KYM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | N1 | sing | 1.47Å | 1.47Å | |
| C14 | C15 | sing | 1.54Å | 1.53Å | |
| C11 | C10 | doub | 1.37Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
| O2 | C13 | doub | 1.22Å | 1.22Å | |
| N1 | C13 | sing | 1.35Å | 1.35Å | |
| N1 | C17 | sing | 1.48Å | 1.46Å | |
| C10 | C9 | sing | 1.40Å | 1.40Å | Aromatic |
| C15 | N2 | sing | 1.46Å | 1.48Å | |
| C13 | C12 | sing | 1.48Å | 1.50Å | |
| C17 | C16 | sing | 1.51Å | 1.50Å | |
| C12 | C22 | doub | 1.40Å | 1.39Å | Aromatic |
| C9 | C8 | sing | 1.47Å | 1.46Å | |
| C9 | C23 | doub | 1.40Å | 1.40Å | Aromatic |
| N2 | C16 | sing | 1.36Å | 1.37Å | Aromatic |
| N2 | C18 | sing | 1.35Å | 1.38Å | Aromatic |
| O1 | C6 | doub | 1.22Å | 1.23Å | |
| C8 | C7 | doub | 1.36Å | 1.34Å | |
| C16 | N3 | doub | 1.30Å | 1.31Å | Aromatic |
| C22 | C23 | sing | 1.37Å | 1.38Å | Aromatic |
| C21 | C19 | sing | 1.53Å | 1.51Å | |
| C21 | C20 | sing | 1.53Å | 1.48Å | |
| C6 | C7 | sing | 1.47Å | 1.46Å | |
| C6 | C5 | sing | 1.48Å | 1.48Å | |
| C7 | O3 | sing | 1.35Å | 1.38Å | |
| C18 | C19 | sing | 1.51Å | 1.50Å | |
| C18 | N4 | doub | 1.31Å | 1.32Å | Aromatic |
| N3 | N4 | sing | 1.29Å | 1.39Å | Aromatic |
| C19 | C20 | sing | 1.53Å | 1.51Å | |
| C5 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C24 | sing | 1.40Å | 1.39Å | Aromatic |
| O3 | C24 | sing | 1.35Å | 1.38Å | |
| C4 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C24 | C1 | doub | 1.41Å | 1.40Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.40Å | Aromatic |
| C1 | C | sing | 1.48Å | 1.49Å | |
| N | C | sing | 1.35Å | 1.34Å | |
| C | O | doub | 1.22Å | 1.24Å | |
| C17 | H1 | sing | 1.09Å | 1.10Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C19 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C21 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.08Å | 1.08Å | |
| C10 | H13 | sing | 1.08Å | 1.08Å | |
| C22 | H14 | sing | 1.08Å | 1.08Å | |
| C23 | H15 | sing | 1.08Å | 1.08Å | |
| C8 | H16 | sing | 1.08Å | 1.08Å | |
| N | H17 | sing | 0.97Å | 1.00Å | |
| N | H18 | sing | 0.97Å | 1.00Å | |
| C4 | H19 | sing | 1.08Å | 1.08Å | |
| C3 | H20 | sing | 1.08Å | 1.08Å | |
| C2 | H21 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C14 | C15 | 111.1° | 109.0° |
| C14 | N1 | C13 | 123.4° | 120.9° |
| C14 | N1 | C17 | 113.2° | 118.1° |
