U3B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N2 | C25 | sing | 1.35Å | 1.48Å | |
| O7 | C25 | doub | 1.22Å | 1.22Å | |
| C25 | C17 | sing | 1.47Å | 1.50Å | |
| O6 | C18 | sing | 1.34Å | 1.33Å | |
| C17 | C18 | doub | 1.37Å | 1.38Å | |
| C17 | C16 | sing | 1.46Å | 1.47Å | |
| C18 | C19 | sing | 1.50Å | 1.50Å | |
| O2 | C20 | doub | 1.22Å | 1.23Å | |
| O1 | C16 | doub | 1.21Å | 1.25Å | |
| C16 | C15 | sing | 1.50Å | 1.52Å | |
| C19 | C20 | sing | 1.50Å | 1.54Å | |
| C19 | O5 | sing | 1.43Å | 1.42Å | |
| C19 | C14 | sing | 1.51Å | 1.53Å | |
| O4 | C22 | sing | 1.35Å | 1.34Å | |
| C20 | C21 | sing | 1.38Å | 1.39Å | |
| C22 | C21 | doub | 1.38Å | 1.40Å | |
| C22 | C23 | sing | 1.47Å | 1.48Å | |
| C21 | C12 | sing | 1.51Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | C10 | sing | 1.51Å | 1.50Å | |
| C14 | C15 | sing | 1.52Å | 1.55Å | |
| C14 | C13 | sing | 1.53Å | 1.54Å | |
| C23 | C10 | doub | 1.40Å | 1.41Å | Aromatic |
| C23 | C24 | sing | 1.40Å | 1.41Å | Aromatic |
| C15 | N3 | sing | 1.47Å | 1.50Å | |
| C28 | N4 | sing | 1.47Å | 1.46Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| O3 | C24 | sing | 1.36Å | 1.35Å | |
| C10 | C9 | sing | 1.38Å | 1.41Å | Aromatic |
| C24 | C7 | doub | 1.39Å | 1.41Å | Aromatic |
| C9 | N4 | sing | 1.40Å | 1.43Å | |
| C9 | C8 | doub | 1.39Å | 1.38Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.51Å | 1.50Å | |
| N4 | C29 | sing | 1.47Å | 1.46Å | |
| N3 | C27 | sing | 1.47Å | 1.47Å | |
| N3 | C26 | sing | 1.47Å | 1.47Å | |
| C6 | N1 | sing | 1.47Å | 1.46Å | |
| N1 | C5 | sing | 1.47Å | 1.47Å | |
| C5 | C2 | sing | 1.53Å | 1.54Å | |
| C2 | C4 | sing | 1.53Å | 1.54Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H8 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C5 | H11 | sing | 1.09Å | 1.10Å | |
| N1 | H12 | sing | 1.01Å | 1.00Å | |
| C6 | H14 | sing | 1.09Å | 1.10Å | |
| C6 | H15 | sing | 1.09Å | 1.10Å | |
| C8 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| O3 | H26 | sing | 0.97Å | 0.95Å | |
| O4 | H27 | sing | 0.97Å | 0.95Å | |
| O5 | H28 | sing | 0.97Å | 0.95Å | |
| O6 | H29 | sing | 0.97Å | 0.95Å | |
| N2 | H30 | sing | 0.97Å | 1.00Å | |
| N2 | H31 | sing | 0.97Å | 1.00Å | |
| C26 | H33 | sing | 1.09Å | 1.10Å | |
| C26 | H34 | sing | 1.09Å | 1.10Å | |
| C26 | H35 | sing | 1.09Å | 1.10Å | |
| C27 | H36 | sing | 1.09Å | 1.10Å | |
| C27 | H37 | sing | 1.09Å | 1.10Å | |
| C27 | H38 | sing | 1.09Å | 1.10Å | |
| C28 | H39 | sing | 1.09Å | 1.10Å | |
| C28 | H40 | sing | 1.09Å | 1.10Å | |
| C28 | H41 | sing | 1.09Å | 1.10Å | |
| C29 | H42 | sing | 1.09Å | 1.10Å | |
| C29 | H43 | sing | 1.09Å | 1.10Å | |
