | N16 | C18 | 177.2° | 179.7° |
| C14 | C15 | N16 | N17 | 178.7° | 179.8° |
| C14 | C15 | C18 | C19 | 178.0° | 179.9° |
| C14 | C15 | C18 | C23 | 3.6° | 0.1° |
| C15 | C14 | H46 | H45 | 118.9° | 120.0° |
| C15 | N16 | N17 | C19 | 1.1° | 0.1° |
| N16 | C15 | C18 | C19 | 1.3° | 0.1° |
| N16 | C15 | C18 | C23 | 179.7° | 179.7° |
| N16 | C15 | C14 | H46 | 5.5° | 150.0° |
| N16 | C15 | C14 | H45 | 113.7° | 30.0° |
| C15 | N16 | N17 | H47 | 178.9° | 179.8° |
| C18 | C15 | N16 | N17 | 1.5° | 0.0° |
| C15 | C18 | C19 | N17 | 0.6° | 0.2° |
| C15 | C18 | C19 | C23 | 178.7° | 179.8° |
| C15 | C18 | C19 | C20 | 179.3° | 179.7° |
| C15 | C18 | C23 | N22 | 175.6° | 169.0° |
| C15 | C18 | C23 | H52 | 55.1° | 71.6° |
| C15 | C18 | C23 | H53 | 63.8° | 49.4° |
| C18 | C15 | C14 | H46 | 178.0° | 29.7° |
| C18 | C15 | C14 | H45 | 62.8° | 149.7° |
| N16 | N17 | C19 | H47 | 180.0° | 179.9° |
| N16 | N17 | C19 | C18 | 0.3° | 0.2° |
| N16 | N17 | C19 | C20 | 179.8° | 179.7° |
| N17 | C19 | C18 | C20 | 179.9° | 179.9° |
| N17 | C19 | C18 | C23 | 179.3° | 179.6° |
| N17 | C19 | C20 | C21 | 158.0° | 162.2° |
| N17 | C19 | C20 | H49 | 38.2° | 78.1° |
| N17 | C19 | C20 | H48 | 82.1° | 42.4° |
| C18 | C19 | C20 | C21 | 21.9° | 18.0° |
| C19 | C18 | C23 | N22 | 6.2° | 11.2° |
| C18 | C19 | C20 | H49 | 141.7° | 101.8° |
| C18 | C19 | C20 | H48 | 98.0° | 137.8° |
| C19 | C18 | C23 | H52 | 126.7° | 108.2° |
| C19 | C18 | C23 | H53 | 114.4° | 130.8° |
| C18 | C19 | N17 | H47 | 179.7° | 179.8° |
| C23 | C18 | C19 | C20 | 0.7° | 0.5° |
| C18 | C23 | N22 | C21 | 36.2° | 44.3° |
| C18 | C23 | N22 | H52 | 120.6° | 119.4° |
| C18 | C23 | N22 | H53 | 120.6° | 119.5° |
| C18 | C23 | H52 | H53 | 118.3° | 121.0° |
| C18 | C23 | N22 | C7 | 133.6° | 135.6° |
| C19 | C20 | C21 | H49 | 119.8° | 119.8° |
| C19 | C20 | C21 | H48 | 119.9° | 119.8° |
| C19 | C20 | C21 | N22 | 47.8° | 45.4° |
| C19 | C20 | H49 | H48 | 120.5° | 120.4° |
| C19 | C20 | C21 | H51 | 72.4° | 165.3° |
| C19 | C20 | C21 | H50 | 168.0° | 74.5° |
| C20 | C19 | N17 | H47 | 0.2° | 0.3° |
| C20 | C21 | N22 | H51 | 120.2° | 119.9° |
| C20 | C21 | N22 | H50 | 120.2° | 120.0° |
| C20 | C21 | N22 | C23 | 59.1° | 64.5° |
| C21 | C20 | H49 | H48 | 120.4° | 120.4° |
| C20 | C21 | H51 | H50 | 119.4° | 120.2° |
| C20 | C21 | N22 | C7 | 109.9° | 115.4° |
| C21 | N22 | C23 | C7 | 97.4° | 179.9° |
| N22 | C21 | C20 | H49 | 167.6° | 74.4° |
| N22 | C21 | C20 | H48 | 72.1° | 165.2° |
| N22 | C21 | H51 | H50 | 119.5° | 120.1° |
| C21 | N22 | C23 | H52 | 156.7° | 75.2° |
| C21 | N22 | C23 | H53 | 84.4° | 163.8° |
| C21 | N22 | C7 | O2 | 90.0° | 0.0° |
| C21 | N22 | C7 | O1 | 90.0° | 180.0° |
| C23 | N22 | C21 | H51 | 61.1° | 175.6° |
