XW7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | O3 | sing | 1.43Å | 1.42Å | |
| O3 | C18 | sing | 1.36Å | 1.38Å | |
| O2 | C23 | sing | 1.43Å | 1.42Å | |
| O2 | C16 | sing | 1.36Å | 1.38Å | |
| C18 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | C13 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C12 | sing | 1.38Å | 1.40Å | Aromatic |
| C13 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C12 | C8 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | C8 | sing | 1.38Å | 1.41Å | Aromatic |
| C10 | C9 | sing | 1.51Å | 1.53Å | |
| C8 | C2 | sing | 1.51Å | 1.54Å | |
| O4 | C17 | doub | 1.21Å | 1.23Å | |
| C9 | C7 | sing | 1.52Å | 1.54Å | |
| C5 | C2 | sing | 1.53Å | 1.55Å | |
| C5 | C3 | sing | 1.53Å | 1.55Å | |
| C17 | O1 | sing | 1.34Å | 1.35Å | |
| C17 | C19 | sing | 1.51Å | 1.52Å | |
| C2 | N1 | sing | 1.46Å | 1.55Å | |
| C22 | C20 | sing | 1.53Å | 1.55Å | |
| O1 | C3 | sing | 1.45Å | 1.43Å | |
| C21 | C20 | sing | 1.53Å | 1.54Å | |
| C7 | N1 | sing | 1.47Å | 1.54Å | |
| C3 | C1 | sing | 1.53Å | 1.55Å | |
| C20 | C19 | sing | 1.53Å | 1.57Å | |
| N1 | C4 | sing | 1.46Å | 1.55Å | |
| C19 | N2 | sing | 1.47Å | 1.51Å | |
| C1 | C4 | sing | 1.53Å | 1.54Å | |
| C1 | C6 | sing | 1.53Å | 1.55Å | |
| C6 | C11 | sing | 1.53Å | 1.55Å | |
| C15 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | C14 | sing | 1.53Å | 1.54Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.08Å | 1.08Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C13 | H23 | sing | 1.08Å | 1.08Å | |
| N2 | H24 | sing | 1.01Å | 1.00Å | |
| N2 | H25 | sing | 1.01Å | 1.00Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C22 | H32 | sing | 1.09Å | 1.10Å | |
| C22 | H33 | sing | 1.09Å | 1.10Å | |
| C22 | H34 | sing | 1.09Å | 1.10Å | |
| C23 | H35 | sing | 1.09Å | 1.10Å | |
| C23 | H36 | sing | 1.09Å | 1.10Å | |
| C23 | H37 | sing | 1.09Å | 1.10Å | |
| C24 | H38 | sing | 1.09Å | 1.10Å | |
| C24 | H39 | sing | 1.09Å | 1.10Å | |
| C24 | H40 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | O3 | C18 | 118.7° | 117.0° |
| O3 | C24 | H38 | 109.5° | 109.5° |
| O3 | C24 | H39 | 109.5° | 109.5° |
| O3 | C24 | H40 | 109.5° | 109.4° |
| O3 | C18 | C16 | 117.2° | 120.1° |
| O3 | C18 | C13 | 123.7° | 120.1° |