| C29 | H44 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C25 | O7 | 117.0° | 120.1° |
| N2 | C25 | C17 | 123.1° | 120.0° |
| C25 | N2 | H30 | 120.0° | 120.0° |
| C25 | N2 | H31 | 120.0° | 119.9° |
| O7 | C25 | C17 | 119.9° | 120.0° |
| C25 | C17 | C18 | 119.4° | 119.9° |
| C25 | C17 | C16 | 124.4° | 119.9° |
| O6 | C18 | C17 | 124.2° | 118.7° |
| O6 | C18 | C19 | 115.8° | 118.6° |
| C18 | O6 | H29 | 109.5° | 116.9° |
| C18 | C17 | C16 | 116.2° | 120.2° |
| C17 | C18 | C19 | 119.9° | 122.8° |
| C17 | C16 | O1 | 120.9° | 120.1° |
| C17 | C16 | C15 | 120.6° | 119.7° |
| C18 | C19 | C20 | 114.9° | 109.8° |
| C18 | C19 | O5 | 106.0° | 107.6° |
| C18 | C19 | C14 | 108.0° | 113.1° |
| O2 | C20 | C19 | 116.5° | 118.2° |
| O2 | C20 | C21 | 121.1° | 118.4° |
| O1 | C16 | C15 | 118.5° | 120.2° |
| C16 | C15 | C14 | 111.5° | 111.2° |
| C16 | C15 | N3 | 113.4° | 109.2° |
| C16 | C15 | H23 | 106.0° | 109.1° |
| C20 | C19 | O5 | 105.6° | 107.6° |
| C20 | C19 | C14 | 112.1° | 111.6° |
| C19 | C20 | C21 | 122.5° | 123.4° |
| O5 | C19 | C14 | 110.0° | 106.9° |
| C19 | O5 | H28 | 109.5° | 114.0° |
| C19 | C14 | C15 | 116.4° | 113.7° |
| C19 | C14 | C13 | 108.9° | 110.6° |
| C19 | C14 | H22 | 107.3° | 106.9° |
| O4 | C22 | C21 | 123.2° | 120.3° |
| O4 | C22 | C23 | 115.9° | 119.7° |
| C22 | O4 | H27 | 109.5° | 113.9° |
| C20 | C21 | C22 | 122.9° | 119.1° |
| C20 | C21 | C12 | 120.0° | 122.2° |
| C21 | C22 | C23 | 120.9° | 120.0° |
| C22 | C21 | C12 | 117.1° | 118.7° |
| C22 | C23 | C10 | 117.8° | 119.0° |
| C22 | C23 | C24 | 122.5° | 121.1° |
| C21 | C12 | C11 | 106.5° | 110.6° |
| C21 | C12 | C13 | 115.8° | 109.0° |
| C21 | C12 | H19 | 107.1° | 109.3° |
| C12 | C11 | C10 | 111.2° | 110.1° |
| C11 | C12 | C13 | 113.1° | 109.4° |
| C12 | C11 | H17 | 109.0° | 109.4° |
| C12 | C11 | H18 | 109.0° | 109.4° |
| C11 | C12 | H19 | 106.9° | 109.3° |
| C11 | C10 | C23 | 117.4° | 119.7° |
| C11 | C10 | C9 | 123.0° | 120.5° |
| C10 | C11 | H17 | 109.1° | 109.3° |
| C10 | C11 | H18 | 109.1° | 109.4° |
| C15 | C14 | C13 | 109.6° | 110.8° |
| C14 | C15 | N3 | 113.3° | 109.2° |
| C15 | C14 | H22 | 107.1° | 107.3° |
| C14 | C15 | H23 | 105.7° | 109.1° |
| C14 | C13 | C12 | 112.7° | 108.7° |
| C14 | C13 | H20 | 108.7° | 109.6° |
| C14 | C13 | H21 | 108.6° | 109.8° |
| C13 | C14 | H22 | 107.2° | 107.2° |
| C10 | C23 | C24 | 119.7° | 119.9° |
| C23 | C10 | C9 | 119.5° | 119.8° |
| C23 | C24 | O3 | 120.1° | 120.2° |
| C23 | C24 | C7 | 120.3° | 119.6° |
| C15 | N3 | C27 | 118.9° | 111.0° |
| C15 | N3 | C26 | 115.4° | 111.0° |
| N3 | C15 | H23 | 106.3° | 109.1° |
