U3I
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O18 | C17 | doub | 1.21Å | 1.22Å | |
| O10 | C9 | doub | 1.22Å | 1.22Å | |
| C17 | N16 | sing | 1.34Å | 1.35Å | |
| C17 | C12 | sing | 1.51Å | 1.51Å | |
| C9 | N8 | sing | 1.34Å | 1.35Å | |
| C9 | C5 | sing | 1.47Å | 1.51Å | |
| N16 | C15 | sing | 1.34Å | 1.35Å | |
| C12 | N8 | sing | 1.47Å | 1.46Å | |
| C12 | C13 | sing | 1.53Å | 1.55Å | |
| C6 | C5 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| N8 | C7 | sing | 1.47Å | 1.47Å | |
| C5 | C4 | sing | 1.40Å | 1.39Å | Aromatic |
| C15 | O19 | doub | 1.21Å | 1.22Å | |
| C15 | C14 | sing | 1.51Å | 1.51Å | |
| C1 | C2 | doub | 1.39Å | 1.41Å | Aromatic |
| C14 | C13 | sing | 1.53Å | 1.54Å | |
| C4 | C7 | sing | 1.51Å | 1.53Å | |
| C4 | C3 | doub | 1.37Å | 1.39Å | Aromatic |
| C29 | C28 | sing | 1.53Å | 1.55Å | |
| C24 | C25 | sing | 1.53Å | 1.55Å | |
| C24 | N23 | sing | 1.47Å | 1.49Å | |
| C2 | C3 | sing | 1.39Å | 1.40Å | Aromatic |
| C2 | O11 | sing | 1.36Å | 1.40Å | |
| C25 | C26 | sing | 1.53Å | 1.54Å | |
| O11 | C20 | sing | 1.43Å | 1.44Å | |
| N23 | C28 | sing | 1.47Å | 1.49Å | |
| N23 | C21 | sing | 1.47Å | 1.50Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.56Å | |
| C20 | C22 | sing | 1.53Å | 1.56Å | |
| C21 | C27 | sing | 1.53Å | 1.56Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C14 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H16 | sing | 1.09Å | 1.10Å | |
| C26 | H17 | sing | 1.09Å | 1.10Å | |
| C26 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å | |
| C28 | H21 | sing | 1.09Å | 1.10Å | |
| C28 | H22 | sing | 1.09Å | 1.10Å | |
| C29 | H23 | sing | 1.09Å | 1.10Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C6 | H26 | sing | 1.08Å | 1.08Å | |
| C7 | H27 | sing | 1.09Å | 1.10Å | |
| C7 | H28 | sing | 1.09Å | 1.10Å | |
| N16 | H29 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O18 | C17 | N16 | 121.2° | 119.5° |
| O18 | C17 | C12 | 118.6° | 119.3° |
| O10 | C9 | N8 | 127.2° | 124.8° |
| O10 | C9 | C5 | 123.9° | 124.9° |
| N16 | C17 | C12 | 120.1° | 121.3° |
| C17 | N16 | C15 | 125.9° | 122.6° |
| C17 | N16 | H29 | 117.0° | 118.6° |
| C17 | C12 | N8 | 108.8° | 109.5° |
| C17 | C12 | C13 | 109.7° | 109.1° |
| C17 | C12 | H3 | 110.0° | 109.6° |
| N8 | C9 | C5 | 108.9° | 110.3° |
| C9 | N8 | C12 | 123.1° | 125.6° |
