K8N
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| BR1 | C17 | sing | 1.89Å | 1.88Å | |
| N5 | C18 | sing | 1.39Å | 1.35Å | |
| C17 | C18 | doub | 1.40Å | 1.42Å | Aromatic |
| C17 | C16 | sing | 1.36Å | 1.36Å | Aromatic |
| C18 | N6 | sing | 1.32Å | 1.32Å | Aromatic |
| C16 | C15 | doub | 1.41Å | 1.40Å | Aromatic |
| N6 | C19 | doub | 1.34Å | 1.38Å | Aromatic |
| C15 | C19 | sing | 1.42Å | 1.41Å | Aromatic |
| C15 | C14 | sing | 1.40Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.41Å | 1.40Å | Aromatic |
| C14 | C13 | doub | 1.36Å | 1.36Å | Aromatic |
| C20 | C12 | doub | 1.36Å | 1.37Å | Aromatic |
| C13 | C12 | sing | 1.39Å | 1.41Å | Aromatic |
| C12 | C11 | sing | 1.51Å | 1.51Å | |
| C11 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | C9 | sing | 1.53Å | 1.53Å | |
| C8 | C9 | sing | 1.54Å | 1.53Å | |
| C8 | C7 | sing | 1.55Å | 1.53Å | |
| C6 | C5 | doub | 1.34Å | 1.35Å | Aromatic |
| C6 | N4 | sing | 1.37Å | 1.37Å | Aromatic |
| C9 | C21 | sing | 1.54Å | 1.53Å | |
| C5 | C4 | sing | 1.46Å | 1.42Å | Aromatic |
| N4 | C7 | sing | 1.46Å | 1.46Å | |
| N4 | C3 | sing | 1.37Å | 1.37Å | Aromatic |
| C4 | C3 | doub | 1.41Å | 1.39Å | Aromatic |
| C4 | C1 | sing | 1.40Å | 1.41Å | Aromatic |
| N1 | C1 | sing | 1.38Å | 1.34Å | |
| C7 | C22 | sing | 1.55Å | 1.53Å | |
| C3 | N3 | sing | 1.33Å | 1.35Å | Aromatic |
| C1 | N2 | doub | 1.33Å | 1.34Å | Aromatic |
| C21 | C22 | sing | 1.54Å | 1.54Å | |
| C21 | O1 | sing | 1.43Å | 1.42Å | |
| C22 | O2 | sing | 1.43Å | 1.42Å | |
| N3 | C2 | doub | 1.32Å | 1.33Å | Aromatic |
| N2 | C2 | sing | 1.32Å | 1.34Å | Aromatic |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| C2 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| N5 | H17 | sing | 0.97Å | 1.00Å | |
| N5 | H18 | sing | 0.97Å | 1.00Å | |
| C20 | H19 | sing | 1.08Å | 1.08Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| O1 | H21 | sing | 0.97Å | 0.95Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| O2 | H23 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| BR1 | C17 | C18 | 120.5° | 120.1° |
| BR1 | C17 | C16 | 118.6° | 120.0° |
| N5 | C18 | C17 | 120.3° | 119.2° |
| N5 | C18 | N6 | 117.8° | 119.3° |
| C18 | N5 | H17 | 109.5° | 120.0° |
| C18 | N5 | H18 | 109.4° | 120.0° |
| C18 | C17 | C16 | 120.8° | 119.9° |
| C17 | C18 | N6 | 121.9° | 121.5° |
| C17 | C16 | C15 | 118.6° | 118.3° |