| C23 | O2 | C16 | 119.1° | 117.0° |
| O2 | C23 | H35 | 109.5° | 109.4° |
| O2 | C23 | H36 | 109.4° | 109.5° |
| O2 | C23 | H37 | 109.5° | 109.4° |
| O2 | C16 | C18 | 116.8° | 120.2° |
| O2 | C16 | C12 | 124.2° | 120.2° |
| C16 | C18 | C13 | 119.2° | 119.8° |
| C18 | C16 | C12 | 119.0° | 119.6° |
| C18 | C13 | C10 | 122.1° | 120.4° |
| C18 | C13 | H23 | 119.0° | 119.8° |
| C16 | C12 | C8 | 122.3° | 120.4° |
| C16 | C12 | H16 | 118.9° | 119.8° |
| C13 | C10 | C8 | 119.3° | 119.9° |
| C13 | C10 | C9 | 119.3° | 118.3° |
| C10 | C13 | H23 | 119.0° | 119.8° |
| C12 | C8 | C10 | 118.3° | 119.9° |
| C12 | C8 | C2 | 119.3° | 118.3° |
| C8 | C12 | H16 | 118.9° | 119.8° |
| C8 | C10 | C9 | 121.4° | 121.8° |
| C10 | C8 | C2 | 122.4° | 121.8° |
| C10 | C9 | C7 | 114.4° | 110.1° |
| C10 | C9 | H13 | 108.2° | 109.2° |
| C10 | C9 | H14 | 108.2° | 109.4° |
| C8 | C2 | C5 | 113.6° | 108.6° |
| C8 | C2 | N1 | 110.5° | 110.1° |
| C8 | C2 | H1 | 107.5° | 109.4° |
| O4 | C17 | O1 | 123.9° | 120.0° |
| O4 | C17 | C19 | 122.1° | 120.0° |
| C9 | C7 | N1 | 109.1° | 108.7° |
| C9 | C7 | H9 | 109.6° | 109.7° |
| C9 | C7 | H10 | 109.6° | 109.5° |
| C7 | C9 | H13 | 108.2° | 109.4° |
| C7 | C9 | H14 | 108.2° | 109.4° |
| C2 | C5 | C3 | 115.8° | 109.5° |
| C5 | C2 | N1 | 110.4° | 109.9° |
| C5 | C2 | H1 | 107.3° | 109.4° |
| C2 | C5 | H5 | 107.9° | 109.5° |
| C2 | C5 | H6 | 107.9° | 109.4° |
| C5 | C3 | O1 | 110.5° | 109.6° |
| C5 | C3 | C1 | 114.9° | 109.0° |
| C5 | C3 | H2 | 104.4° | 109.6° |
| C3 | C5 | H5 | 107.9° | 109.5° |
| C3 | C5 | H6 | 107.9° | 109.5° |
| O1 | C17 | C19 | 114.1° | 120.0° |
| C17 | O1 | C3 | 125.5° | 117.0° |
| C17 | C19 | C20 | 118.1° | 109.5° |
| C17 | C19 | N2 | 106.3° | 109.5° |
| C17 | C19 | H27 | 105.4° | 109.5° |
| C2 | N1 | C7 | 111.6° | 110.7° |
| C2 | N1 | C4 | 111.9° | 112.4° |
| N1 | C2 | H1 | 107.3° | 109.4° |
| C22 | C20 | C21 | 108.2° | 109.5° |
| C22 | C20 | C19 | 116.9° | 109.5° |
| C22 | C20 | H28 | 107.1° | 109.5° |
| C20 | C22 | H32 | 109.5° | 109.5° |
| C20 | C22 | H33 | 109.4° | 109.5° |
| C20 | C22 | H34 | 109.4° | 109.5° |
| O1 | C3 | C1 | 115.7° | 109.5° |
| O1 | C3 | H2 | 105.6° | 109.6° |
| C21 | C20 | C19 | 110.2° | 109.4° |
| C21 | C20 | H28 | 107.2° | 109.4° |