| C9 | N8 | C7 | 113.0° | 108.8° |
| C9 | C5 | C6 | 133.2° | 132.3° |
| C9 | C5 | C4 | 105.2° | 108.3° |
| N16 | C15 | O19 | 122.2° | 119.4° |
| N16 | C15 | C14 | 119.5° | 121.2° |
| C15 | N16 | H29 | 117.1° | 118.7° |
| N8 | C12 | C13 | 108.0° | 109.5° |
| C12 | N8 | C7 | 123.9° | 125.6° |
| N8 | C12 | H3 | 110.8° | 109.6° |
| C12 | C13 | C14 | 111.6° | 108.6° |
| C13 | C12 | H3 | 109.5° | 109.5° |
| C12 | C13 | H4 | 108.9° | 109.6° |
| C12 | C13 | H5 | 108.9° | 109.6° |
| C5 | C6 | C1 | 117.9° | 119.9° |
| C6 | C5 | C4 | 121.5° | 119.4° |
| C5 | C6 | H26 | 121.0° | 120.1° |
| C6 | C1 | C2 | 120.7° | 120.3° |
| C6 | C1 | H1 | 119.7° | 119.9° |
| C1 | C6 | H26 | 121.0° | 120.0° |
| N8 | C7 | C4 | 101.1° | 106.2° |
| N8 | C7 | H27 | 111.5° | 110.1° |
| N8 | C7 | H28 | 111.5° | 110.2° |
| C5 | C4 | C7 | 111.8° | 106.4° |
| C5 | C4 | C3 | 120.5° | 120.4° |
| O19 | C15 | C14 | 118.3° | 119.4° |
| C15 | C14 | C13 | 110.4° | 109.2° |
| C15 | C14 | H6 | 109.2° | 109.5° |
| C15 | C14 | H7 | 109.2° | 109.6° |
| C1 | C2 | C3 | 119.9° | 120.0° |
| C1 | C2 | O11 | 124.7° | 120.0° |
| C2 | C1 | H1 | 119.6° | 119.9° |
| C14 | C13 | H4 | 109.0° | 109.6° |
| C14 | C13 | H5 | 109.0° | 109.7° |
| C13 | C14 | H6 | 109.2° | 109.5° |
| C13 | C14 | H7 | 109.2° | 109.6° |
| C7 | C4 | C3 | 127.7° | 133.2° |
| C4 | C7 | H27 | 111.5° | 110.1° |
| C4 | C7 | H28 | 111.5° | 110.1° |
| C4 | C3 | C2 | 119.5° | 119.9° |
| C4 | C3 | H2 | 120.3° | 120.1° |
| C29 | C28 | N23 | 116.5° | 109.5° |
| C29 | C28 | H21 | 107.7° | 109.5° |
| C29 | C28 | H22 | 107.7° | 109.5° |
| C28 | C29 | H23 | 109.5° | 109.5° |
| C28 | C29 | H24 | 109.5° | 109.5° |
| C28 | C29 | H25 | 109.5° | 109.5° |
| C25 | C24 | N23 | 114.5° | 109.6° |
| C24 | C25 | C26 | 109.1° | 109.2° |
| C25 | C24 | H13 | 108.2° | 109.4° |
| C25 | C24 | H14 | 108.2° | 109.5° |
| C24 | C25 | H15 | 109.6° | 109.5° |
| C24 | C25 | H16 | 109.5° | 109.5° |
| C24 | N23 | C28 | 116.9° | 111.0° |
| C24 | N23 | C21 | 118.4° | 111.2° |
| N23 | C24 | H13 | 108.2° | 109.5° |
| N23 | C24 | H14 | 108.2° | 109.5° |
| C3 | C2 | O11 | 115.4° | 120.0° |
| C2 | C3 | H2 | 120.3° | 120.0° |
| C2 | O11 | C20 | 127.7° | 117.0° |
| C25 | C26 | C27 | 106.9° | 109.2° |
| C26 | C25 | H15 | 109.5° | 109.5° |
| C26 | C25 | H16 | 109.6° | 109.5° |
| C25 | C26 | H17 | 110.1° | 109.5° |
