TV7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C22 | doub | 1.21Å | 1.23Å | |
| O | C2 | sing | 1.43Å | 1.41Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C24 | C25 | sing | 1.53Å | 1.49Å | |
| C22 | C23 | sing | 1.51Å | 1.51Å | |
| C22 | N3 | sing | 1.35Å | 1.34Å | |
| N2 | C9 | doub | 1.31Å | 1.32Å | Aromatic |
| N2 | C21 | sing | 1.34Å | 1.37Å | Aromatic |
| C8 | N3 | sing | 1.46Å | 1.46Å | |
| C8 | C9 | sing | 1.51Å | 1.50Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C23 | C25 | sing | 1.53Å | 1.52Å | |
| O1 | C2 | sing | 1.43Å | 1.41Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C3 | sing | 1.53Å | 1.54Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C25 | C31 | sing | 1.53Å | 1.53Å | |
| C9 | N | sing | 1.35Å | 1.36Å | Aromatic |
| C21 | C10 | doub | 1.36Å | 1.38Å | Aromatic |
| C1 | C | sing | 1.53Å | 1.53Å | |
| C27 | N4 | sing | 1.47Å | 1.50Å | |
| C31 | C30 | sing | 1.53Å | 1.52Å | |
| N | C10 | sing | 1.38Å | 1.36Å | Aromatic |
| C10 | C11 | sing | 1.48Å | 1.47Å | |
| O2 | C20 | sing | 1.43Å | 1.43Å | |
| O2 | C19 | sing | 1.36Å | 1.34Å | |
| N4 | C30 | sing | 1.47Å | 1.50Å | |
| N4 | C28 | sing | 1.47Å | 1.50Å | |
| C11 | C19 | doub | 1.41Å | 1.42Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.38Å | Aromatic |
| C19 | N1 | sing | 1.31Å | 1.30Å | Aromatic |
| C29 | C28 | sing | 1.53Å | 1.51Å | |
| N1 | C18 | doub | 1.34Å | 1.37Å | Aromatic |
| C12 | C13 | doub | 1.41Å | 1.41Å | Aromatic |
| C18 | C13 | sing | 1.42Å | 1.41Å | Aromatic |
| C18 | C17 | sing | 1.41Å | 1.42Å | Aromatic |
| C13 | C14 | sing | 1.40Å | 1.42Å | Aromatic |
| C17 | C16 | doub | 1.36Å | 1.37Å | Aromatic |
| C14 | C15 | doub | 1.36Å | 1.38Å | Aromatic |
| C16 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.08Å | 1.08Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | 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 | |
| C7 | H26 | sing | 1.09Å | 1.10Å | |
| C7 | H27 | sing | 1.09Å | 1.10Å | |
| C8 | H28 | sing | 1.09Å | 1.10Å | |
| C14 | H29 | sing | 1.08Å | 1.08Å | |
| N3 | H30 | sing | 0.97Å | 1.00Å | |
| O1 | H31 | sing | 0.97Å | 0.95Å | |
| C15 | H32 | sing | 1.08Å | 1.08Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| C31 | H34 | sing | 1.09Å | 1.10Å | |
| C31 | H35 | sing | 1.09Å | 1.10Å | |
| C30 | H36 | sing | 1.09Å | 1.10Å | |
| C30 | H37 | sing | 1.09Å | 1.10Å | |
| C27 | H39 | sing | 1.09Å | 1.10Å | |
| C27 | H40 | sing | 1.09Å | 1.10Å | |