| C20 | C21 | H29 | 109.5° | 109.4° |
| C20 | C21 | H30 | 109.4° | 109.5° |
| C20 | C21 | H31 | 109.5° | 109.5° |
| C7 | N1 | C4 | 114.1° | 112.0° |
| N1 | C7 | H9 | 109.6° | 109.6° |
| N1 | C7 | H10 | 109.6° | 109.6° |
| C3 | C1 | C4 | 107.8° | 109.0° |
| C3 | C1 | C6 | 111.0° | 109.5° |
| C1 | C3 | H2 | 104.4° | 109.5° |
| C3 | C1 | H12 | 108.0° | 109.6° |
| C20 | C19 | N2 | 115.3° | 109.4° |
| C20 | C19 | H27 | 105.0° | 109.5° |
| C19 | C20 | H28 | 106.8° | 109.5° |
| N1 | C4 | C1 | 108.6° | 109.9° |
| N1 | C4 | H3 | 109.7° | 109.4° |
| N1 | C4 | H4 | 109.7° | 109.4° |
| C19 | N2 | H24 | 109.5° | 111.0° |
| C19 | N2 | H25 | 109.5° | 111.0° |
| N2 | C19 | H27 | 105.6° | 109.5° |
| C4 | C1 | C6 | 113.6° | 109.6° |
| C1 | C4 | H3 | 109.7° | 109.4° |
| C1 | C4 | H4 | 109.7° | 109.3° |
| C4 | C1 | H12 | 108.1° | 109.6° |
| C1 | C6 | C11 | 118.6° | 109.5° |
| C1 | C6 | H7 | 107.1° | 109.5° |
| C1 | C6 | H8 | 107.2° | 109.5° |
| C6 | C1 | H12 | 108.0° | 109.6° |
| C6 | C11 | C15 | 113.0° | 109.5° |
| C6 | C11 | C14 | 109.4° | 109.5° |
| C11 | C6 | H7 | 107.2° | 109.4° |
| C11 | C6 | H8 | 107.1° | 109.5° |
| C6 | C11 | H15 | 108.0° | 109.5° |
| C15 | C11 | C14 | 109.9° | 109.5° |
| C15 | C11 | H15 | 108.2° | 109.5° |
| C11 | C15 | H17 | 109.5° | 109.5° |
| C11 | C15 | H18 | 109.4° | 109.4° |
| C11 | C15 | H19 | 109.5° | 109.5° |
| C14 | C11 | H15 | 108.1° | 109.4° |
| C11 | C14 | H20 | 109.5° | 109.4° |
| C11 | C14 | H21 | 109.5° | 109.5° |
| C11 | C14 | H22 | 109.5° | 109.5° |
| H3 | C4 | H4 | 109.5° | 109.4° |
| H5 | C5 | H6 | 109.4° | 109.4° |
| H7 | C6 | H8 | 109.4° | 109.5° |
| H9 | C7 | H10 | 109.5° | 109.6° |
| H13 | C9 | H14 | 109.5° | 109.4° |
| H17 | C15 | H18 | 109.5° | 109.4° |
| H17 | C15 | H19 | 109.5° | 109.5° |
| H18 | C15 | H19 | 109.4° | 109.5° |
| H20 | C14 | H21 | 109.5° | 109.5° |
| H20 | C14 | H22 | 109.5° | 109.5° |
| H21 | C14 | H22 | 109.5° | 109.4° |
| H24 | N2 | H25 | 109.5° | 111.1° |
| H29 | C21 | H30 | 109.5° | 109.5° |
| H29 | C21 | H31 | 109.5° | 109.4° |
| H30 | C21 | H31 | 109.5° | 109.5° |
| H32 | C22 | H33 | 109.5° | 109.5° |
| H32 | C22 | H34 | 109.5° | 109.5° |
| H33 | C22 | H34 | 109.5° | 109.5° |
| H35 | C23 | H36 | 109.5° | 109.5° |