| C28 | N4 | C9 | 120.3° | 111.0° |
| C28 | N4 | C29 | 114.8° | 111.0° |
| N4 | C28 | H39 | 109.5° | 109.5° |
| N4 | C28 | H40 | 109.5° | 109.5° |
| N4 | C28 | H41 | 109.5° | 109.5° |
| C13 | C12 | H19 | 107.0° | 109.3° |
| C12 | C13 | H20 | 108.6° | 109.6° |
| C12 | C13 | H21 | 108.7° | 109.6° |
| O3 | C24 | C7 | 119.5° | 120.2° |
| C24 | O3 | H26 | 109.5° | 114.0° |
| C10 | C9 | N4 | 121.7° | 119.9° |
| C10 | C9 | C8 | 119.7° | 120.1° |
| C24 | C7 | C8 | 118.7° | 120.2° |
| C24 | C7 | C6 | 122.2° | 119.9° |
| N4 | C9 | C8 | 118.6° | 120.0° |
| C9 | N4 | C29 | 122.8° | 111.0° |
| C9 | C8 | C7 | 122.0° | 120.4° |
| C9 | C8 | H16 | 119.0° | 119.8° |
| C8 | C7 | C6 | 119.0° | 119.9° |
| C7 | C8 | H16 | 119.0° | 119.8° |
| C7 | C6 | N1 | 112.4° | 109.5° |
| C7 | C6 | H14 | 108.7° | 109.5° |
| C7 | C6 | H15 | 108.7° | 109.5° |
| N4 | C29 | H42 | 109.5° | 109.4° |
| N4 | C29 | H43 | 109.4° | 109.5° |
| N4 | C29 | H44 | 109.4° | 109.5° |
| C27 | N3 | C26 | 112.0° | 111.0° |
| N3 | C27 | H36 | 109.5° | 109.5° |
| N3 | C27 | H37 | 109.5° | 109.4° |
| N3 | C27 | H38 | 109.5° | 109.5° |
| N3 | C26 | H33 | 109.5° | 109.5° |
| N3 | C26 | H34 | 109.5° | 109.5° |
| N3 | C26 | H35 | 109.5° | 109.4° |
| C6 | N1 | C5 | 113.7° | 111.0° |
| C6 | N1 | H12 | 108.4° | 111.0° |
| N1 | C6 | H14 | 108.8° | 109.5° |
| N1 | C6 | H15 | 108.8° | 109.4° |
| N1 | C5 | C2 | 116.5° | 109.5° |
| N1 | C5 | H10 | 107.7° | 109.5° |
| N1 | C5 | H11 | 107.7° | 109.4° |
| C5 | N1 | H12 | 108.4° | 111.0° |
| C5 | C2 | C4 | 109.9° | 109.5° |
| C5 | C2 | C3 | 106.9° | 109.4° |
| C5 | C2 | C1 | 108.0° | 109.4° |
| C2 | C5 | H10 | 107.7° | 109.5° |
| C2 | C5 | H11 | 107.7° | 109.4° |
| C4 | C2 | C3 | 110.0° | 109.5° |
| C4 | C2 | C1 | 111.0° | 109.5° |
| C2 | C4 | H7 | 109.5° | 109.4° |
| C2 | C4 | H8 | 109.5° | 109.5° |
| C2 | C4 | H9 | 109.4° | 109.5° |
| C3 | C2 | C1 | 111.0° | 109.5° |
| C2 | C3 | H4 | 109.5° | 109.5° |
| C2 | C3 | H5 | 109.5° | 109.4° |
| C2 | C3 | H6 | 109.5° | 109.4° |
| C2 | C1 | H1 | 109.5° | 109.4° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C1 | H3 | 109.4° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H4 | C3 | H5 | 109.5° | 109.6° |
| H4 | C3 | H6 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H7 | C4 | H8 | 109.5° | 109.4° |
| H7 | C4 | H9 | 109.4° | 109.5° |
| H8 | C4 | H9 | 109.5° | 109.5° |
| H10 | C5 | H11 | 109.5° | 109.5° |
| H14 | C6 | H15 | 109.5° | 109.5° |
| H17 | C11 | H18 | 109.5° | 109.2° |
| H20 | C13 | H21 | 109.4° | 109.6° |
| H30 | N2 | H31 | 120.0° | 120.0° |
| H33 | C26 | H34 | 109.4° | 109.5° |
| H33 | C26 | H35 | 109.5° | 109.5° |