| N1 | C14 | H10 | 109.1° | 109.5° |
| N1 | C14 | H11 | 109.0° | 109.5° |
| C14 | C15 | N2 | 110.1° | 109.2° |
| C14 | C15 | H8 | 109.3° | 109.6° |
| C14 | C15 | H9 | 109.3° | 109.5° |
| C15 | C14 | H10 | 109.1° | 109.7° |
| C15 | C14 | H11 | 109.1° | 109.7° |
| C10 | C11 | C12 | 120.7° | 120.1° |
| C11 | C10 | C9 | 121.3° | 119.9° |
| C10 | C11 | H12 | 119.6° | 120.0° |
| C11 | C10 | H13 | 119.4° | 120.0° |
| C11 | C12 | C13 | 118.8° | 120.0° |
| C11 | C12 | C22 | 118.5° | 120.0° |
| C12 | C11 | H12 | 119.6° | 119.9° |
| O2 | C13 | N1 | 121.9° | 120.0° |
| O2 | C13 | C12 | 118.9° | 120.0° |
| C13 | N1 | C17 | 123.2° | 120.9° |
| N1 | C13 | C12 | 118.9° | 120.0° |
| N1 | C17 | C16 | 97.9° | 106.9° |
| N1 | C17 | H1 | 112.3° | 109.9° |
| N1 | C17 | H2 | 112.3° | 110.0° |
| C10 | C9 | C8 | 115.2° | 120.0° |
| C10 | C9 | C23 | 117.6° | 119.9° |
| C9 | C10 | H13 | 119.3° | 120.0° |
| C15 | N2 | C16 | 124.6° | 125.2° |
| C15 | N2 | C18 | 131.2° | 128.6° |
| N2 | C15 | H8 | 109.3° | 109.6° |
| N2 | C15 | H9 | 109.3° | 109.5° |
| C13 | C12 | C22 | 122.7° | 120.0° |
| C17 | C16 | N2 | 120.5° | 123.8° |
| C17 | C16 | N3 | 128.4° | 128.6° |
| C16 | C17 | H1 | 112.3° | 110.0° |
| C16 | C17 | H2 | 112.3° | 110.0° |
| C12 | C22 | C23 | 120.7° | 120.1° |
| C12 | C22 | H14 | 119.6° | 120.0° |
| C8 | C9 | C23 | 127.2° | 120.0° |
| C9 | C8 | C7 | 131.8° | 120.0° |
| C9 | C8 | H16 | 114.1° | 120.1° |
| C9 | C23 | C22 | 121.1° | 120.0° |
| C9 | C23 | H15 | 119.4° | 120.0° |
| C16 | N2 | C18 | 104.2° | 106.1° |
| N2 | C16 | N3 | 111.0° | 107.6° |
| N2 | C18 | C19 | 123.6° | 126.5° |
| N2 | C18 | N4 | 110.5° | 107.1° |
| O1 | C6 | C7 | 126.6° | 127.8° |
| O1 | C6 | C5 | 129.3° | 127.8° |
| C8 | C7 | C6 | 126.1° | 126.3° |
| C8 | C7 | O3 | 124.6° | 126.2° |
| C7 | C8 | H16 | 114.1° | 119.9° |
| C16 | N3 | N4 | 107.0° | 109.4° |
| C23 | C22 | H14 | 119.7° | 120.0° |
| C22 | C23 | H15 | 119.4° | 120.0° |
| C19 | C21 | C20 | 60.6° | 60.0° |
| C21 | C19 | C18 | 119.5° | 117.6° |
| C21 | C19 | C20 | 58.8° | 60.0° |
| C21 | C19 | H3 | 115.1° | 117.5° |
| C19 | C21 | H4 | 119.9° | 117.5° |
| C19 | C21 | H5 | 119.9° | 117.4° |
| C21 | C20 | C19 | 60.6° | 60.0° |
| C20 | C21 | H4 | 119.9° | 117.5° |
| C20 | C21 | H5 | 119.9° | 117.5° |
| C21 | C20 | H6 | 119.9° | 117.5° |
| C21 | C20 | H7 | 119.9° | 117.5° |