| H35 | C23 | H37 | 109.5° | 109.5° |
| H36 | C23 | H37 | 109.5° | 109.5° |
| H38 | C24 | H39 | 109.5° | 109.4° |
| H38 | C24 | H40 | 109.5° | 109.5° |
| H39 | C24 | H40 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | O3 | C18 | C16 | 164.9° | 180.0° |
| C24 | O3 | C18 | C13 | 15.1° | 0.0° |
| O3 | C24 | H38 | H39 | 120.0° | 120.0° |
| O3 | C24 | H38 | H40 | 120.0° | 120.0° |
| O3 | C24 | H39 | H40 | 120.0° | 119.9° |
| O3 | C18 | C16 | O2 | 0.1° | 0.0° |
| O3 | C18 | C16 | C13 | 179.9° | 180.0° |
| O3 | C18 | C16 | C12 | 180.0° | 179.9° |
| O3 | C18 | C13 | C10 | 180.0° | 179.9° |
| O3 | C18 | C13 | H23 | 0.0° | 0.0° |
| C18 | O3 | C24 | H38 | 180.0° | 60.0° |
| C18 | O3 | C24 | H39 | 60.0° | 180.0° |
| C18 | O3 | C24 | H40 | 60.0° | 60.0° |
| C23 | O2 | C16 | C18 | 109.6° | 180.0° |
| C23 | O2 | C16 | C12 | 70.5° | 0.0° |
| O2 | C23 | H35 | H36 | 120.0° | 120.0° |
| O2 | C23 | H35 | H37 | 120.0° | 119.9° |
| O2 | C23 | H36 | H37 | 120.0° | 120.0° |
| O2 | C16 | C18 | C12 | 179.9° | 180.0° |
| O2 | C16 | C18 | C13 | 180.0° | 179.9° |
| O2 | C16 | C12 | C8 | 180.0° | 180.0° |
| O2 | C16 | C12 | H16 | 0.0° | 0.0° |
| C16 | O2 | C23 | H35 | 180.0° | 180.0° |
| C16 | O2 | C23 | H36 | 60.0° | 60.0° |
| C16 | O2 | C23 | H37 | 60.0° | 60.1° |
| C16 | C18 | C13 | C10 | 0.1° | 0.0° |
| C18 | C16 | C12 | C8 | 0.2° | 0.1° |
| C18 | C16 | C12 | H16 | 179.8° | 179.9° |
| C16 | C18 | C13 | H23 | 179.9° | 180.0° |
| C13 | C18 | C16 | C12 | 0.1° | 0.1° |
| C18 | C13 | C10 | H23 | 180.0° | 180.0° |
| C18 | C13 | C10 | C8 | 0.1° | 0.3° |
| C18 | C13 | C10 | C9 | 180.0° | 179.7° |
| C16 | C12 | C8 | H16 | 180.0° | 180.0° |
| C16 | C12 | C8 | C10 | 0.1° | 0.2° |
| C16 | C12 | C8 | C2 | 179.9° | 179.8° |
| C13 | C10 | C8 | C12 | 0.1° | 0.3° |
| C13 | C10 | C8 | C9 | 180.0° | 180.0° |
| C13 | C10 | C8 | C2 | 179.8° | 179.7° |
| C13 | C10 | C9 | C7 | 166.8° | 164.0° |
| C13 | C10 | C9 | H13 | 46.1° | 75.9° |
| C13 | C10 | C9 | H14 | 72.5° | 43.8° |
| C12 | C8 | C10 | C2 | 179.7° | 180.0° |
| C12 | C8 | C10 | C9 | 180.0° | 179.7° |
| C12 | C8 | C2 | C5 | 73.7° | 77.6° |
| C12 | C8 | C2 | N1 | 161.6° | 162.0° |
| C12 | C8 | C2 | H1 | 44.8° | 41.8° |
| C8 | C10 | C9 | C7 | 13.3° | 16.0° |
| C10 | C8 | C2 | C5 | 106.0° | 102.3° |