| C25 | C26 | H18 | 110.1° | 109.6° |
| O11 | C20 | C21 | 103.7° | 109.5° |
| O11 | C20 | C22 | 110.8° | 109.5° |
| O11 | C20 | H8 | 110.9° | 109.5° |
| C28 | N23 | C21 | 117.8° | 111.0° |
| N23 | C28 | H21 | 107.7° | 109.5° |
| N23 | C28 | H22 | 107.7° | 109.4° |
| N23 | C21 | C20 | 113.2° | 109.5° |
| N23 | C21 | C27 | 114.1° | 109.5° |
| N23 | C21 | H9 | 106.3° | 109.4° |
| C26 | C27 | C21 | 111.8° | 109.3° |
| C27 | C26 | H17 | 110.1° | 109.5° |
| C27 | C26 | H18 | 110.1° | 109.5° |
| C26 | C27 | H19 | 108.9° | 109.5° |
| C26 | C27 | H20 | 108.9° | 109.5° |
| C21 | C20 | C22 | 112.9° | 109.4° |
| C20 | C21 | C27 | 110.9° | 109.5° |
| C21 | C20 | H8 | 109.2° | 109.5° |
| C20 | C21 | H9 | 105.7° | 109.4° |
| C22 | C20 | H8 | 109.2° | 109.5° |
| C20 | C22 | H10 | 109.5° | 109.4° |
| C20 | C22 | H11 | 109.5° | 109.5° |
| C20 | C22 | H12 | 109.4° | 109.4° |
| C27 | C21 | H9 | 105.7° | 109.5° |
| C21 | C27 | H19 | 108.9° | 109.5° |
| C21 | C27 | H20 | 108.9° | 109.5° |
| H4 | C13 | H5 | 109.4° | 109.7° |
| H6 | C14 | H7 | 109.5° | 109.5° |
| H10 | C22 | H11 | 109.4° | 109.5° |
| H10 | C22 | H12 | 109.5° | 109.5° |
| H11 | C22 | H12 | 109.5° | 109.5° |
| H13 | C24 | H14 | 109.5° | 109.4° |
| H15 | C25 | H16 | 109.5° | 109.6° |
| H17 | C26 | H18 | 109.4° | 109.5° |
| H19 | C27 | H20 | 109.5° | 109.6° |
| H21 | C28 | H22 | 109.5° | 109.4° |
| H23 | C29 | H24 | 109.5° | 109.5° |
| H23 | C29 | H25 | 109.5° | 109.4° |
| H24 | C29 | H25 | 109.5° | 109.4° |
| H27 | C7 | H28 | 109.4° | 110.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O18 | C17 | N16 | C12 | 179.8° | 179.9° |
| O18 | C17 | N16 | C15 | 179.9° | 179.5° |
| O18 | C17 | C12 | N8 | 36.4° | 89.2° |
| O18 | C17 | C12 | C13 | 154.4° | 151.0° |
| O18 | C17 | C12 | H3 | 85.1° | 31.1° |
| O18 | C17 | N16 | H29 | 0.1° | 0.4° |
| O10 | C9 | N8 | C5 | 179.7° | 179.9° |
| O10 | C9 | N8 | C12 | 0.6° | 0.0° |
| O10 | C9 | C5 | C6 | 0.1° | 0.2° |
| O10 | C9 | N8 | C7 | 179.8° | 179.9° |
| O10 | C9 | C5 | C4 | 180.0° | 179.9° |
| C17 | N16 | C15 | H29 | 180.0° | 179.9° |
| N16 | C17 | C12 | N8 | 143.4° | 90.7° |
| N16 | C17 | C12 | C13 | 25.4° | 29.1° |
| C17 | N16 | C15 | O19 | 179.9° | 179.4° |
| C17 | N16 | C15 | C14 | 0.2° | 0.6° |
| N16 | C17 | C12 | H3 | 95.1° | 149.0° |
| C17 | C12 | N8 | C9 | 128.8° | 175.3° |