| O | H41 | sing | 0.97Å | 0.95Å | |
| C | H42 | sing | 1.09Å | 1.10Å | |
| C | H43 | sing | 1.09Å | 1.10Å | |
| C | H44 | sing | 1.09Å | 1.10Å | |
| N | H45 | sing | 0.97Å | 1.00Å | |
| C17 | H46 | sing | 1.08Å | 1.08Å | |
| C16 | H47 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C22 | C23 | 122.4° | 120.0° |
| O3 | C22 | N3 | 122.9° | 120.0° |
| O | C2 | O1 | 110.1° | 109.5° |
| O | C2 | C3 | 111.4° | 109.4° |
| O | C2 | C1 | 104.5° | 109.4° |
| C2 | O | H41 | 109.5° | 114.0° |
| C23 | C24 | C25 | 60.4° | 60.0° |
| C24 | C23 | C22 | 120.7° | 117.5° |
| C24 | C23 | C25 | 58.5° | 59.9° |
| C23 | C24 | H17 | 119.9° | 117.5° |
| C23 | C24 | H18 | 120.0° | 117.5° |
| C24 | C23 | H33 | 115.7° | 117.5° |
| C24 | C25 | C23 | 61.1° | 60.1° |
| C24 | C25 | C26 | 120.2° | 117.9° |
| C24 | C25 | C31 | 119.7° | 117.8° |
| C25 | C24 | H17 | 119.9° | 117.5° |
| C25 | C24 | H18 | 120.0° | 117.5° |
| C23 | C22 | N3 | 114.7° | 120.0° |
| C22 | C23 | C25 | 117.9° | 117.5° |
| C22 | C23 | H33 | 116.0° | 115.5° |
| C22 | N3 | C8 | 121.2° | 120.0° |
| C22 | N3 | H30 | 119.4° | 119.9° |
| C9 | N2 | C21 | 104.7° | 109.5° |
| N2 | C9 | C8 | 123.5° | 125.5° |
| N2 | C9 | N | 111.7° | 109.0° |
| N2 | C21 | C10 | 111.1° | 107.9° |
| N2 | C21 | H16 | 124.5° | 126.1° |
| N3 | C8 | C9 | 109.1° | 109.5° |
| N3 | C8 | C7 | 109.4° | 109.5° |
| N3 | C8 | H28 | 109.7° | 109.4° |
| C8 | N3 | H30 | 119.4° | 120.0° |
| C9 | C8 | C7 | 110.7° | 109.5° |
| C8 | C9 | N | 124.8° | 125.5° |
| C9 | C8 | H28 | 109.1° | 109.5° |
| C8 | C7 | C6 | 112.3° | 109.4° |
| C8 | C7 | H26 | 108.8° | 109.5° |
| C8 | C7 | H27 | 108.8° | 109.4° |
| C7 | C8 | H28 | 108.8° | 109.5° |
| C23 | C25 | C26 | 123.1° | 117.8° |
| C23 | C25 | C31 | 117.7° | 117.8° |
| C25 | C23 | H33 | 115.9° | 117.5° |
| O1 | C2 | C3 | 107.2° | 109.5° |
| O1 | C2 | C1 | 114.0° | 109.5° |
| C2 | O1 | H31 | 109.5° | 114.0° |
| C7 | C6 | C5 | 113.2° | 109.4° |
| C7 | C6 | H10 | 108.5° | 109.5° |
| C7 | C6 | H11 | 108.5° | 109.4° |
| C6 | C7 | H26 | 108.8° | 109.5° |
| C6 | C7 | H27 | 108.8° | 109.4° |
| C6 | C5 | C4 | 115.7° | 109.5° |
| C6 | C5 | H8 | 107.9° | 109.5° |
| C6 | C5 | H9 | 107.9° | 109.4° |
| C5 | C6 | H10 | 108.5° | 109.5° |
| C5 | C6 | H11 | 108.5° | 109.4° |
| C5 | C4 | C3 | 111.6° | 109.5° |
| C5 | C4 | H6 | 108.9° | 109.5° |
| C5 | C4 | H7 | 108.9° | 109.4° |
| C4 | C5 | H8 | 107.9° | 109.5° |
| C4 | C5 | H9 | 107.9° | 109.4° |
| C4 | C3 | C2 | 116.1° | 109.5° |
| C4 | C3 | H4 | 107.8° | 109.4° |