| C10 | C8 | C2 | N1 | 18.6° | 18.0° |
| C10 | C8 | C2 | H1 | 135.4° | 138.3° |
| C8 | C10 | C9 | H13 | 134.0° | 104.1° |
| C8 | C10 | C9 | H14 | 107.5° | 136.3° |
| C10 | C8 | C12 | H16 | 179.9° | 179.9° |
| C8 | C10 | C13 | H23 | 179.9° | 179.8° |
| C9 | C10 | C8 | C2 | 0.2° | 0.4° |
| C10 | C9 | C7 | H13 | 120.7° | 120.0° |
| C10 | C9 | C7 | H14 | 120.7° | 120.2° |
| C10 | C9 | C7 | N1 | 43.8° | 49.3° |
| C10 | C9 | C7 | H9 | 76.1° | 169.2° |
| C10 | C9 | C7 | H10 | 163.7° | 70.5° |
| C10 | C9 | H13 | H14 | 117.7° | 119.7° |
| C9 | C10 | C13 | H23 | 0.0° | 0.2° |
| C8 | C2 | C5 | N1 | 124.7° | 120.5° |
| C8 | C2 | C5 | H1 | 118.6° | 119.4° |
| C8 | C2 | C5 | C3 | 166.4° | 178.4° |
| C8 | C2 | N1 | H1 | 116.9° | 120.2° |
| C8 | C2 | N1 | C7 | 50.5° | 53.0° |
| C8 | C2 | N1 | C4 | 179.8° | 179.1° |
| C8 | C2 | C5 | H5 | 72.6° | 61.5° |
| C8 | C2 | C5 | H6 | 45.5° | 58.4° |
| C2 | C8 | C12 | H16 | 0.1° | 0.2° |
| O4 | C17 | O1 | C19 | 178.3° | 179.9° |
| O4 | C17 | O1 | C3 | 102.0° | 0.1° |
| O4 | C17 | C19 | C20 | 10.8° | 99.9° |
| O4 | C17 | C19 | N2 | 142.2° | 20.0° |
| O4 | C17 | C19 | H27 | 106.0° | 140.0° |
| C9 | C7 | N1 | C2 | 64.1° | 71.2° |
| C9 | C7 | N1 | H9 | 119.9° | 119.9° |
| C9 | C7 | N1 | H10 | 119.9° | 119.7° |
| C9 | C7 | N1 | C4 | 167.8° | 162.6° |
| C9 | C7 | H9 | H10 | 120.2° | 120.3° |
| C7 | C9 | H13 | H14 | 117.8° | 119.8° |
| C2 | C5 | C3 | H5 | 121.0° | 120.0° |
| C2 | C5 | C3 | H6 | 120.9° | 120.0° |
| C5 | C2 | N1 | H1 | 116.6° | 120.2° |
| C2 | C5 | C3 | O1 | 176.2° | 178.1° |
| C5 | C2 | N1 | C7 | 76.0° | 66.6° |
| C2 | C5 | C3 | C1 | 43.0° | 58.2° |
| C5 | C2 | N1 | C4 | 53.3° | 59.5° |
| C2 | C5 | C3 | H2 | 70.7° | 61.6° |
| C2 | C5 | H5 | H6 | 117.1° | 120.0° |
| C5 | C3 | O1 | C17 | 84.1° | 90.5° |
| C3 | C5 | C2 | N1 | 41.7° | 58.0° |
| C5 | C3 | O1 | C1 | 132.8° | 119.5° |
| C5 | C3 | O1 | H2 | 112.4° | 120.3° |
| C5 | C3 | C1 | H2 | 113.7° | 119.9° |
| C5 | C3 | C1 | C4 | 52.1° | 58.5° |
| C5 | C3 | C1 | C6 | 177.2° | 178.3° |
| C3 | C5 | C2 | H1 | 74.9° | 62.2° |
| C3 | C5 | H5 | H6 | 117.1° | 120.0° |
| C5 | C3 | C1 | H12 | 64.5° | 61.4° |
| C17 | O1 | C3 | C1 | 143.1° | 150.0° |
| O1 | C17 | C19 | C20 | 170.9° | 80.0° |