| C17 | C16 | H16 | 120.7° | 120.9° |
| C18 | N6 | C19 | 117.7° | 121.3° |
| C16 | C15 | C19 | 118.0° | 119.1° |
| C16 | C15 | C14 | 122.1° | 121.3° |
| C15 | C16 | H16 | 120.7° | 120.8° |
| N6 | C19 | C15 | 122.9° | 119.9° |
| N6 | C19 | C20 | 118.1° | 121.0° |
| C19 | C15 | C14 | 119.9° | 119.6° |
| C15 | C19 | C20 | 119.0° | 119.1° |
| C15 | C14 | C13 | 119.7° | 119.7° |
| C15 | C14 | H15 | 120.1° | 120.1° |
| C19 | C20 | C12 | 120.6° | 119.8° |
| C19 | C20 | H19 | 119.7° | 120.1° |
| C14 | C13 | C12 | 121.1° | 120.9° |
| C14 | C13 | H14 | 119.4° | 119.6° |
| C13 | C14 | H15 | 120.1° | 120.2° |
| C20 | C12 | C13 | 119.6° | 121.0° |
| C20 | C12 | C11 | 119.9° | 119.5° |
| C12 | C20 | H19 | 119.7° | 120.1° |
| C13 | C12 | C11 | 120.4° | 119.5° |
| C12 | C13 | H14 | 119.4° | 119.6° |
| C12 | C11 | C10 | 109.8° | 109.4° |
| C12 | C11 | H12 | 109.4° | 109.5° |
| C12 | C11 | H13 | 109.4° | 109.5° |
| C11 | C10 | C9 | 115.3° | 109.4° |
| C11 | C10 | H10 | 108.0° | 109.5° |
| C11 | C10 | H11 | 108.0° | 109.5° |
| C10 | C11 | H12 | 109.4° | 109.5° |
| C10 | C11 | H13 | 109.4° | 109.5° |
| C10 | C9 | C8 | 113.0° | 110.0° |
| C10 | C9 | C21 | 113.9° | 110.0° |
| C10 | C9 | H9 | 108.1° | 110.1° |
| C9 | C10 | H10 | 108.0° | 109.5° |
| C9 | C10 | H11 | 108.0° | 109.4° |
| C9 | C8 | C7 | 106.4° | 104.2° |
| C8 | C9 | C21 | 105.5° | 106.6° |
| C9 | C8 | H7 | 110.3° | 110.5° |
| C9 | C8 | H8 | 110.2° | 110.5° |
| C8 | C9 | H9 | 108.0° | 110.0° |
| C8 | C7 | N4 | 113.8° | 110.8° |
| C8 | C7 | C22 | 102.2° | 102.7° |
| C8 | C7 | H6 | 109.1° | 110.9° |
| C7 | C8 | H7 | 110.2° | 110.5° |
| C7 | C8 | H8 | 110.3° | 110.5° |
| C5 | C6 | N4 | 109.4° | 109.8° |
| C6 | C5 | C4 | 107.6° | 106.8° |
| C6 | C5 | H4 | 126.2° | 126.6° |
| C5 | C6 | H5 | 125.3° | 125.1° |
| C6 | N4 | C7 | 125.6° | 125.0° |
| C6 | N4 | C3 | 108.6° | 110.0° |
| N4 | C6 | H5 | 125.3° | 125.1° |
| C9 | C21 | C22 | 106.1° | 106.6° |
| C9 | C21 | O1 | 108.3° | 110.0° |
| C21 | C9 | H9 | 108.1° | 110.1° |
| C9 | C21 | H20 | 108.2° | 110.0° |
| C5 | C4 | C3 | 106.4° | 106.2° |
| C5 | C4 | C1 | 136.9° | 135.1° |
| C4 | C5 | H4 | 126.2° | 126.6° |
| C7 | N4 | C3 | 125.7° | 125.0° |
| N4 | C7 | C22 | 112.4° | 110.7° |
| N4 | C7 | H6 | 110.0° | 110.7° |
| N4 | C3 | C4 | 108.0° | 107.1° |
| N4 | C3 | N3 | 126.4° | 134.3° |
| C3 | C4 | C1 | 116.7° | 118.7° |
| C4 | C3 | N3 | 125.6° | 118.6° |