| C23 | N22 | C21 | H50 | 179.3° | 55.5° |
| N22 | C23 | H52 | H53 | 118.2° | 121.2° |
| C23 | N22 | C7 | O2 | 90.0° | 179.9° |
| C23 | N22 | C7 | O1 | 90.0° | 0.1° |
| H36 | C11 | H38 | H37 | 120.0° | 120.0° |
| H43 | C13 | H44 | H42 | 120.0° | 120.0° |
| H49 | C20 | C21 | H51 | 47.4° | 45.5° |
| H49 | C20 | C21 | H50 | 72.2° | 165.7° |
| H48 | C20 | C21 | H51 | 167.7° | 74.9° |
| H48 | C20 | C21 | H50 | 48.1° | 45.2° |
| H51 | C21 | N22 | C7 | 10.3° | 4.5° |
| H50 | C21 | N22 | C7 | 130.0° | 124.6° |
| H52 | C23 | N22 | C7 | 105.9° | 104.9° |
| H53 | C23 | N22 | C7 | 13.0° | 16.1° |
| H33 | C8 | H34 | H35 | 120.0° | 120.0° |
| H39 | C12 | H40 | H41 | 120.0° | 119.9° |
| N22 | C7 | O2 | O1 | 90.0° | 180.0° |
| N22 | C7 | O2 | C17 | 90.0° | 180.0° |
| C7 | O2 | C17 | C22 | 90.0° | 60.0° |
| C7 | O2 | C17 | C24 | 90.0° | 180.0° |
| C7 | O2 | C17 | C25 | 90.0° | 60.0° |
| O1 | C7 | O2 | C17 | 90.0° | 0.0° |
| O2 | C17 | C22 | C24 | 90.0° | 120.0° |
| O2 | C17 | C22 | C25 | 90.0° | 120.0° |
| O2 | C17 | C24 | C25 | 90.0° | 120.0° |
| O2 | C17 | C22 | H1 | 90.0° | 60.0° |
| O2 | C17 | C22 | H2 | 90.0° | 180.0° |
| O2 | C17 | C22 | H3 | 90.0° | 60.0° |
| O2 | C17 | C24 | H4 | 90.0° | 60.1° |
| O2 | C17 | C24 | H5 | 90.0° | 180.0° |
| O2 | C17 | C24 | H6 | 90.0° | 60.0° |
| O2 | C17 | C25 | H7 | 90.0° | 60.0° |
| O2 | C17 | C25 | H8 | 90.0° | 180.0° |
| O2 | C17 | C25 | H9 | 90.0° | 60.0° |
| C22 | C17 | C24 | C25 | 90.0° | 120.0° |
| C17 | C22 | H1 | H2 | 90.0° | 120.0° |
| C17 | C22 | H1 | H3 | 90.0° | 120.0° |
| C17 | C22 | H2 | H3 | 90.0° | 120.1° |
| C22 | C17 | C24 | H4 | 90.0° | 179.9° |
| C22 | C17 | C24 | H5 | 90.0° | 60.0° |
| C22 | C17 | C24 | H6 | 90.0° | 60.0° |
| C22 | C17 | C25 | H7 | 90.0° | 60.0° |
| C22 | C17 | C25 | H8 | 90.0° | 60.0° |
| C22 | C17 | C25 | H9 | 90.0° | 180.0° |
| C24 | C17 | C22 | H1 | 90.0° | 60.0° |
| C24 | C17 | C22 | H2 | 90.0° | 60.0° |
| C24 | C17 | C22 | H3 | 90.0° | 179.9° |
| C17 | C24 | H4 | H5 | 90.0° | 119.9° |
| C17 | C24 | H4 | H6 | 90.0° | 120.1° |
| C17 | C24 | H5 | H6 | 90.0° | 120.0° |
| C24 | C17 | C25 | H7 | 90.0° | 180.0° |
| C24 | C17 | C25 | H8 | 90.0° | 60.0° |
| C24 | C17 | C25 | H9 | 90.0° | 60.0° |
| C25 | C17 | C22 | H1 | 90.0° | 180.0° |
| C25 | C17 | C22 | H2 | 90.0° | 60.0° |
| C25 | C17 | C22 | H3 | 90.0° | 60.1° |
| C25 | C17 | C24 | H4 | 90.0° | 59.9° |
| C25 | C17 | C24 | H5 | 90.0° | 60.0° |
| C25 | C17 | C24 | H6 | 90.0° | 180.0° |
| C17 | C25 | H7 | H8 | 90.0° | 120.0° |
| C17 | C25 | H7 | H9 | 90.0° | 120.0° |
| C17 | C25 | H8 | H9 | 90.0° | 120.0° |
| H1 | C22 | H2 | H3 | 90.0° | 119.9° |
| H4 | C24 | H5 | H6 | 90.0° | 120.0° |
| H7 | C25 | H8 | H9 | 90.0° | 120.0° |