| C4 | C3 | H5 | 107.8° | 109.5° |
| C3 | C4 | H6 | 108.9° | 109.5° |
| C3 | C4 | H7 | 108.9° | 109.4° |
| C25 | C26 | C27 | 112.1° | 108.6° |
| C26 | C25 | C31 | 108.6° | 114.7° |
| C25 | C26 | H19 | 108.8° | 109.6° |
| C25 | C26 | H20 | 108.8° | 109.6° |
| C26 | C27 | N4 | 110.9° | 109.5° |
| C27 | C26 | H19 | 108.8° | 109.6° |
| C27 | C26 | H20 | 108.8° | 109.7° |
| C26 | C27 | H39 | 109.1° | 109.4° |
| C26 | C27 | H40 | 109.1° | 109.4° |
| C3 | C2 | C1 | 109.7° | 109.5° |
| C2 | C3 | H4 | 107.8° | 109.4° |
| C2 | C3 | H5 | 107.8° | 109.5° |
| C2 | C1 | C | 114.8° | 109.5° |
| C2 | C1 | H1 | 108.1° | 109.4° |
| C2 | C1 | H2 | 108.1° | 109.5° |
| C25 | C31 | C30 | 112.5° | 108.7° |
| C25 | C31 | H34 | 108.7° | 109.6° |
| C25 | C31 | H35 | 108.7° | 109.6° |
| C9 | N | C10 | 108.1° | 107.1° |
| C9 | N | H45 | 126.0° | 126.4° |
| C21 | C10 | N | 104.5° | 106.4° |
| C21 | C10 | C11 | 131.5° | 126.8° |
| C10 | C21 | H16 | 124.5° | 126.0° |
| C | C1 | H1 | 108.1° | 109.5° |
| C | C1 | H2 | 108.1° | 109.5° |
| C1 | C | H42 | 109.5° | 109.4° |
| C1 | C | H43 | 109.5° | 109.5° |
| C1 | C | H44 | 109.5° | 109.4° |
| C27 | N4 | C30 | 111.9° | 111.6° |
| C27 | N4 | C28 | 112.4° | 111.0° |
| N4 | C27 | H39 | 109.1° | 109.5° |
| N4 | C27 | H40 | 109.1° | 109.5° |
| C31 | C30 | N4 | 111.2° | 109.5° |
| C30 | C31 | H34 | 108.7° | 109.6° |
| C30 | C31 | H35 | 108.7° | 109.6° |
| C31 | C30 | H36 | 109.1° | 109.5° |
| C31 | C30 | H37 | 109.0° | 109.5° |
| N | C10 | C11 | 124.0° | 126.8° |
| C10 | N | H45 | 126.0° | 126.4° |
| C10 | C11 | C19 | 125.5° | 120.3° |
| C10 | C11 | C12 | 117.8° | 120.3° |
| C20 | O2 | C19 | 117.5° | 117.0° |
| O2 | C20 | H13 | 109.5° | 109.5° |
| O2 | C20 | H14 | 109.5° | 109.5° |
| O2 | C20 | H15 | 109.5° | 109.5° |
| O2 | C19 | C11 | 116.1° | 119.3° |
| O2 | C19 | N1 | 118.5° | 119.3° |
| C30 | N4 | C28 | 111.9° | 111.0° |
| N4 | C30 | H36 | 109.0° | 109.4° |
| N4 | C30 | H37 | 109.0° | 109.5° |
| N4 | C28 | C29 | 114.1° | 109.5° |
| N4 | C28 | H21 | 108.3° | 109.5° |
| N4 | C28 | H22 | 108.3° | 109.4° |
| C19 | C11 | C12 | 116.7° | 119.5° |
| C11 | C19 | N1 | 125.3° | 121.4° |
| C11 | C12 | C13 | 120.3° | 118.0° |
| C11 | C12 | H12 | 119.8° | 121.0° |
| C19 | N1 | C18 | 118.0° | 121.6° |
| C29 | C28 | H21 | 108.3° | 109.5° |
| C29 | C28 | H22 | 108.3° | 109.5° |
| C28 | C29 | H23 | 109.5° | 109.5° |
| C28 | C29 | H24 | 109.5° | 109.5° |
| C28 | C29 | H25 | 109.5° | 109.4° |