| C4 | C1 | N1 | 123.4° | 120.8° |
| C4 | C1 | N2 | 119.3° | 118.3° |
| N1 | C1 | N2 | 117.4° | 120.8° |
| C1 | N1 | H1 | 109.5° | 120.0° |
| C1 | N1 | H2 | 109.5° | 120.0° |
| C7 | C22 | C21 | 103.8° | 104.2° |
| C7 | C22 | O2 | 111.8° | 110.5° |
| C22 | C7 | H6 | 109.1° | 110.7° |
| C7 | C22 | H22 | 108.6° | 110.5° |
| C3 | N3 | C2 | 111.7° | 120.7° |
| C1 | N2 | C2 | 117.4° | 121.0° |
| C22 | C21 | O1 | 116.1° | 110.0° |
| C21 | C22 | O2 | 113.9° | 110.5° |
| C22 | C21 | H20 | 108.2° | 110.1° |
| C21 | C22 | H22 | 108.5° | 110.5° |
| O1 | C21 | H20 | 109.7° | 110.0° |
| C21 | O1 | H21 | 109.5° | 114.0° |
| O2 | C22 | H22 | 110.1° | 110.5° |
| C22 | O2 | H23 | 109.5° | 114.0° |
| N3 | C2 | N2 | 129.4° | 122.7° |
| N3 | C2 | H3 | 115.3° | 118.6° |
| N2 | C2 | H3 | 115.3° | 118.7° |
| H1 | N1 | H2 | 109.5° | 120.0° |
| H7 | C8 | H8 | 109.5° | 110.5° |
| H10 | C10 | H11 | 109.5° | 109.5° |
| H12 | C11 | H13 | 109.5° | 109.5° |
| H17 | N5 | H18 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| BR1 | C17 | C18 | N5 | 3.8° | 0.0° |
| BR1 | C17 | C18 | C16 | 176.5° | 180.0° |
| BR1 | C17 | C18 | N6 | 178.8° | 180.0° |
| BR1 | C17 | C16 | C15 | 177.4° | 180.0° |
| BR1 | C17 | C16 | H16 | 2.6° | 0.0° |
| N5 | C18 | C17 | N6 | 177.4° | 180.0° |
| N5 | C18 | C17 | C16 | 179.7° | 180.0° |
| N5 | C18 | N6 | C19 | 179.6° | 180.0° |
| C18 | N5 | H17 | H18 | 120.0° | 180.0° |
| C18 | C17 | C16 | C15 | 0.9° | 0.0° |
| C17 | C18 | N6 | C19 | 2.1° | 0.0° |
| C18 | C17 | C16 | H16 | 179.1° | 180.0° |
| C17 | C18 | N5 | H17 | 177.5° | 0.0° |
| C17 | C18 | N5 | H18 | 57.5° | 180.0° |
| C16 | C17 | C18 | N6 | 2.3° | 0.0° |
| C17 | C16 | C15 | H16 | 180.0° | 180.0° |
| C17 | C16 | C15 | C19 | 0.4° | 0.0° |
| C17 | C16 | C15 | C14 | 180.0° | 179.8° |
| C18 | N6 | C19 | C15 | 0.7° | 0.0° |
| C18 | N6 | C19 | C20 | 179.3° | 180.0° |
| N6 | C18 | N5 | H17 | 0.0° | 180.0° |
| N6 | C18 | N5 | H18 | 120.0° | 0.0° |
| C16 | C15 | C19 | N6 | 0.6° | 0.0° |
| C16 | C15 | C19 | C14 | 179.6° | 179.8° |
| C16 | C15 | C19 | C20 | 179.4° | 180.0° |
| C16 | C15 | C14 | C13 | 179.7° | 179.7° |
| C16 | C15 | C14 | H15 | 0.3° | 0.2° |
| N6 | C19 | C15 | C20 | 180.0° | 180.0° |
| N6 | C19 | C15 | C14 | 179.9° | 179.8° |
| N6 | C19 | C20 | C12 | 179.8° | 179.5° |
| N6 | C19 | C20 | H19 | 0.2° | 0.0° |
| C19 | C15 | C14 | C13 | 0.1° | 0.0° |