| H34 | C26 | H35 | 109.5° | 109.5° |
| H36 | C27 | H37 | 109.5° | 109.4° |
| H36 | C27 | H38 | 109.4° | 109.5° |
| H37 | C27 | H38 | 109.5° | 109.5° |
| H39 | C28 | H40 | 109.4° | 109.5° |
| H39 | C28 | H41 | 109.5° | 109.5° |
| H40 | C28 | H41 | 109.5° | 109.4° |
| H42 | C29 | H43 | 109.5° | 109.5° |
| H42 | C29 | H44 | 109.5° | 109.5° |
| H43 | C29 | H44 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C25 | O7 | C17 | 179.3° | 180.0° |
| N2 | C25 | C17 | C18 | 12.9° | 79.2° |
| N2 | C25 | C17 | C16 | 170.0° | 100.8° |
| C25 | N2 | H30 | H31 | 180.0° | 179.9° |
| O7 | C25 | C17 | C18 | 166.4° | 100.8° |
| O7 | C25 | C17 | C16 | 10.7° | 79.2° |
| O7 | C25 | N2 | H30 | 0.0° | 175.2° |
| O7 | C25 | N2 | H31 | 180.0° | 4.7° |
| C25 | C17 | C18 | O6 | 19.8° | 0.9° |
| C25 | C17 | C18 | C16 | 177.4° | 180.0° |
| C25 | C17 | C18 | C19 | 162.0° | 179.1° |
| C25 | C17 | C16 | O1 | 25.4° | 7.7° |
| C25 | C17 | C16 | C15 | 155.3° | 172.2° |
| C17 | C25 | N2 | H30 | 179.3° | 4.8° |
| C17 | C25 | N2 | H31 | 0.7° | 175.3° |
| O6 | C18 | C17 | C19 | 178.2° | 180.0° |
| O6 | C18 | C17 | C16 | 162.8° | 179.1° |
| O6 | C18 | C19 | C20 | 0.2° | 35.3° |
| O6 | C18 | C19 | O5 | 116.0° | 81.6° |
| O6 | C18 | C19 | C14 | 126.2° | 160.6° |
| C18 | C17 | C16 | O1 | 151.8° | 172.2° |
| C18 | C17 | C16 | C15 | 27.5° | 7.8° |
| C17 | C18 | C19 | C20 | 178.1° | 144.8° |
| C17 | C18 | C19 | O5 | 65.7° | 98.4° |
| C17 | C18 | C19 | C14 | 52.2° | 19.5° |
| C17 | C18 | O6 | H29 | 180.0° | 4.2° |
| C16 | C17 | C18 | C19 | 15.4° | 1.0° |
| C17 | C16 | O1 | C15 | 179.3° | 179.9° |
| C17 | C16 | C15 | C14 | 27.6° | 32.2° |
| C17 | C16 | C15 | N3 | 156.9° | 88.3° |
| C17 | C16 | C15 | H23 | 86.9° | 152.6° |
| C18 | C19 | C20 | O2 | 83.4° | 63.7° |
| C18 | C19 | C20 | O5 | 116.4° | 116.9° |
| C18 | C19 | C20 | C14 | 123.8° | 126.2° |
| C18 | C19 | O5 | C14 | 116.5° | 121.8° |
| C18 | C19 | C20 | C21 | 96.9° | 115.7° |
| C18 | C19 | C14 | C15 | 48.5° | 44.3° |
| C18 | C19 | C14 | C13 | 75.9° | 81.1° |
| C18 | C19 | C14 | H22 | 168.3° | 162.6° |
| C18 | C19 | O5 | H28 | 107.5° | 60.0° |
| C19 | C18 | O6 | H29 | 1.7° | 175.8° |
| O2 | C20 | C19 | C21 | 179.7° | 179.4° |
| O2 | C20 | C19 | O5 | 33.0° | 53.2° |
| O2 | C20 | C19 | C14 | 152.8° | 170.2° |
| O2 | C20 | C21 | C22 | 4.1° | 3.3° |
| O2 | C20 | C21 | C12 | 173.5° | 179.8° |
| O1 | C16 | C15 | C14 | 151.7° | 147.9° |
| O1 | C16 | C15 | N3 | 22.4° | 91.6° |
| O1 | C16 | C15 | H23 | 93.8° | 27.5° |
| C16 | C15 | C14 | C19 | 12.1° | 50.3° |
| C16 | C15 | C14 | N3 | 129.4° | 120.5° |
| C16 | C15 | C14 | H23 | 114.7° | 120.4° |