| N1 | C18 | C13 | 122.0° | 120.2° |
| N1 | C18 | C17 | 118.8° | 120.7° |
| C12 | C13 | C18 | 117.6° | 119.2° |
| C12 | C13 | C14 | 123.5° | 121.1° |
| C13 | C12 | H12 | 119.8° | 121.0° |
| C13 | C18 | C17 | 119.2° | 119.0° |
| C18 | C13 | C14 | 118.9° | 119.6° |
| C18 | C17 | C16 | 120.3° | 119.8° |
| C18 | C17 | H46 | 119.8° | 120.1° |
| C13 | C14 | C15 | 120.4° | 119.7° |
| C13 | C14 | H29 | 119.8° | 120.2° |
| C17 | C16 | C15 | 120.7° | 121.1° |
| C16 | C17 | H46 | 119.8° | 120.1° |
| C17 | C16 | H47 | 119.6° | 119.5° |
| C14 | C15 | C16 | 120.5° | 120.8° |
| C15 | C14 | H29 | 119.8° | 120.2° |
| C14 | C15 | H32 | 119.8° | 119.6° |
| C16 | C15 | H32 | 119.7° | 119.6° |
| C15 | C16 | H47 | 119.6° | 119.4° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H4 | C3 | H5 | 109.5° | 109.5° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H8 | C5 | H9 | 109.5° | 109.5° |
| H10 | C6 | H11 | 109.4° | 109.5° |
| H13 | C20 | H14 | 109.5° | 109.4° |
| H13 | C20 | H15 | 109.5° | 109.4° |
| H14 | C20 | H15 | 109.5° | 109.5° |
| H17 | C24 | H18 | 109.5° | 115.6° |
| H19 | C26 | H20 | 109.5° | 109.8° |
| H21 | C28 | H22 | 109.5° | 109.4° |
| H23 | C29 | H24 | 109.5° | 109.5° |
| H23 | C29 | H25 | 109.5° | 109.5° |
| H24 | C29 | H25 | 109.5° | 109.4° |
| H26 | C7 | H27 | 109.5° | 109.5° |
| H34 | C31 | H35 | 109.4° | 109.7° |
| H36 | C30 | H37 | 109.5° | 109.5° |
| H39 | C27 | H40 | 109.5° | 109.5° |
| H42 | C | H43 | 109.5° | 109.5° |
| H42 | C | H44 | 109.4° | 109.5° |
| H43 | C | H44 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C22 | C23 | C24 | 3.8° | 2.0° |
| O3 | C22 | C23 | N3 | 178.0° | 179.9° |
| O3 | C22 | N3 | C8 | 0.3° | 0.1° |
| O3 | C22 | C23 | C25 | 64.3° | 66.5° |
| O3 | C22 | N3 | H30 | 179.7° | 180.0° |
| O3 | C22 | C23 | H33 | 152.0° | 147.8° |
| O | C2 | O1 | C3 | 121.3° | 120.0° |
| O | C2 | O1 | C1 | 117.1° | 120.0° |
| O | C2 | C3 | C4 | 58.1° | 60.1° |
| O | C2 | C3 | C1 | 115.2° | 120.0° |
| O | C2 | C1 | C | 179.6° | 60.0° |
| O | C2 | C1 | H1 | 59.6° | 179.9° |
| O | C2 | C1 | H2 | 58.8° | 60.0° |
| O | C2 | C3 | H4 | 62.8° | 180.0° |
| O | C2 | C3 | H5 | 179.1° | 60.0° |
| O | C2 | O1 | H31 | 180.0° | 180.0° |
| C23 | C24 | C25 | H17 | 109.6° | 107.5° |
| C23 | C24 | C25 | H18 | 109.6° | 107.4° |
| C24 | C23 | C22 | C25 | 68.1° | 68.5° |
| C24 | C23 | C22 | H33 | 148.2° | 145.8° |
| C24 | C23 | C22 | N3 | 178.2° | 178.1° |
| C24 | C23 | C25 | H33 | 105.5° | 107.5° |