| O1 | C17 | C19 | N2 | 39.5° | 160.0° |
| C17 | O1 | C3 | H2 | 28.3° | 29.8° |
| O1 | C17 | C19 | H27 | 72.3° | 40.0° |
| C17 | C19 | C20 | C22 | 47.2° | 180.0° |
| C19 | C17 | O1 | C3 | 79.7° | 180.0° |
| C17 | C19 | C20 | C21 | 76.8° | 60.0° |
| C17 | C19 | C20 | N2 | 127.1° | 120.0° |
| C17 | C19 | C20 | H27 | 117.1° | 120.0° |
| C17 | C19 | N2 | H27 | 111.7° | 120.0° |
| C17 | C19 | N2 | H24 | 180.0° | 60.0° |
| C17 | C19 | N2 | H25 | 60.0° | 176.0° |
| C17 | C19 | C20 | H28 | 167.1° | 59.9° |
| C2 | N1 | C7 | C4 | 128.1° | 126.3° |
| C2 | N1 | C4 | C1 | 65.8° | 60.0° |
| C2 | N1 | C4 | H3 | 174.3° | 179.9° |
| C2 | N1 | C4 | H4 | 54.0° | 60.0° |
| N1 | C2 | C5 | H5 | 162.6° | 178.0° |
| N1 | C2 | C5 | H6 | 79.2° | 62.0° |
| C2 | N1 | C7 | H9 | 55.9° | 168.9° |
| C2 | N1 | C7 | H10 | 176.0° | 48.5° |
| C22 | C20 | C21 | C19 | 128.9° | 120.0° |
| C22 | C20 | C21 | H28 | 115.2° | 120.0° |
| C22 | C20 | C19 | H28 | 119.9° | 120.1° |
| C22 | C20 | C19 | N2 | 80.0° | 60.0° |
| C22 | C20 | C19 | H27 | 164.2° | 60.0° |
| C22 | C20 | C21 | H29 | 180.0° | 60.0° |
| C22 | C20 | C21 | H30 | 60.0° | 180.0° |
| C22 | C20 | C21 | H31 | 60.0° | 59.9° |
| C20 | C22 | H32 | H33 | 120.0° | 120.0° |
| C20 | C22 | H32 | H34 | 120.0° | 120.0° |
| C20 | C22 | H33 | H34 | 120.0° | 120.0° |
| O1 | C3 | C1 | H2 | 115.6° | 120.2° |
| O1 | C3 | C1 | C4 | 177.2° | 178.4° |
| O1 | C3 | C1 | C6 | 52.1° | 61.7° |
| O1 | C3 | C5 | H5 | 62.9° | 61.9° |
| O1 | C3 | C5 | H6 | 55.2° | 58.1° |
| O1 | C3 | C1 | H12 | 66.2° | 58.5° |
| C21 | C20 | C19 | H28 | 116.1° | 119.9° |
| C21 | C20 | C19 | N2 | 156.0° | 180.0° |
| C21 | C20 | C19 | H27 | 40.2° | 60.0° |
| C20 | C21 | H29 | H30 | 120.0° | 120.0° |
| C20 | C21 | H29 | H31 | 120.0° | 119.9° |
| C20 | C21 | H30 | H31 | 120.0° | 120.0° |
| C21 | C20 | C22 | H32 | 180.0° | 180.0° |
| C21 | C20 | C22 | H33 | 60.0° | 60.0° |
| C21 | C20 | C22 | H34 | 60.0° | 60.0° |
| C7 | N1 | C4 | C1 | 62.2° | 65.3° |
| C7 | N1 | C2 | H1 | 167.4° | 173.3° |
| C7 | N1 | C4 | H3 | 57.7° | 54.8° |
| C7 | N1 | C4 | H4 | 178.0° | 174.6° |
| N1 | C7 | H9 | H10 | 120.2° | 120.4° |
| N1 | C7 | C9 | H13 | 164.5° | 70.7° |
| N1 | C7 | C9 | H14 | 76.9° | 169.5° |
| C3 | C1 | C4 | N1 | 62.5° | 58.8° |