| C12 | C17 | N16 | C15 | 0.2° | 0.6° |
| C17 | C12 | N8 | C13 | 119.0° | 119.6° |
| C17 | C12 | N8 | H3 | 121.0° | 120.2° |
| C17 | C12 | C13 | H3 | 120.8° | 120.0° |
| C17 | C12 | N8 | C7 | 52.1° | 4.7° |
| C17 | C12 | C13 | C14 | 50.6° | 55.6° |
| C17 | C12 | C13 | H4 | 171.0° | 64.1° |
| C17 | C12 | C13 | H5 | 69.7° | 175.5° |
| C12 | C17 | N16 | H29 | 179.8° | 179.5° |
| C9 | N8 | C12 | C7 | 179.2° | 180.0° |
| C9 | N8 | C12 | C13 | 112.2° | 65.1° |
| N8 | C9 | C5 | C6 | 179.8° | 179.7° |
| N8 | C9 | C5 | C4 | 0.2° | 0.0° |
| C9 | N8 | C7 | C4 | 0.5° | 0.0° |
| C9 | N8 | C12 | H3 | 7.8° | 55.0° |
| C9 | N8 | C7 | H27 | 119.1° | 119.2° |
| C9 | N8 | C7 | H28 | 118.2° | 119.2° |
| C5 | C9 | N8 | C12 | 179.7° | 180.0° |
| C9 | C5 | C6 | C4 | 180.0° | 179.7° |
| C9 | C5 | C6 | C1 | 179.8° | 179.8° |
| C5 | C9 | N8 | C7 | 0.5° | 0.0° |
| C9 | C5 | C4 | C7 | 0.1° | 0.0° |
| C9 | C5 | C4 | C3 | 180.0° | 179.9° |
| C9 | C5 | C6 | H26 | 0.2° | 0.3° |
| N16 | C15 | O19 | C14 | 179.7° | 180.0° |
| N16 | C15 | C14 | C13 | 26.5° | 29.1° |
| N16 | C15 | C14 | H6 | 146.6° | 149.1° |
| N16 | C15 | C14 | H7 | 93.7° | 90.9° |
| N8 | C12 | C13 | H3 | 120.7° | 120.2° |
| N8 | C12 | C13 | C14 | 169.1° | 64.3° |
| C12 | N8 | C7 | C4 | 179.7° | 180.0° |
| N8 | C12 | C13 | H4 | 70.6° | 176.0° |
| N8 | C12 | C13 | H5 | 48.8° | 55.6° |
| C12 | N8 | C7 | H27 | 61.6° | 60.8° |
| C12 | N8 | C7 | H28 | 61.1° | 60.7° |
| C13 | C12 | N8 | C7 | 67.0° | 115.0° |
| C12 | C13 | C14 | C15 | 51.4° | 55.6° |
| C12 | C13 | C14 | H4 | 120.3° | 119.7° |
| C12 | C13 | C14 | H5 | 120.3° | 119.8° |
| C12 | C13 | H4 | H5 | 119.0° | 120.4° |
| C12 | C13 | C14 | H6 | 171.6° | 175.5° |
| C12 | C13 | C14 | H7 | 68.7° | 64.4° |
| C5 | C6 | C1 | H26 | 180.0° | 179.5° |
| C5 | C6 | C1 | C2 | 0.3° | 0.5° |
| C6 | C5 | C4 | C7 | 179.9° | 179.8° |
| C6 | C5 | C4 | C3 | 0.0° | 0.3° |
| C5 | C6 | C1 | H1 | 179.7° | 179.7° |
| C1 | C6 | C5 | C4 | 0.2° | 0.5° |
| C6 | C1 | C2 | H1 | 180.0° | 179.8° |
| C6 | C1 | C2 | C3 | 0.2° | 0.2° |
| C6 | C1 | C2 | O11 | 179.6° | 179.7° |
| N8 | C7 | C4 | C5 | 0.3° | 0.0° |
| N8 | C7 | C4 | H27 | 118.6° | 119.2° |
| N8 | C7 | C4 | H28 | 118.6° | 119.3° |
| N8 | C7 | C4 | C3 | 179.8° | 179.9° |
| C7 | N8 | C12 | H3 | 173.1° | 124.9° |
| N8 | C7 | H27 | H28 | 123.9° | 121.6° |