| C7 | C6 | C5 | 104.1° | 104.4° |
| C6 | C7 | O3 | 109.2° | 107.5° |
| C6 | C5 | C4 | 132.5° | 133.2° |
| C6 | C5 | C24 | 107.2° | 106.3° |
| C7 | O3 | C24 | 108.8° | 111.9° |
| C19 | C18 | N4 | 125.9° | 126.4° |
| C18 | C19 | C20 | 121.2° | 117.5° |
| C18 | C19 | H3 | 115.3° | 115.5° |
| C18 | N4 | N3 | 107.3° | 109.7° |
| C20 | C19 | H3 | 115.1° | 117.5° |
| C19 | C20 | H6 | 119.9° | 117.5° |
| C19 | C20 | H7 | 119.9° | 117.5° |
| C4 | C5 | C24 | 120.1° | 120.6° |
| C5 | C4 | C3 | 119.5° | 120.0° |
| C5 | C4 | H19 | 120.2° | 120.0° |
| C5 | C24 | O3 | 110.7° | 109.9° |
| C5 | C24 | C1 | 120.5° | 118.8° |
| O3 | C24 | C1 | 128.6° | 131.3° |
| C4 | C3 | C2 | 120.5° | 120.3° |
| C3 | C4 | H19 | 120.2° | 120.0° |
| C4 | C3 | H20 | 119.7° | 119.9° |
| C24 | C1 | C2 | 118.6° | 119.9° |
| C24 | C1 | C | 124.6° | 120.1° |
| C3 | C2 | C1 | 120.7° | 120.5° |
| C2 | C3 | H20 | 119.7° | 119.8° |
| C3 | C2 | H21 | 119.7° | 119.7° |
| C2 | C1 | C | 116.7° | 120.1° |
| C1 | C2 | H21 | 119.6° | 119.8° |
| C1 | C | N | 117.8° | 120.0° |
| C1 | C | O | 119.5° | 120.0° |
| N | C | O | 122.7° | 120.0° |
| C | N | H17 | 120.0° | 120.0° |
| C | N | H18 | 120.0° | 120.0° |
| H1 | C17 | H2 | 109.5° | 110.0° |
| H4 | C21 | H5 | 109.4° | 115.6° |
| H6 | C20 | H7 | 109.5° | 115.6° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H10 | C14 | H11 | 109.5° | 109.5° |
| H17 | N | H18 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C14 | C15 | H10 | 120.2° | 119.9° |
| N1 | C14 | C15 | H11 | 120.2° | 119.8° |
| C14 | N1 | C13 | O2 | 8.1° | 3.9° |
| C14 | N1 | C13 | C17 | 175.3° | 179.7° |
| N1 | C14 | C15 | N2 | 13.6° | 45.8° |
| C14 | N1 | C13 | C12 | 165.0° | 175.8° |
| C14 | N1 | C17 | C16 | 73.4° | 43.4° |
| C14 | N1 | C17 | H1 | 44.7° | 162.8° |
| C14 | N1 | C17 | H2 | 168.5° | 76.0° |
| N1 | C14 | C15 | H8 | 106.4° | 74.2° |
| N1 | C14 | C15 | H9 | 133.7° | 165.7° |
| N1 | C14 | H10 | H11 | 119.3° | 120.1° |
| C15 | C14 | N1 | C13 | 112.6° | 116.5° |
| C15 | C14 | N1 | C17 | 63.2° | 63.8° |
| C14 | C15 | N2 | H8 | 120.1° | 120.1° |
| C14 | C15 | N2 | H9 | 120.1° | 119.9° |
| C14 | C15 | N2 | C16 | 15.1° | 18.6° |
| C14 | C15 | N2 | C18 | 163.2° | 161.7° |
| C14 | C15 | H8 | H9 | 119.7° | 120.1° |
| C15 | C14 | H10 | H11 | 119.3° | 120.4° |
| C10 | C11 | C12 | H12 | 180.0° | 180.0° |