| C3 | C1 | C4 | C6 | 123.5° | 119.8° |
| C3 | C1 | C4 | H12 | 116.6° | 119.9° |
| C3 | C1 | C6 | H12 | 118.3° | 120.2° |
| C3 | C1 | C6 | C11 | 165.4° | 175.0° |
| C3 | C1 | C4 | H3 | 177.7° | 178.9° |
| C3 | C1 | C4 | H4 | 57.4° | 61.4° |
| C1 | C3 | C5 | H5 | 164.0° | 178.2° |
| C1 | C3 | C5 | H6 | 77.9° | 61.8° |
| C3 | C1 | C6 | H7 | 44.1° | 65.0° |
| C3 | C1 | C6 | H8 | 73.3° | 55.0° |
| C20 | C19 | N2 | H27 | 115.4° | 120.0° |
| C20 | C19 | N2 | H24 | 47.1° | 60.0° |
| C20 | C19 | N2 | H25 | 167.1° | 64.0° |
| C19 | C20 | C21 | H29 | 51.1° | 179.9° |
| C19 | C20 | C21 | H30 | 171.1° | 60.0° |
| C19 | C20 | C21 | H31 | 69.0° | 60.0° |
| C19 | C20 | C22 | H32 | 55.0° | 60.0° |
| C19 | C20 | C22 | H33 | 65.0° | 179.9° |
| C19 | C20 | C22 | H34 | 175.0° | 59.9° |
| N1 | C4 | C1 | H3 | 119.8° | 120.1° |
| N1 | C4 | C1 | H4 | 119.9° | 120.1° |
| N1 | C4 | C1 | C6 | 174.0° | 178.6° |
| C4 | N1 | C2 | H1 | 63.3° | 60.7° |
| N1 | C4 | H3 | H4 | 120.4° | 119.9° |
| C4 | N1 | C7 | H9 | 72.3° | 42.6° |
| C4 | N1 | C7 | H10 | 47.9° | 77.8° |
| N1 | C4 | C1 | H12 | 54.1° | 61.2° |
| C19 | N2 | H24 | H25 | 120.0° | 124.0° |
| N2 | C19 | C20 | H28 | 39.9° | 60.0° |
| C4 | C1 | C6 | H12 | 120.0° | 120.3° |
| C4 | C1 | C6 | C11 | 43.7° | 65.4° |
| C4 | C1 | C3 | H2 | 61.6° | 61.4° |
| C1 | C4 | H3 | H4 | 120.4° | 119.7° |
| C4 | C1 | C6 | H7 | 77.6° | 54.5° |
| C4 | C1 | C6 | H8 | 165.0° | 174.6° |
| C1 | C6 | C11 | H7 | 121.3° | 120.0° |
| C1 | C6 | C11 | H8 | 121.3° | 120.0° |
| C1 | C6 | C11 | C15 | 57.9° | 175.0° |
| C1 | C6 | C11 | C14 | 179.3° | 65.0° |
| C6 | C1 | C3 | H2 | 63.5° | 58.5° |
| C6 | C1 | C4 | H3 | 54.2° | 61.3° |
| C6 | C1 | C4 | H4 | 66.1° | 58.5° |
| C1 | C6 | H7 | H8 | 115.9° | 120.0° |
| C1 | C6 | C11 | H15 | 61.8° | 54.9° |
| C6 | C11 | C15 | C14 | 122.5° | 120.0° |
| C6 | C11 | C15 | H15 | 119.6° | 120.1° |
| C6 | C11 | C14 | H15 | 117.4° | 120.0° |
| C11 | C6 | H7 | H8 | 115.8° | 120.0° |
| C11 | C6 | C1 | H12 | 76.3° | 54.8° |
| C6 | C11 | C15 | H17 | 180.0° | 60.0° |
| C6 | C11 | C15 | H18 | 60.0° | 180.0° |
| C6 | C11 | C15 | H19 | 60.0° | 60.0° |
| C6 | C11 | C14 | H20 | 180.0° | 180.0° |
| C6 | C11 | C14 | H21 | 60.0° | 60.0° |
| C6 | C11 | C14 | H22 | 60.0° | 60.0° |