| C16 | C15 | C14 | C13 | 111.9° | 75.0° |
| C16 | C15 | N3 | H23 | 116.1° | 119.1° |
| C16 | C15 | N3 | C27 | 64.6° | 51.1° |
| C16 | C15 | N3 | C26 | 158.0° | 175.0° |
| C16 | C15 | C14 | H22 | 132.1° | 168.3° |
| C20 | C19 | O5 | C14 | 121.2° | 120.0° |
| C19 | C20 | C21 | C22 | 176.2° | 177.3° |
| C19 | C20 | C21 | C12 | 6.1° | 0.4° |
| C20 | C19 | C14 | C15 | 176.1° | 168.7° |
| C20 | C19 | C14 | C13 | 51.7° | 43.3° |
| C20 | C19 | C14 | H22 | 64.1° | 73.1° |
| C20 | C19 | O5 | H28 | 14.9° | 58.3° |
| O5 | C19 | C20 | C21 | 146.7° | 127.5° |
| O5 | C19 | C14 | C15 | 66.7° | 73.9° |
| O5 | C19 | C14 | C13 | 168.9° | 160.7° |
| O5 | C19 | C14 | H22 | 53.1° | 44.3° |
| C14 | C19 | C20 | C21 | 26.9° | 10.5° |
| C19 | C14 | C15 | C13 | 124.0° | 125.3° |
| C19 | C14 | C15 | H22 | 120.0° | 118.0° |
| C19 | C14 | C13 | H22 | 115.8° | 116.2° |
| C19 | C14 | C15 | N3 | 117.3° | 70.2° |
| C19 | C14 | C13 | C12 | 59.3° | 67.8° |
| C19 | C14 | C13 | H20 | 61.2° | 172.5° |
| C19 | C14 | C13 | H21 | 179.8° | 52.1° |
| C19 | C14 | C15 | H23 | 126.8° | 170.7° |
| C14 | C19 | O5 | H28 | 136.0° | 178.2° |
| O4 | C22 | C21 | C20 | 3.7° | 3.4° |
| O4 | C22 | C21 | C23 | 178.3° | 178.8° |
| O4 | C22 | C21 | C12 | 174.1° | 173.6° |
| O4 | C22 | C23 | C10 | 160.8° | 165.5° |
| O4 | C22 | C23 | C24 | 19.3° | 14.0° |
| C20 | C21 | C22 | C12 | 177.7° | 177.0° |
| C20 | C21 | C22 | C23 | 178.1° | 177.8° |
| C20 | C21 | C12 | C11 | 138.8° | 143.3° |
| C20 | C21 | C12 | C13 | 12.2° | 23.0° |
| C20 | C21 | C12 | H19 | 107.1° | 96.3° |
| C22 | C21 | C12 | C11 | 43.4° | 39.8° |
| C21 | C22 | C23 | C10 | 20.9° | 15.7° |
| C21 | C22 | C23 | C24 | 159.1° | 164.8° |
| C22 | C21 | C12 | C13 | 170.0° | 160.1° |
| C22 | C21 | C12 | H19 | 70.8° | 80.6° |
| C21 | C22 | O4 | H27 | 1.5° | 86.0° |
| C23 | C22 | C21 | C12 | 4.2° | 5.3° |
| C22 | C23 | C10 | C11 | 1.6° | 1.0° |
| C22 | C23 | C10 | C24 | 179.9° | 179.5° |
| C22 | C23 | C24 | O3 | 0.3° | 0.6° |
| C22 | C23 | C10 | C9 | 179.9° | 179.6° |
| C22 | C23 | C24 | C7 | 179.0° | 179.5° |
| C23 | C22 | O4 | H27 | 179.9° | 95.2° |
| C21 | C12 | C11 | C13 | 128.2° | 120.0° |
| C21 | C12 | C11 | H19 | 114.3° | 120.4° |
| C21 | C12 | C11 | C10 | 60.4° | 52.8° |
| C21 | C12 | C13 | C14 | 39.4° | 54.9° |
| C21 | C12 | C13 | H19 | 119.3° | 119.4° |
| C21 | C12 | C11 | H17 | 59.9° | 173.0° |
| C21 | C12 | C11 | H18 | 179.4° | 67.4° |
| C21 | C12 | C13 | H20 | 81.1° | 174.6° |
| C21 | C12 | C13 | H21 | 159.8° | 65.1° |
| C12 | C11 | C10 | H17 | 120.3° | 120.2° |
| C12 | C11 | C10 | H18 | 120.2° | 120.2° |
| C11 | C12 | C13 | C14 | 162.6° | 175.8° |