| C5 | C4 | C7 | C3 | 179.9° | 179.9° |
| C5 | C4 | C3 | C2 | 0.1° | 0.0° |
| C5 | C4 | C3 | H2 | 179.9° | 180.0° |
| C4 | C5 | C6 | H26 | 179.8° | 180.0° |
| C5 | C4 | C7 | H27 | 119.0° | 119.2° |
| C5 | C4 | C7 | H28 | 118.3° | 119.3° |
| O19 | C15 | C14 | C13 | 153.8° | 150.9° |
| O19 | C15 | C14 | H6 | 33.7° | 31.0° |
| O19 | C15 | C14 | H7 | 86.0° | 89.1° |
| O19 | C15 | N16 | H29 | 0.1° | 0.5° |
| C15 | C14 | C13 | H6 | 120.1° | 119.9° |
| C15 | C14 | C13 | H7 | 120.1° | 120.0° |
| C15 | C14 | C13 | H4 | 171.7° | 64.1° |
| C15 | C14 | C13 | H5 | 68.9° | 175.4° |
| C15 | C14 | H6 | H7 | 119.6° | 120.1° |
| C14 | C15 | N16 | H29 | 179.8° | 179.5° |
| C1 | C2 | C3 | C4 | 0.0° | 0.0° |
| C1 | C2 | C3 | O11 | 179.8° | 180.0° |
| C1 | C2 | O11 | C20 | 76.7° | 2.9° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C2 | C1 | C6 | H26 | 179.7° | 180.0° |
| C14 | C13 | C12 | H3 | 70.2° | 175.6° |
| C14 | C13 | H4 | H5 | 119.1° | 120.5° |
| C13 | C14 | H6 | H7 | 119.6° | 120.2° |
| C7 | C4 | C3 | C2 | 179.8° | 180.0° |
| C7 | C4 | C3 | H2 | 0.2° | 0.1° |
| C4 | C7 | H27 | H28 | 123.9° | 121.6° |
| C4 | C3 | C2 | H2 | 180.0° | 180.0° |
| C4 | C3 | C2 | O11 | 179.8° | 180.0° |
| C3 | C4 | C7 | H27 | 61.1° | 60.8° |
| C3 | C4 | C7 | H28 | 61.6° | 60.8° |
| C29 | C28 | N23 | C24 | 50.0° | 70.1° |
| C29 | C28 | N23 | H21 | 121.0° | 120.0° |
| C29 | C28 | N23 | H22 | 121.0° | 120.0° |
| C29 | C28 | N23 | C21 | 159.5° | 165.6° |
| C29 | C28 | H21 | H22 | 116.8° | 120.0° |
| C28 | C29 | H23 | H24 | 120.0° | 120.0° |
| C28 | C29 | H23 | H25 | 120.0° | 120.0° |
| C28 | C29 | H24 | H25 | 120.0° | 120.0° |
| C25 | C24 | N23 | H13 | 120.7° | 120.0° |
| C25 | C24 | N23 | H14 | 120.7° | 120.0° |
| C24 | C25 | C26 | H15 | 120.0° | 119.9° |
| C24 | C25 | C26 | H16 | 119.9° | 119.9° |
| C25 | C24 | N23 | C28 | 113.8° | 174.1° |
| C25 | C24 | N23 | C21 | 36.6° | 61.7° |
| C24 | C25 | C26 | C27 | 64.9° | 57.7° |
| C25 | C24 | H13 | H14 | 117.7° | 119.9° |
| C24 | C25 | H15 | H16 | 120.2° | 120.1° |
| C24 | C25 | C26 | H17 | 54.7° | 177.5° |
| C24 | C25 | C26 | H18 | 175.5° | 62.3° |
| N23 | C24 | C25 | C26 | 52.9° | 59.2° |
| C24 | N23 | C28 | C21 | 150.5° | 124.3° |
| C24 | N23 | C21 | C20 | 96.1° | 178.2° |
| C24 | N23 | C21 | C27 | 32.1° | 61.7° |
| C24 | N23 | C21 | H9 | 148.2° | 58.3° |