| C15 | C11 | C14 | H15 | 117.9° | 120.0° |
| C15 | C11 | C6 | H7 | 179.2° | 55.0° |
| C15 | C11 | C6 | H8 | 63.4° | 65.0° |
| C11 | C15 | H17 | H18 | 120.0° | 120.0° |
| C11 | C15 | H17 | H19 | 120.0° | 120.0° |
| C11 | C15 | H18 | H19 | 120.0° | 120.0° |
| C15 | C11 | C14 | H20 | 55.4° | 60.0° |
| C15 | C11 | C14 | H21 | 175.4° | 60.0° |
| C15 | C11 | C14 | H22 | 64.6° | 180.0° |
| C14 | C11 | C6 | H7 | 58.0° | 175.0° |
| C14 | C11 | C6 | H8 | 59.4° | 55.0° |
| C14 | C11 | C15 | H17 | 57.5° | 60.0° |
| C14 | C11 | C15 | H18 | 62.5° | 60.0° |
| C14 | C11 | C15 | H19 | 177.5° | 180.0° |
| C11 | C14 | H20 | H21 | 120.0° | 120.0° |
| C11 | C14 | H20 | H22 | 120.0° | 120.0° |
| C11 | C14 | H21 | H22 | 120.0° | 120.0° |
| H1 | C2 | C5 | H5 | 46.0° | 57.8° |
| H1 | C2 | C5 | H6 | 164.1° | 177.8° |
| H2 | C3 | C5 | H5 | 50.3° | 58.4° |
| H2 | C3 | C5 | H6 | 168.4° | 178.4° |
| H2 | C3 | C1 | H12 | 178.2° | 178.7° |
| H3 | C4 | C1 | H12 | 65.7° | 59.0° |
| H4 | C4 | C1 | H12 | 174.0° | 178.7° |
| H7 | C6 | C1 | H12 | 162.4° | 174.8° |
| H7 | C6 | C11 | H15 | 59.5° | 65.1° |
| H8 | C6 | C1 | H12 | 45.0° | 65.2° |
| H8 | C6 | C11 | H15 | 176.9° | 175.0° |
| H9 | C7 | C9 | H13 | 44.6° | 49.2° |
| H9 | C7 | C9 | H14 | 163.1° | 70.6° |
| H10 | C7 | C9 | H13 | 75.5° | 169.5° |
| H10 | C7 | C9 | H14 | 43.0° | 49.8° |
| H15 | C11 | C15 | H17 | 60.4° | 179.9° |
| H15 | C11 | C15 | H18 | 179.6° | 60.0° |
| H15 | C11 | C15 | H19 | 59.7° | 60.0° |
| H15 | C11 | C14 | H20 | 62.6° | 60.0° |
| H15 | C11 | C14 | H21 | 57.4° | 180.0° |
| H15 | C11 | C14 | H22 | 177.4° | 60.0° |
| H17 | C15 | H18 | H19 | 120.0° | 120.0° |
| H20 | C14 | H21 | H22 | 120.0° | 120.0° |
| H24 | N2 | C19 | H27 | 68.3° | 179.9° |
| H25 | N2 | C19 | H27 | 51.7° | 56.0° |
| H27 | C19 | C20 | H28 | 75.8° | 180.0° |
| H28 | C20 | C21 | H29 | 64.8° | 60.1° |
| H28 | C20 | C21 | H30 | 55.2° | 60.0° |
| H28 | C20 | C21 | H31 | 175.2° | 180.0° |
| H28 | C20 | C22 | H32 | 64.8° | 60.0° |
| H28 | C20 | C22 | H33 | 175.2° | 60.0° |
| H28 | C20 | C22 | H34 | 55.2° | 180.0° |
| H29 | C21 | H30 | H31 | 120.0° | 120.0° |
| H32 | C22 | H33 | H34 | 120.0° | 120.0° |
| H35 | C23 | H36 | H37 | 120.0° | 120.0° |
| H38 | C24 | H39 | H40 | 120.0° | 120.1° |