| C12 | C11 | C10 | C23 | 39.5° | 35.3° |
| C11 | C12 | C13 | H19 | 117.5° | 119.6° |
| C12 | C11 | C10 | C9 | 138.7° | 145.4° |
| C12 | C11 | H17 | H18 | 119.2° | 119.7° |
| C11 | C12 | C13 | H20 | 42.1° | 64.5° |
| C11 | C12 | C13 | H21 | 76.9° | 55.9° |
| C11 | C10 | C23 | C9 | 178.3° | 179.4° |
| C11 | C10 | C23 | C24 | 178.3° | 178.5° |
| C10 | C11 | C12 | C13 | 171.4° | 172.8° |
| C11 | C10 | C9 | N4 | 2.1° | 0.9° |
| C11 | C10 | C9 | C8 | 177.6° | 179.1° |
| C10 | C11 | H17 | H18 | 119.3° | 119.7° |
| C10 | C11 | C12 | H19 | 53.9° | 67.6° |
| C15 | C14 | C13 | H22 | 115.9° | 116.8° |
| C14 | C15 | N3 | H23 | 115.6° | 119.2° |
| C15 | C14 | C13 | C12 | 172.4° | 165.2° |
| C14 | C15 | N3 | C27 | 63.8° | 172.8° |
| C14 | C15 | N3 | C26 | 73.6° | 63.3° |
| C15 | C14 | C13 | H20 | 67.1° | 45.5° |
| C15 | C14 | C13 | H21 | 51.9° | 74.9° |
| C13 | C14 | C15 | N3 | 118.7° | 164.5° |
| C14 | C13 | C12 | H20 | 120.5° | 119.7° |
| C14 | C13 | C12 | H21 | 120.5° | 119.9° |
| C14 | C13 | C12 | H19 | 79.9° | 64.5° |
| C14 | C13 | H20 | H21 | 118.5° | 120.5° |
| C13 | C14 | C15 | H23 | 2.7° | 45.4° |
| C10 | C23 | C24 | O3 | 179.8° | 178.9° |
| C10 | C23 | C24 | C7 | 1.1° | 1.0° |
| C23 | C10 | C9 | N4 | 179.7° | 179.7° |
| C23 | C10 | C9 | C8 | 0.6° | 0.3° |
| C23 | C10 | C11 | H17 | 80.7° | 155.4° |
| C23 | C10 | C11 | H18 | 159.8° | 85.0° |
| C23 | C24 | O3 | C7 | 178.7° | 179.9° |
| C24 | C23 | C10 | C9 | 0.0° | 0.9° |
| C23 | C24 | C7 | C8 | 2.7° | 0.5° |
| C23 | C24 | C7 | C6 | 178.5° | 179.8° |
| C23 | C24 | O3 | H26 | 180.0° | 90.1° |
| C15 | N3 | C27 | C26 | 138.7° | 124.0° |
| N3 | C15 | C14 | H22 | 2.7° | 47.8° |
| C15 | N3 | C26 | H33 | 180.0° | 53.4° |
| C15 | N3 | C26 | H34 | 60.0° | 173.4° |
| C15 | N3 | C26 | H35 | 60.0° | 66.7° |
| C15 | N3 | C27 | H36 | 180.0° | 60.0° |
| C15 | N3 | C27 | H37 | 60.0° | 180.0° |
| C15 | N3 | C27 | H38 | 60.0° | 60.0° |
| C28 | N4 | C9 | C10 | 62.4° | 116.0° |
| C28 | N4 | C9 | C29 | 162.6° | 123.9° |
| C28 | N4 | C9 | C8 | 118.0° | 63.9° |
| N4 | C28 | H39 | H40 | 120.0° | 120.0° |
| N4 | C28 | H39 | H41 | 120.0° | 120.1° |
| N4 | C28 | H40 | H41 | 120.0° | 120.0° |
| C28 | N4 | C29 | H42 | 180.0° | 180.0° |
| C28 | N4 | C29 | H43 | 60.0° | 60.0° |
| C28 | N4 | C29 | H44 | 60.0° | 60.0° |
| C13 | C12 | C11 | H17 | 68.3° | 67.0° |
| C13 | C12 | C11 | H18 | 51.1° | 52.6° |
| C12 | C13 | H20 | H21 | 118.5° | 120.3° |
| C12 | C13 | C14 | H22 | 56.5° | 48.4° |
| O3 | C24 | C7 | C8 | 178.6° | 179.3° |
| O3 | C24 | C7 | C6 | 2.8° | 0.3° |
| C10 | C9 | N4 | C8 | 179.7° | 180.0° |
| C10 | C9 | C8 | C7 | 2.3° | 0.2° |