| N23 | C24 | H13 | H14 | 117.7° | 120.0° |
| N23 | C24 | C25 | H15 | 172.8° | 60.8° |
| N23 | C24 | C25 | H16 | 67.1° | 179.1° |
| C24 | N23 | C28 | H21 | 71.0° | 49.9° |
| C24 | N23 | C28 | H22 | 171.0° | 169.8° |
| C3 | C2 | O11 | C20 | 103.5° | 177.2° |
| C3 | C2 | C1 | H1 | 179.8° | 180.0° |
| C2 | O11 | C20 | C21 | 176.3° | 157.0° |
| C2 | O11 | C20 | C22 | 62.3° | 83.1° |
| O11 | C2 | C1 | H1 | 0.4° | 0.0° |
| O11 | C2 | C3 | H2 | 0.2° | 0.0° |
| C2 | O11 | C20 | H8 | 59.3° | 36.9° |
| C25 | C26 | C27 | H17 | 119.6° | 119.9° |
| C25 | C26 | C27 | H18 | 119.6° | 120.0° |
| C25 | C26 | C27 | C21 | 61.7° | 57.7° |
| C26 | C25 | C24 | H13 | 173.6° | 60.9° |
| C26 | C25 | C24 | H14 | 67.8° | 179.2° |
| C26 | C25 | H15 | H16 | 120.2° | 120.1° |
| C25 | C26 | H17 | H18 | 121.2° | 120.2° |
| C25 | C26 | C27 | H19 | 177.9° | 177.6° |
| C25 | C26 | C27 | H20 | 58.6° | 62.2° |
| O11 | C20 | C21 | N23 | 7.0° | 174.2° |
| O11 | C20 | C21 | C22 | 120.0° | 120.0° |
| O11 | C20 | C21 | H8 | 118.3° | 120.0° |
| O11 | C20 | C22 | H8 | 122.5° | 120.0° |
| O11 | C20 | C21 | C27 | 136.8° | 54.1° |
| O11 | C20 | C21 | H9 | 109.0° | 65.8° |
| O11 | C20 | C22 | H10 | 180.0° | 64.1° |
| O11 | C20 | C22 | H11 | 60.0° | 55.9° |
| O11 | C20 | C22 | H12 | 60.0° | 176.0° |
| C28 | N23 | C21 | C20 | 113.9° | 54.1° |
| C28 | N23 | C21 | C27 | 118.0° | 174.2° |
| C28 | N23 | C21 | H9 | 1.8° | 65.8° |
| C28 | N23 | C24 | H13 | 7.0° | 65.9° |
| C28 | N23 | C24 | H14 | 125.5° | 54.1° |
| N23 | C28 | H21 | H22 | 116.8° | 119.9° |
| N23 | C28 | C29 | H23 | 180.0° | 60.0° |
| N23 | C28 | C29 | H24 | 60.0° | 180.0° |
| N23 | C28 | C29 | H25 | 60.0° | 60.0° |
| N23 | C21 | C27 | C26 | 45.0° | 59.1° |
| N23 | C21 | C20 | C27 | 129.8° | 120.1° |
| N23 | C21 | C20 | H9 | 116.0° | 119.9° |
| N23 | C21 | C20 | C22 | 127.0° | 54.3° |
| N23 | C21 | C27 | H9 | 116.5° | 120.0° |
| N23 | C21 | C20 | H8 | 111.3° | 65.7° |
| C21 | N23 | C24 | H13 | 157.3° | 58.3° |
| C21 | N23 | C24 | H14 | 84.2° | 178.3° |
| N23 | C21 | C27 | H19 | 165.3° | 179.1° |
| N23 | C21 | C27 | H20 | 75.4° | 60.8° |
| C21 | N23 | C28 | H21 | 79.5° | 74.4° |
| C21 | N23 | C28 | H22 | 38.4° | 45.6° |
| C26 | C27 | C21 | C20 | 84.3° | 179.2° |
| C26 | C27 | C21 | H19 | 120.4° | 119.9° |
| C26 | C27 | C21 | H20 | 120.3° | 119.9° |