| C11 | C10 | C9 | H13 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 176.8° | 180.0° |
| C10 | C11 | C12 | C22 | 0.5° | 0.3° |
| C11 | C10 | C9 | C8 | 176.0° | 180.0° |
| C11 | C10 | C9 | C23 | 2.4° | 0.3° |
| C11 | C12 | C13 | O2 | 110.9° | 42.8° |
| C11 | C12 | C13 | N1 | 62.4° | 137.0° |
| C12 | C11 | C10 | C9 | 1.5° | 0.0° |
| C11 | C12 | C13 | C22 | 177.1° | 179.8° |
| C11 | C12 | C22 | C23 | 1.5° | 0.2° |
| C12 | C11 | C10 | H13 | 178.5° | 179.9° |
| C11 | C12 | C22 | H14 | 178.5° | 179.7° |
| O2 | C13 | N1 | C12 | 173.1° | 179.8° |
| O2 | C13 | N1 | C17 | 167.2° | 175.7° |
| O2 | C13 | C12 | C22 | 66.2° | 137.0° |
| C13 | N1 | C17 | C16 | 102.3° | 136.9° |
| N1 | C13 | C12 | C22 | 120.5° | 43.2° |
| C13 | N1 | C17 | H1 | 139.6° | 17.5° |
| C13 | N1 | C17 | H2 | 15.7° | 103.7° |
| C13 | N1 | C14 | H10 | 7.7° | 123.6° |
| C13 | N1 | C14 | H11 | 127.2° | 3.5° |
| C17 | N1 | C13 | C12 | 19.7° | 4.5° |
| N1 | C17 | C16 | H1 | 118.1° | 119.3° |
| N1 | C17 | C16 | H2 | 118.1° | 119.4° |
| N1 | C17 | C16 | N2 | 41.4° | 10.8° |
| N1 | C17 | C16 | N3 | 137.2° | 169.2° |
| N1 | C17 | H1 | H2 | 125.4° | 121.3° |
| C17 | N1 | C14 | H10 | 176.6° | 56.1° |
| C17 | N1 | C14 | H11 | 57.1° | 176.2° |
| C10 | C9 | C8 | C23 | 178.3° | 179.7° |
| C10 | C9 | C8 | C7 | 174.6° | 6.1° |
| C10 | C9 | C23 | C22 | 1.4° | 0.3° |
| C9 | C10 | C11 | H12 | 178.5° | 180.0° |
| C10 | C9 | C23 | H15 | 178.6° | 179.7° |
| C10 | C9 | C8 | H16 | 5.4° | 173.9° |
| C15 | N2 | C16 | C17 | 0.6° | 0.7° |
| C15 | N2 | C16 | C18 | 178.7° | 179.7° |
| C15 | N2 | C16 | N3 | 178.2° | 179.3° |
| C15 | N2 | C18 | C19 | 3.1° | 0.7° |
| C15 | N2 | C18 | N4 | 177.9° | 179.3° |
| N2 | C15 | H8 | H9 | 119.7° | 120.1° |
| N2 | C15 | C14 | H10 | 133.9° | 74.0° |
| N2 | C15 | C14 | H11 | 106.6° | 165.7° |
| C13 | C12 | C22 | C23 | 175.6° | 180.0° |
| C13 | C12 | C11 | H12 | 3.3° | 0.1° |
| C13 | C12 | C22 | H14 | 4.4° | 0.1° |
| C17 | C16 | N2 | N3 | 178.8° | 180.0° |
| C17 | C16 | N2 | C18 | 179.3° | 179.6° |
| C17 | C16 | N3 | N4 | 178.9° | 179.6° |
| C16 | C17 | H1 | H2 | 125.4° | 121.3° |
| C12 | C22 | C23 | C9 | 0.5° | 0.1° |
| C12 | C22 | C23 | H14 | 180.0° | 180.0° |
| C22 | C12 | C11 | H12 | 179.5° | 179.7° |
| C12 | C22 | C23 | H15 | 179.4° | 179.9° |
| C9 | C8 | C7 | H16 | 180.0° | 180.0° |
| C8 | C9 | C23 | C22 | 176.9° | 180.0° |