| C10 | C9 | N4 | C29 | 135.0° | 120.1° |
| C10 | C9 | C8 | H16 | 177.7° | 179.8° |
| C9 | C10 | C11 | H17 | 101.1° | 25.2° |
| C9 | C10 | C11 | H18 | 18.4° | 94.4° |
| C24 | C7 | C8 | C9 | 3.3° | 0.0° |
| C24 | C7 | C8 | C6 | 175.9° | 179.7° |
| C24 | C7 | C6 | N1 | 103.2° | 79.7° |
| C24 | C7 | C6 | H14 | 17.3° | 40.3° |
| C24 | C7 | C6 | H15 | 136.4° | 160.3° |
| C24 | C7 | C8 | H16 | 176.6° | 179.9° |
| C7 | C24 | O3 | H26 | 1.2° | 89.8° |
| N4 | C9 | C8 | C7 | 178.0° | 179.9° |
| N4 | C9 | C8 | H16 | 2.0° | 0.2° |
| C9 | N4 | C28 | H39 | 180.0° | 63.9° |
| C9 | N4 | C28 | H40 | 60.0° | 176.1° |
| C9 | N4 | C28 | H41 | 60.0° | 56.1° |
| C9 | N4 | C29 | H42 | 16.5° | 56.1° |
| C9 | N4 | C29 | H43 | 103.5° | 176.1° |
| C9 | N4 | C29 | H44 | 136.5° | 63.9° |
| C9 | C8 | C7 | H16 | 180.0° | 180.0° |
| C9 | C8 | C7 | C6 | 179.3° | 179.6° |
| C8 | C9 | N4 | C29 | 44.7° | 60.0° |
| C8 | C7 | C6 | N1 | 72.6° | 100.0° |
| C8 | C7 | C6 | H14 | 166.9° | 140.0° |
| C8 | C7 | C6 | H15 | 47.8° | 20.0° |
| C7 | C6 | N1 | H14 | 120.4° | 120.0° |
| C7 | C6 | N1 | H15 | 120.4° | 120.0° |
| C7 | C6 | N1 | C5 | 53.6° | 180.0° |
| C7 | C6 | N1 | H12 | 174.2° | 56.0° |
| C7 | C6 | H14 | H15 | 118.6° | 120.0° |
| C6 | C7 | C8 | H16 | 0.7° | 0.4° |
| C29 | N4 | C28 | H39 | 16.0° | 60.0° |
| C29 | N4 | C28 | H40 | 103.9° | 60.0° |
| C29 | N4 | C28 | H41 | 136.1° | 180.0° |
| N4 | C29 | H42 | H43 | 120.0° | 120.0° |
| N4 | C29 | H42 | H44 | 120.0° | 120.0° |
| N4 | C29 | H43 | H44 | 120.0° | 120.0° |
| C27 | N3 | C15 | H23 | 179.3° | 68.1° |
| C27 | N3 | C26 | H33 | 39.7° | 70.6° |
| C27 | N3 | C26 | H34 | 80.3° | 49.4° |
| C27 | N3 | C26 | H35 | 159.7° | 169.3° |
| N3 | C27 | H36 | H37 | 120.0° | 120.0° |
| N3 | C27 | H36 | H38 | 120.0° | 120.0° |
| N3 | C27 | H37 | H38 | 120.0° | 120.0° |
| C26 | N3 | C15 | H23 | 41.9° | 55.9° |
| N3 | C26 | H33 | H34 | 120.0° | 120.0° |
| N3 | C26 | H33 | H35 | 120.0° | 120.0° |
| N3 | C26 | H34 | H35 | 120.0° | 120.0° |
| C26 | N3 | C27 | H36 | 41.2° | 176.0° |
| C26 | N3 | C27 | H37 | 161.3° | 56.0° |
| C26 | N3 | C27 | H38 | 78.7° | 64.0° |
| C6 | N1 | C5 | H12 | 120.6° | 123.9° |
| C6 | N1 | C5 | C2 | 167.3° | 180.0° |
| C6 | N1 | C5 | H10 | 71.6° | 60.0° |
| C6 | N1 | C5 | H11 | 46.3° | 60.1° |
| N1 | C6 | H14 | H15 | 118.7° | 120.0° |
| N1 | C5 | C2 | H10 | 121.0° | 120.1° |
| N1 | C5 | C2 | H11 | 121.0° | 119.9° |
| N1 | C5 | C2 | C4 | 55.1° | 60.0° |
| N1 | C5 | C2 | C3 | 174.5° | 179.9° |
| N1 | C5 | C2 | C1 | 66.1° | 60.1° |
| N1 | C5 | H10 | H11 | 116.8° | 120.0° |
| C5 | N1 | C6 | H14 | 66.8° | 59.9° |
| C5 | N1 | C6 | H15 | 174.0° | 60.1° |