| C26 | C27 | C21 | H9 | 161.5° | 60.8° |
| C27 | C26 | C25 | H15 | 175.2° | 62.2° |
| C27 | C26 | C25 | H16 | 55.0° | 177.6° |
| C27 | C26 | H17 | H18 | 121.2° | 120.1° |
| C26 | C27 | H19 | H20 | 118.9° | 120.1° |
| C21 | C20 | C22 | H8 | 121.7° | 120.0° |
| C20 | C21 | C27 | H9 | 114.2° | 119.9° |
| C21 | C20 | C22 | H10 | 64.2° | 55.9° |
| C21 | C20 | C22 | H11 | 55.8° | 175.9° |
| C21 | C20 | C22 | H12 | 175.8° | 64.1° |
| C20 | C21 | C27 | H19 | 36.0° | 60.9° |
| C20 | C21 | C27 | H20 | 155.3° | 59.3° |
| C22 | C20 | C21 | C27 | 103.2° | 65.9° |
| C22 | C20 | C21 | H9 | 11.0° | 174.2° |
| C20 | C22 | H10 | H11 | 120.0° | 120.0° |
| C20 | C22 | H10 | H12 | 120.0° | 119.9° |
| C20 | C22 | H11 | H12 | 120.0° | 120.0° |
| C27 | C21 | C20 | H8 | 18.5° | 174.2° |
| C21 | C27 | C26 | H17 | 57.9° | 177.6° |
| C21 | C27 | C26 | H18 | 178.7° | 62.3° |
| C21 | C27 | H19 | H20 | 118.9° | 120.1° |
| H1 | C1 | C6 | H26 | 0.3° | 0.3° |
| H3 | C12 | C13 | H4 | 50.2° | 55.9° |
| H3 | C12 | C13 | H5 | 169.5° | 64.6° |
| H4 | C13 | C14 | H6 | 68.1° | 55.8° |
| H4 | C13 | C14 | H7 | 51.6° | 175.9° |
| H5 | C13 | C14 | H6 | 51.2° | 64.7° |
| H5 | C13 | C14 | H7 | 171.0° | 55.4° |
| H8 | C20 | C21 | H9 | 132.7° | 54.2° |
| H8 | C20 | C22 | H10 | 57.5° | 175.9° |
| H8 | C20 | C22 | H11 | 177.5° | 64.1° |
| H8 | C20 | C22 | H12 | 62.5° | 56.0° |
| H9 | C21 | C27 | H19 | 78.2° | 59.1° |
| H9 | C21 | C27 | H20 | 41.1° | 179.2° |
| H10 | C22 | H11 | H12 | 120.0° | 120.0° |
| H13 | C24 | C25 | H15 | 66.4° | 179.2° |
| H13 | C24 | C25 | H16 | 53.7° | 59.1° |
| H14 | C24 | C25 | H15 | 52.1° | 59.3° |
| H14 | C24 | C25 | H16 | 172.2° | 60.9° |
| H15 | C25 | C26 | H17 | 65.2° | 57.6° |
| H15 | C25 | C26 | H18 | 55.5° | 177.8° |
| H16 | C25 | C26 | H17 | 174.7° | 62.5° |
| H16 | C25 | C26 | H18 | 64.6° | 57.6° |
| H17 | C26 | C27 | H19 | 62.5° | 62.5° |
| H17 | C26 | C27 | H20 | 178.2° | 57.6° |
| H18 | C26 | C27 | H19 | 58.3° | 57.6° |
| H18 | C26 | C27 | H20 | 61.0° | 177.8° |
| H21 | C28 | C29 | H23 | 59.0° | 180.0° |
| H21 | C28 | C29 | H24 | 61.0° | 60.0° |
| H21 | C28 | C29 | H25 | 179.0° | 60.0° |
| H22 | C28 | C29 | H23 | 58.9° | 60.0° |
| H22 | C28 | C29 | H24 | 179.0° | 60.0° |
| H22 | C28 | C29 | H25 | 61.1° | 180.0° |
| H23 | C29 | H24 | H25 | 120.0° | 120.0° |