| C24 | C23 | C25 | C26 | 109.0° | 107.9° |
| C23 | C24 | C25 | C31 | 107.3° | 107.7° |
| C23 | C24 | H17 | H18 | 144.5° | 145.7° |
| C24 | C25 | C26 | C31 | 143.1° | 145.6° |
| C24 | C25 | C26 | C27 | 161.1° | 163.0° |
| C24 | C25 | C31 | C30 | 161.7° | 163.0° |
| C25 | C24 | H17 | H18 | 144.6° | 145.7° |
| C24 | C25 | C26 | H19 | 78.5° | 77.3° |
| C24 | C25 | C26 | H20 | 40.7° | 43.2° |
| C24 | C25 | C31 | H34 | 41.3° | 43.2° |
| C24 | C25 | C31 | H35 | 77.8° | 77.3° |
| C23 | C22 | N3 | C8 | 178.3° | 180.0° |
| C22 | C23 | C25 | H33 | 143.8° | 145.0° |
| C22 | C23 | C25 | C26 | 1.7° | 0.4° |
| C22 | C23 | C25 | C31 | 138.8° | 144.7° |
| C22 | C23 | C24 | H17 | 144.6° | 0.0° |
| C22 | C23 | C24 | H18 | 3.7° | 145.0° |
| C23 | C22 | N3 | H30 | 1.7° | 0.1° |
| C22 | N3 | C8 | H30 | 180.0° | 179.9° |
| C22 | N3 | C8 | C9 | 86.8° | 155.0° |
| C22 | N3 | C8 | C7 | 151.9° | 84.9° |
| N3 | C22 | C23 | C25 | 113.7° | 113.4° |
| C22 | N3 | C8 | H28 | 32.7° | 35.1° |
| N3 | C22 | C23 | H33 | 30.1° | 32.3° |
| N2 | C9 | C8 | N3 | 135.0° | 175.1° |
| N2 | C9 | C8 | N | 178.4° | 180.0° |
| N2 | C9 | C8 | C7 | 104.6° | 55.0° |
| C9 | N2 | C21 | C10 | 0.6° | 0.0° |
| N2 | C9 | N | C10 | 0.2° | 0.0° |
| C9 | N2 | C21 | H16 | 179.4° | 180.0° |
| N2 | C9 | C8 | H28 | 15.1° | 65.0° |
| N2 | C9 | N | H45 | 179.8° | 179.9° |
| C21 | N2 | C9 | C8 | 179.0° | 180.0° |
| C21 | N2 | C9 | N | 0.4° | 0.0° |
| N2 | C21 | C10 | H16 | 180.0° | 179.9° |
| N2 | C21 | C10 | N | 0.5° | 0.0° |
| N2 | C21 | C10 | C11 | 177.7° | 180.0° |
| N3 | C8 | C9 | C7 | 120.4° | 120.1° |
| N3 | C8 | C9 | H28 | 119.9° | 119.9° |
| N3 | C8 | C7 | H28 | 119.8° | 120.0° |
| N3 | C8 | C7 | C6 | 174.9° | 64.9° |
| N3 | C8 | C9 | N | 46.7° | 4.9° |
| N3 | C8 | C7 | H26 | 54.5° | 175.0° |
| N3 | C8 | C7 | H27 | 64.6° | 55.0° |
| C9 | C8 | C7 | H28 | 119.9° | 120.0° |
| C9 | C8 | C7 | C6 | 64.8° | 175.0° |
| C8 | C9 | N | C10 | 178.7° | 180.0° |
| C9 | C8 | C7 | H26 | 174.8° | 54.9° |
| C9 | C8 | C7 | H27 | 55.7° | 65.0° |
| C9 | C8 | N3 | H30 | 93.2° | 25.1° |
| C8 | C9 | N | H45 | 1.3° | 0.1° |
| C8 | C7 | C6 | H26 | 120.4° | 120.1° |
| C8 | C7 | C6 | H27 | 120.4° | 119.9° |
| C8 | C7 | C6 | C5 | 179.5° | 180.0° |
| C7 | C8 | C9 | N | 73.8° | 125.0° |
| C8 | C7 | C6 | H10 | 58.9° | 60.0° |
| C8 | C7 | C6 | H11 | 59.9° | 60.1° |
| C8 | C7 | H26 | H27 | 118.7° | 120.0° |
| C7 | C8 | N3 | H30 | 28.1° | 95.0° |
| C23 | C25 | C26 | C31 | 143.6° | 145.3° |
| C23 | C25 | C26 | C27 | 87.9° | 94.0° |