| C5 | C2 | C4 | C3 | 117.4° | 119.9° |
| C5 | C2 | C4 | C1 | 119.4° | 120.0° |
| C5 | C2 | C3 | C1 | 117.5° | 119.9° |
| C5 | C2 | C1 | H1 | 180.0° | 180.0° |
| C5 | C2 | C1 | H2 | 60.0° | 60.0° |
| C5 | C2 | C1 | H3 | 60.0° | 60.0° |
| C5 | C2 | C3 | H4 | 180.0° | 60.1° |
| C5 | C2 | C3 | H5 | 60.0° | 60.0° |
| C5 | C2 | C3 | H6 | 60.0° | 180.0° |
| C5 | C2 | C4 | H7 | 180.0° | 180.0° |
| C5 | C2 | C4 | H8 | 60.0° | 60.1° |
| C5 | C2 | C4 | H9 | 60.0° | 60.0° |
| C2 | C5 | H10 | H11 | 116.8° | 120.0° |
| C2 | C5 | N1 | H12 | 46.7° | 56.1° |
| C4 | C2 | C3 | C1 | 123.2° | 120.1° |
| C4 | C2 | C1 | H1 | 59.5° | 60.0° |
| C4 | C2 | C1 | H2 | 60.5° | 180.0° |
| C4 | C2 | C1 | H3 | 179.5° | 60.0° |
| C4 | C2 | C3 | H4 | 60.7° | 59.9° |
| C4 | C2 | C3 | H5 | 179.3° | 180.0° |
| C4 | C2 | C3 | H6 | 59.3° | 60.1° |
| C2 | C4 | H7 | H8 | 120.0° | 119.9° |
| C2 | C4 | H7 | H9 | 120.0° | 120.1° |
| C2 | C4 | H8 | H9 | 120.0° | 120.1° |
| C4 | C2 | C5 | H10 | 176.1° | 180.0° |
| C4 | C2 | C5 | H11 | 65.9° | 59.9° |
| C3 | C2 | C1 | H1 | 63.1° | 60.1° |
| C3 | C2 | C1 | H2 | 176.8° | 59.9° |
| C3 | C2 | C1 | H3 | 56.9° | 180.0° |
| C2 | C3 | H4 | H5 | 120.0° | 120.0° |
| C2 | C3 | H4 | H6 | 120.0° | 119.9° |
| C2 | C3 | H5 | H6 | 120.0° | 119.9° |
| C3 | C2 | C4 | H7 | 62.6° | 60.1° |
| C3 | C2 | C4 | H8 | 57.4° | 180.0° |
| C3 | C2 | C4 | H9 | 177.4° | 60.0° |
| C3 | C2 | C5 | H10 | 64.5° | 60.0° |
| C3 | C2 | C5 | H11 | 53.4° | 60.0° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 120.1° |
| C1 | C2 | C3 | H4 | 62.5° | 180.0° |
| C1 | C2 | C3 | H5 | 57.5° | 59.9° |
| C1 | C2 | C3 | H6 | 177.5° | 60.0° |
| C1 | C2 | C4 | H7 | 60.6° | 60.0° |
| C1 | C2 | C4 | H8 | 179.4° | 59.9° |
| C1 | C2 | C4 | H9 | 59.3° | 180.0° |
| C1 | C2 | C5 | H10 | 55.0° | 60.0° |
| C1 | C2 | C5 | H11 | 172.9° | 180.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H4 | C3 | H5 | H6 | 120.0° | 120.1° |
| H7 | C4 | H8 | H9 | 120.0° | 120.0° |
| H10 | C5 | N1 | H12 | 167.8° | 64.0° |
| H11 | C5 | N1 | H12 | 74.3° | 176.0° |
| H12 | N1 | C6 | H14 | 53.8° | 64.0° |
| H12 | N1 | C6 | H15 | 65.3° | 176.0° |
| H17 | C11 | C12 | H19 | 174.1° | 52.6° |
| H18 | C11 | C12 | H19 | 66.4° | 172.2° |
| H19 | C12 | C13 | H20 | 159.5° | 55.2° |
| H19 | C12 | C13 | H21 | 40.5° | 175.5° |
| H20 | C13 | C14 | H22 | 177.0° | 71.3° |
| H21 | C13 | C14 | H22 | 64.0° | 168.3° |
| H22 | C14 | C15 | H23 | 113.2° | 71.4° |
| H33 | C26 | H34 | H35 | 120.0° | 120.0° |
| H36 | C27 | H37 | H38 | 119.9° | 120.0° |
| H39 | C28 | H40 | H41 | 120.0° | 120.0° |
| H42 | C29 | H43 | H44 | 120.0° | 120.0° |