| C9 | C8 | C7 | C6 | 166.4° | 175.0° |
| C9 | C8 | C7 | O3 | 8.2° | 5.2° |
| C8 | C9 | C10 | H13 | 4.0° | 0.0° |
| C8 | C9 | C23 | H15 | 3.1° | 0.1° |
| C23 | C9 | C8 | C7 | 3.7° | 173.7° |
| C9 | C23 | C22 | H15 | 180.0° | 180.0° |
| C23 | C9 | C10 | H13 | 177.6° | 179.8° |
| C9 | C23 | C22 | H14 | 179.4° | 180.0° |
| C23 | C9 | C8 | H16 | 176.3° | 6.4° |
| C16 | N2 | C18 | C19 | 178.4° | 179.6° |
| C16 | N2 | C18 | N4 | 0.6° | 0.3° |
| N2 | C16 | N3 | N4 | 0.2° | 0.3° |
| N2 | C16 | C17 | H1 | 76.7° | 130.2° |
| N2 | C16 | C17 | H2 | 159.4° | 108.5° |
| C16 | N2 | C15 | H8 | 135.2° | 101.4° |
| C16 | N2 | C15 | H9 | 105.0° | 138.5° |
| C18 | N2 | C16 | N3 | 0.5° | 0.4° |
| N2 | C18 | C19 | C21 | 51.9° | 171.4° |
| N2 | C18 | C19 | N4 | 178.8° | 180.0° |
| N2 | C18 | N4 | N3 | 0.5° | 0.2° |
| N2 | C18 | C19 | C20 | 121.3° | 120.0° |
| N2 | C18 | C19 | H3 | 91.9° | 25.7° |
| C18 | N2 | C15 | H8 | 43.1° | 78.2° |
| C18 | N2 | C15 | H9 | 76.7° | 41.9° |
| O1 | C6 | C7 | C8 | 3.4° | 0.0° |
| O1 | C6 | C7 | C5 | 178.6° | 180.0° |
| O1 | C6 | C7 | O3 | 178.7° | 179.8° |
| O1 | C6 | C5 | C4 | 6.5° | 0.0° |
| O1 | C6 | C5 | C24 | 178.8° | 179.8° |
| C8 | C7 | C6 | O3 | 175.3° | 179.8° |
| C8 | C7 | C6 | C5 | 175.2° | 180.0° |
| C8 | C7 | O3 | C24 | 175.5° | 180.0° |
| C16 | N3 | N4 | C18 | 0.2° | 0.1° |
| N3 | C16 | C17 | H1 | 104.7° | 49.9° |
| N3 | C16 | C17 | H2 | 19.1° | 71.4° |
| C19 | C21 | C20 | H4 | 109.7° | 107.5° |
| C19 | C21 | C20 | H5 | 109.6° | 107.4° |
| C21 | C19 | C18 | C20 | 69.4° | 68.7° |
| C21 | C19 | C18 | H3 | 143.9° | 145.7° |
| C21 | C19 | C18 | N4 | 126.9° | 8.7° |
| C21 | C19 | C20 | H3 | 105.3° | 107.5° |
| C19 | C21 | H4 | H5 | 144.4° | 145.7° |
| C19 | C21 | C20 | H6 | 109.7° | 107.4° |
| C19 | C21 | C20 | H7 | 109.7° | 107.5° |
| C20 | C21 | H4 | H5 | 144.4° | 145.7° |
| C21 | C20 | H6 | H7 | 144.4° | 145.7° |
| C7 | C6 | C5 | C4 | 174.9° | 179.9° |
| C7 | C6 | C5 | C24 | 0.3° | 0.1° |
| C6 | C7 | O3 | C24 | 0.1° | 0.2° |
| C6 | C7 | C8 | H16 | 13.6° | 5.0° |
| C5 | C6 | C7 | O3 | 0.1° | 0.2° |
| C6 | C5 | C4 | C24 | 174.1° | 179.8° |
| C6 | C5 | C24 | O3 | 0.3° | 0.0° |
| C6 | C5 | C4 | C3 | 174.7° | 180.0° |
| C6 | C5 | C24 | C1 | 176.4° | 179.9° |
| C6 | C5 | C4 | H19 | 5.3° | 0.1° |
| C7 | O3 | C24 | C5 | 0.3° | 0.1° |
| C7 | O3 | C24 | C1 | 176.1° | 180.0° |