| C23 | C25 | C31 | C30 | 90.9° | 94.0° |
| C23 | C25 | C26 | H19 | 151.8° | 146.3° |
| C23 | C25 | C26 | H20 | 32.5° | 25.8° |
| C23 | C25 | C31 | H34 | 29.6° | 25.8° |
| C23 | C25 | C31 | H35 | 148.7° | 146.3° |
| O1 | C2 | C3 | C4 | 62.4° | 59.9° |
| O1 | C2 | C3 | C1 | 124.3° | 120.1° |
| O1 | C2 | C1 | C | 60.2° | 60.0° |
| O1 | C2 | C1 | H1 | 60.6° | 60.1° |
| O1 | C2 | C1 | H2 | 179.1° | 180.0° |
| O1 | C2 | C3 | H4 | 176.7° | 60.0° |
| O1 | C2 | C3 | H5 | 58.6° | 180.0° |
| O1 | C2 | O | H41 | 180.0° | 179.9° |
| C7 | C6 | C5 | H10 | 120.6° | 120.0° |
| C7 | C6 | C5 | H11 | 120.6° | 119.9° |
| C7 | C6 | C5 | C4 | 173.6° | 180.0° |
| C7 | C6 | C5 | H8 | 52.7° | 59.9° |
| C7 | C6 | C5 | H9 | 65.5° | 60.1° |
| C7 | C6 | H10 | H11 | 118.3° | 120.0° |
| C6 | C7 | H26 | H27 | 118.7° | 120.0° |
| C6 | C7 | C8 | H28 | 55.1° | 55.0° |
| C6 | C5 | C4 | H8 | 120.9° | 120.1° |
| C6 | C5 | C4 | H9 | 120.9° | 119.9° |
| C6 | C5 | C4 | C3 | 173.6° | 180.0° |
| C6 | C5 | C4 | H6 | 53.3° | 59.9° |
| C6 | C5 | C4 | H7 | 66.1° | 60.1° |
| C6 | C5 | H8 | H9 | 117.2° | 120.0° |
| C5 | C6 | H10 | H11 | 118.3° | 120.0° |
| C5 | C6 | C7 | H26 | 60.1° | 59.9° |
| C5 | C6 | C7 | H27 | 59.0° | 60.1° |
| C5 | C4 | C3 | H6 | 120.3° | 120.0° |
| C5 | C4 | C3 | H7 | 120.3° | 119.9° |
| C5 | C4 | C3 | C2 | 157.2° | 180.0° |
| C5 | C4 | C3 | H4 | 36.2° | 60.0° |
| C5 | C4 | C3 | H5 | 81.9° | 59.9° |
| C5 | C4 | H6 | H7 | 119.0° | 120.0° |
| C4 | C5 | H8 | H9 | 117.2° | 120.0° |
| C4 | C5 | C6 | H10 | 65.8° | 60.0° |
| C4 | C5 | C6 | H11 | 53.1° | 60.1° |
| C4 | C3 | C2 | H4 | 121.0° | 120.0° |
| C4 | C3 | C2 | H5 | 120.9° | 120.1° |
| C4 | C3 | C2 | C1 | 173.3° | 180.0° |
| C4 | C3 | H4 | H5 | 117.0° | 120.0° |
| C3 | C4 | H6 | H7 | 119.0° | 120.0° |
| C3 | C4 | C5 | H8 | 65.5° | 59.9° |
| C3 | C4 | C5 | H9 | 52.7° | 60.1° |
| C25 | C26 | C27 | H19 | 120.4° | 119.7° |
| C25 | C26 | C27 | H20 | 120.4° | 119.8° |
| C25 | C26 | C27 | N4 | 56.9° | 55.6° |
| C26 | C25 | C31 | C30 | 55.0° | 51.4° |
| C26 | C25 | C24 | H17 | 136.8° | 0.2° |
| C26 | C25 | C24 | H18 | 4.1° | 144.8° |
| C25 | C26 | H19 | H20 | 118.8° | 120.4° |
| C26 | C25 | C23 | H33 | 145.5° | 144.6° |
| C26 | C25 | C31 | H34 | 175.4° | 171.2° |
| C26 | C25 | C31 | H35 | 65.5° | 68.4° |
| C25 | C26 | C27 | H39 | 177.1° | 175.6° |
| C25 | C26 | C27 | H40 | 63.3° | 64.4° |
| C27 | C26 | C25 | C31 | 55.8° | 51.4° |
| C26 | C27 | N4 | H39 | 120.2° | 120.0° |