| C15 | C19 | C20 | C12 | 0.2° | 0.5° |
| C19 | C15 | C14 | H15 | 179.9° | 179.9° |
| C19 | C15 | C16 | H16 | 179.6° | 180.0° |
| C15 | C19 | C20 | H19 | 179.8° | 180.0° |
| C14 | C15 | C19 | C20 | 0.2° | 0.2° |
| C15 | C14 | C13 | H15 | 180.0° | 179.9° |
| C15 | C14 | C13 | C12 | 0.8° | 0.0° |
| C15 | C14 | C13 | H14 | 179.2° | 180.0° |
| C14 | C15 | C16 | H16 | 0.0° | 0.2° |
| C19 | C20 | C12 | H19 | 180.0° | 179.5° |
| C19 | C20 | C12 | C13 | 0.9° | 0.5° |
| C19 | C20 | C12 | C11 | 177.4° | 179.8° |
| C14 | C13 | C12 | C20 | 1.2° | 0.3° |
| C14 | C13 | C12 | H14 | 180.0° | 180.0° |
| C14 | C13 | C12 | C11 | 177.7° | 180.0° |
| C20 | C12 | C13 | C11 | 176.5° | 179.7° |
| C20 | C12 | C11 | C10 | 78.0° | 90.3° |
| C20 | C12 | C11 | H12 | 162.0° | 149.7° |
| C20 | C12 | C11 | H13 | 42.1° | 29.7° |
| C20 | C12 | C13 | H14 | 178.8° | 179.7° |
| C13 | C12 | C11 | C10 | 98.5° | 90.0° |
| C13 | C12 | C11 | H12 | 21.5° | 30.0° |
| C13 | C12 | C11 | H13 | 141.4° | 150.0° |
| C12 | C13 | C14 | H15 | 179.2° | 179.9° |
| C13 | C12 | C20 | H19 | 179.1° | 180.0° |
| C12 | C11 | C10 | H12 | 120.0° | 120.0° |
| C12 | C11 | C10 | H13 | 120.0° | 120.0° |
| C12 | C11 | C10 | C9 | 164.5° | 180.0° |
| C12 | C11 | C10 | H10 | 74.7° | 60.0° |
| C12 | C11 | C10 | H11 | 43.7° | 60.0° |
| C12 | C11 | H12 | H13 | 119.8° | 120.0° |
| C11 | C12 | C13 | H14 | 2.3° | 0.1° |
| C11 | C12 | C20 | H19 | 2.6° | 0.3° |
| C11 | C10 | C9 | H10 | 120.8° | 120.0° |
| C11 | C10 | C9 | H11 | 120.8° | 120.0° |
| C11 | C10 | C9 | C8 | 59.3° | 175.0° |
| C11 | C10 | C9 | C21 | 179.6° | 67.9° |
| C11 | C10 | C9 | H9 | 60.2° | 53.6° |
| C11 | C10 | H10 | H11 | 117.4° | 120.0° |
| C10 | C11 | H12 | H13 | 119.8° | 120.0° |
| C10 | C9 | C8 | C21 | 125.1° | 119.2° |
| C10 | C9 | C8 | H9 | 119.5° | 121.5° |
| C10 | C9 | C8 | C7 | 142.2° | 142.8° |
| C10 | C9 | C21 | H9 | 120.2° | 121.5° |
| C10 | C9 | C21 | C22 | 116.5° | 119.3° |
| C10 | C9 | C21 | O1 | 118.2° | 121.5° |
| C10 | C9 | C8 | H7 | 98.3° | 24.2° |
| C10 | C9 | C8 | H8 | 22.6° | 98.5° |
| C9 | C10 | H10 | H11 | 117.3° | 120.0° |
| C9 | C10 | C11 | H12 | 44.4° | 60.0° |
| C9 | C10 | C11 | H13 | 75.5° | 60.0° |
| C10 | C9 | C21 | H20 | 0.6° | 0.1° |
| C9 | C8 | C7 | H7 | 119.5° | 118.7° |
| C9 | C8 | C7 | H8 | 119.5° | 118.7° |
| C8 | C9 | C21 | H9 | 115.4° | 119.3° |
| C9 | C8 | C7 | N4 | 156.8° | 156.2° |