| O3 | C7 | C8 | H16 | 171.8° | 174.8° |
| C19 | C18 | N4 | N3 | 178.4° | 179.8° |
| C18 | C19 | C20 | H3 | 146.8° | 144.9° |
| C18 | C19 | C21 | H4 | 139.6° | 145.0° |
| C18 | C19 | C21 | H5 | 1.1° | 0.0° |
| C18 | C19 | C20 | H6 | 142.5° | 0.0° |
| C18 | C19 | C20 | H7 | 1.8° | 145.0° |
| N4 | C18 | C19 | C20 | 57.5° | 60.0° |
| N4 | C18 | C19 | H3 | 89.2° | 154.3° |
| C19 | C20 | H6 | H7 | 144.4° | 145.7° |
| C4 | C5 | C24 | O3 | 175.8° | 179.9° |
| C5 | C4 | C3 | H19 | 180.0° | 180.0° |
| C4 | C5 | C24 | C1 | 0.9° | 0.0° |
| C5 | C4 | C3 | C2 | 0.4° | 0.2° |
| C5 | C4 | C3 | H20 | 179.6° | 180.0° |
| C5 | C24 | O3 | C1 | 176.4° | 179.9° |
| C24 | C5 | C4 | C3 | 0.6° | 0.2° |
| C5 | C24 | C1 | C2 | 0.3° | 0.1° |
| C5 | C24 | C1 | C | 178.5° | 179.9° |
| C24 | C5 | C4 | H19 | 179.4° | 179.9° |
| O3 | C24 | C1 | C2 | 175.7° | 180.0° |
| O3 | C24 | C1 | C | 2.4° | 0.0° |
| C4 | C3 | C2 | H20 | 180.0° | 179.9° |
| C4 | C3 | C2 | C1 | 1.0° | 0.0° |
| C4 | C3 | C2 | H21 | 179.0° | 179.9° |
| C24 | C1 | C2 | C3 | 0.6° | 0.1° |
| C24 | C1 | C2 | C | 178.3° | 180.0° |
| C24 | C1 | C | N | 9.5° | 180.0° |
| C24 | C1 | C | O | 170.6° | 0.0° |
| C24 | C1 | C2 | H21 | 179.4° | 180.0° |
| C3 | C2 | C1 | H21 | 180.0° | 179.9° |
| C3 | C2 | C1 | C | 177.7° | 179.9° |
| C2 | C3 | C4 | H19 | 179.6° | 179.9° |
| C2 | C1 | C | N | 168.7° | 0.0° |
| C2 | C1 | C | O | 11.3° | 180.0° |
| C1 | C2 | C3 | H20 | 179.0° | 179.9° |
| C1 | C | N | O | 179.9° | 180.0° |
| C1 | C | N | H17 | 179.9° | 0.1° |
| C1 | C | N | H18 | 0.1° | 180.0° |
| C | C1 | C2 | H21 | 2.3° | 0.0° |
| C | N | H17 | H18 | 180.0° | 179.9° |
| O | C | N | H17 | 0.0° | 180.0° |
| O | C | N | H18 | 180.0° | 0.1° |
| H3 | C19 | C21 | H4 | 4.3° | 0.0° |
| H3 | C19 | C21 | H5 | 145.0° | 145.0° |
| H3 | C19 | C20 | H6 | 4.3° | 144.9° |
| H3 | C19 | C20 | H7 | 145.0° | 0.0° |
| H4 | C21 | C20 | H6 | 0.0° | 145.1° |
| H4 | C21 | C20 | H7 | 140.7° | 0.0° |
| H5 | C21 | C20 | H6 | 140.7° | 0.0° |
| H5 | C21 | C20 | H7 | 0.0° | 145.1° |
| H8 | C15 | C14 | H10 | 13.8° | 165.9° |
| H8 | C15 | C14 | H11 | 133.3° | 45.7° |
| H9 | C15 | C14 | H10 | 106.1° | 45.8° |
| H9 | C15 | C14 | H11 | 13.5° | 74.4° |
| H12 | C11 | C10 | H13 | 1.5° | 0.1° |
| H14 | C22 | C23 | H15 | 0.6° | 0.0° |
| H19 | C4 | C3 | H20 | 0.4° | 0.0° |
| H20 | C3 | C2 | H21 | 1.0° | 0.0° |