| C9 | C8 | C7 | C22 | 35.4° | 37.9° |
| C8 | C9 | C21 | C22 | 7.9° | 0.0° |
| C8 | C9 | C21 | O1 | 117.3° | 119.3° |
| C9 | C8 | C7 | H6 | 80.0° | 80.4° |
| C9 | C8 | H7 | H8 | 121.4° | 122.6° |
| C8 | C9 | C10 | H10 | 61.5° | 65.0° |
| C8 | C9 | C10 | H11 | 179.9° | 55.1° |
| C8 | C9 | C21 | H20 | 123.8° | 119.3° |
| C8 | C7 | N4 | C6 | 57.0° | 54.7° |
| C7 | C8 | C9 | C21 | 17.1° | 23.6° |
| C8 | C7 | N4 | C22 | 115.6° | 113.3° |
| C8 | C7 | N4 | H6 | 122.7° | 123.4° |
| C8 | C7 | N4 | C3 | 126.8° | 124.8° |
| C8 | C7 | C22 | H6 | 115.4° | 118.4° |
| C8 | C7 | C22 | C21 | 39.8° | 37.9° |
| C8 | C7 | C22 | O2 | 162.9° | 156.6° |
| C7 | C8 | H7 | H8 | 121.4° | 122.6° |
| C7 | C8 | C9 | H9 | 98.3° | 95.7° |
| C8 | C7 | C22 | H22 | 75.5° | 80.8° |
| C5 | C6 | N4 | H5 | 180.0° | 179.8° |
| C6 | C5 | C4 | H4 | 180.0° | 180.0° |
| C5 | C6 | N4 | C7 | 177.2° | 180.0° |
| C5 | C6 | N4 | C3 | 0.5° | 0.4° |
| C6 | C5 | C4 | C3 | 0.1° | 0.0° |
| C6 | C5 | C4 | C1 | 178.9° | 179.3° |
| N4 | C6 | C5 | C4 | 0.4° | 0.2° |
| C6 | N4 | C7 | C3 | 176.1° | 179.6° |
| C6 | N4 | C3 | C4 | 0.5° | 0.3° |
| C6 | N4 | C7 | C22 | 58.5° | 58.6° |
| C6 | N4 | C3 | N3 | 179.5° | 180.0° |
| N4 | C6 | C5 | H4 | 179.6° | 179.8° |
| C6 | N4 | C7 | H6 | 179.8° | 178.2° |
| C9 | C21 | C22 | C7 | 29.9° | 23.6° |
| C9 | C21 | C22 | O1 | 120.3° | 119.2° |
| C9 | C21 | C22 | H20 | 116.0° | 119.3° |
| C9 | C21 | O1 | H20 | 117.9° | 121.4° |
| C9 | C21 | C22 | O2 | 151.6° | 142.3° |
| C21 | C9 | C8 | H7 | 136.6° | 95.0° |
| C21 | C9 | C8 | H8 | 102.4° | 142.3° |
| C21 | C9 | C10 | H10 | 58.8° | 52.1° |
| C21 | C9 | C10 | H11 | 59.5° | 172.1° |
| C9 | C21 | O1 | H21 | 180.0° | 180.0° |
| C9 | C21 | C22 | H22 | 85.5° | 95.1° |
| C5 | C4 | C3 | N4 | 0.2° | 0.2° |
| C5 | C4 | C3 | C1 | 179.1° | 179.5° |
| C5 | C4 | C1 | N1 | 0.9° | 0.5° |
| C5 | C4 | C3 | N3 | 179.8° | 180.0° |
| C5 | C4 | C1 | N2 | 179.5° | 179.9° |
| C4 | C5 | C6 | H5 | 179.6° | 180.0° |
| C7 | N4 | C3 | C4 | 177.1° | 180.0° |
| N4 | C7 | C22 | H6 | 122.2° | 123.2° |
| C7 | N4 | C3 | N3 | 2.9° | 0.4° |
| N4 | C7 | C22 | C21 | 162.2° | 156.2° |
| N4 | C7 | C22 | O2 | 74.7° | 85.1° |
| C7 | N4 | C6 | H5 | 2.8° | 0.2° |
| N4 | C7 | C8 | H7 | 83.7° | 37.5° |
| N4 | C7 | C8 | H8 | 37.3° | 85.1° |
| N4 | C7 | C22 | H22 | 46.9° | 37.6° |
| N4 | C3 | C4 | N3 | 180.0° | 179.8° |
| N4 | C3 | C4 | C1 | 178.9° | 179.7° |
| C3 | N4 | C7 | C22 | 117.6° | 121.9° |
| N4 | C3 | N3 | C2 | 179.0° | 179.9° |
| C3 | N4 | C6 | H5 | 179.5° | 179.8° |
| C3 | N4 | C7 | H6 | 4.1° | 1.4° |
| C3 | C4 | C1 | N1 | 179.7° | 179.8° |
| C3 | C4 | C1 | N2 | 0.8° | 0.6° |
| C4 | C3 | N3 | C2 | 1.0° | 0.3° |
| C3 | C4 | C5 | H4 | 179.9° | 180.0° |
| C4 | C1 | N1 | N2 | 179.5° | 179.7° |
| C1 | C4 | C3 | N3 | 1.1° | 0.6° |
| C4 | C1 | N2 | C2 | 0.5° | 0.3° |
| C4 | C1 | N1 | H1 | 179.5° | 179.8° |
| C4 | C1 | N1 | H2 | 60.5° | 0.6° |
| C1 | C4 | C5 | H4 | 1.1° | 0.6° |
| N1 | C1 | N2 | C2 | 179.9° | 179.9° |
| C1 | N1 | H1 | H2 | 120.0° | 179.6° |
| C7 | C22 | C21 | O2 | 121.7° | 118.7° |
| C7 | C22 | C21 | H22 | 115.3° | 118.7° |
| C7 | C22 | C21 | O1 | 90.5° | 95.7° |
| C7 | C22 | O2 | H22 | 120.7° | 122.6° |
| C22 | C7 | C8 | H7 | 154.9° | 80.8° |
| C22 | C7 | C8 | H8 | 84.1° | 156.6° |
| C7 | C22 | C21 | H20 | 145.8° | 142.9° |
| C7 | C22 | O2 | H23 | 180.0° | 179.9° |
| C3 | N3 | C2 | N2 | 0.8° | 0.0° |
| C3 | N3 | C2 | H3 | 179.2° | 179.9° |
| C1 | N2 | C2 | N3 | 0.5° | 0.0° |
| N2 | C1 | N1 | H1 | 0.0° | 0.1° |
| N2 | C1 | N1 | H2 | 120.0° | 179.7° |
| C1 | N2 | C2 | H3 | 179.5° | 179.9° |
| C22 | C21 | O1 | H20 | 122.9° | 121.5° |
| C21 | C22 | O2 | H22 | 122.0° | 122.6° |
| C21 | C22 | C7 | H6 | 75.6° | 80.5° |
| C22 | C21 | C9 | H9 | 123.3° | 119.2° |
| C22 | C21 | O1 | H21 | 60.8° | 62.8° |
| C21 | C22 | O2 | H23 | 62.8° | 65.1° |
| O1 | C21 | C22 | O2 | 31.3° | 23.0° |
| O1 | C21 | C9 | H9 | 2.0° | 0.0° |
| O1 | C21 | C22 | H22 | 154.2° | 145.7° |
| O2 | C22 | C7 | H6 | 47.5° | 38.2° |
| O2 | C22 | C21 | H20 | 92.4° | 98.4° |
| N3 | C2 | N2 | H3 | 180.0° | 179.9° |
| H4 | C5 | C6 | H5 | 0.4° | 0.0° |
| H6 | C7 | C8 | H7 | 39.5° | 160.9° |
| H6 | C7 | C8 | H8 | 160.5° | 38.3° |
| H6 | C7 | C22 | H22 | 169.1° | 160.8° |
| H7 | C8 | C9 | H9 | 21.2° | 145.7° |
| H8 | C8 | C9 | H9 | 142.2° | 23.0° |
| H9 | C9 | C10 | H10 | 179.0° | 173.6° |
| H9 | C9 | C10 | H11 | 60.7° | 66.4° |
| H9 | C9 | C21 | H20 | 120.8° | 121.4° |
| H10 | C10 | C11 | H12 | 165.3° | 180.0° |
| H10 | C10 | C11 | H13 | 45.4° | 60.0° |
| H11 | C10 | C11 | H12 | 76.4° | 59.9° |
| H11 | C10 | C11 | H13 | 163.7° | 180.0° |
| H14 | C13 | C14 | H15 | 0.8° | 0.1° |
| H20 | C21 | O1 | H21 | 62.1° | 58.6° |
| H20 | C21 | C22 | H22 | 30.5° | 24.2° |
| H22 | C22 | O2 | H23 | 59.3° | 57.5° |