| C26 | C27 | N4 | H40 | 120.2° | 119.9° |
| C26 | C27 | N4 | C30 | 55.5° | 64.8° |
| C26 | C27 | N4 | C28 | 177.5° | 170.8° |
| C27 | C26 | H19 | H20 | 118.8° | 120.5° |
| C26 | C27 | H39 | H40 | 119.4° | 119.9° |
| C3 | C2 | C1 | C | 60.1° | 180.0° |
| C3 | C2 | C1 | H1 | 179.1° | 60.0° |
| C3 | C2 | C1 | H2 | 60.6° | 59.9° |
| C2 | C3 | H4 | H5 | 117.0° | 120.0° |
| C2 | C3 | C4 | H6 | 82.5° | 60.0° |
| C2 | C3 | C4 | H7 | 36.9° | 60.1° |
| C3 | C2 | O1 | H31 | 58.7° | 60.1° |
| C3 | C2 | O | H41 | 61.2° | 59.9° |
| C2 | C1 | C | H1 | 120.8° | 120.0° |
| C2 | C1 | C | H2 | 120.8° | 120.0° |
| C2 | C1 | H1 | H2 | 117.6° | 119.9° |
| C1 | C2 | C3 | H4 | 52.4° | 60.0° |
| C1 | C2 | C3 | H5 | 65.7° | 60.0° |
| C1 | C2 | O1 | H31 | 62.9° | 60.0° |
| C1 | C2 | O | H41 | 57.2° | 60.1° |
| C2 | C1 | C | H42 | 180.0° | 180.0° |
| C2 | C1 | C | H43 | 60.0° | 60.0° |
| C2 | C1 | C | H44 | 60.0° | 60.0° |
| C25 | C31 | C30 | H34 | 120.5° | 119.8° |
| C25 | C31 | C30 | H35 | 120.5° | 119.7° |
| C25 | C31 | C30 | N4 | 55.2° | 55.6° |
| C31 | C25 | C24 | H17 | 2.3° | 144.8° |
| C31 | C25 | C24 | H18 | 143.1° | 0.3° |
| C31 | C25 | C26 | H19 | 64.6° | 68.3° |
| C31 | C25 | C26 | H20 | 176.2° | 171.1° |
| C31 | C25 | C23 | H33 | 5.0° | 0.3° |
| C25 | C31 | H34 | H35 | 118.6° | 120.4° |
| C25 | C31 | C30 | H36 | 65.0° | 64.4° |
| C25 | C31 | C30 | H37 | 175.4° | 175.6° |
| C9 | N | C10 | C21 | 0.2° | 0.0° |
| C9 | N | C10 | H45 | 180.0° | 179.9° |
| C9 | N | C10 | C11 | 177.7° | 180.0° |
| N | C9 | C8 | H28 | 166.5° | 115.0° |
| C21 | C10 | N | C11 | 177.5° | 180.0° |
| C21 | C10 | C11 | C19 | 9.2° | 140.1° |
| C21 | C10 | C11 | C12 | 170.4° | 39.7° |
| C21 | C10 | N | H45 | 179.8° | 179.9° |
| C | C1 | H1 | H2 | 117.6° | 120.0° |
| C1 | C | H42 | H43 | 120.0° | 120.0° |
| C1 | C | H42 | H44 | 120.0° | 119.9° |
| C1 | C | H43 | H44 | 120.0° | 120.0° |
| C27 | N4 | C30 | C31 | 54.7° | 64.8° |
| C27 | N4 | C30 | C28 | 127.3° | 124.4° |
| C27 | N4 | C28 | C29 | 58.4° | 65.3° |
| N4 | C27 | C26 | H19 | 63.5° | 64.2° |
| N4 | C27 | C26 | H20 | 177.3° | 175.3° |
| C27 | N4 | C28 | H21 | 62.2° | 174.7° |
| C27 | N4 | C28 | H22 | 179.1° | 54.7° |
| C27 | N4 | C30 | H36 | 65.6° | 55.2° |
| C27 | N4 | C30 | H37 | 174.9° | 175.1° |
| N4 | C27 | H39 | H40 | 119.4° | 120.1° |
| C31 | C30 | N4 | H36 | 120.3° | 120.0° |
| C31 | C30 | N4 | H37 | 120.3° | 120.1° |
| C31 | C30 | N4 | C28 | 178.0° | 170.8° |
| C30 | C31 | H34 | H35 | 118.6° | 120.4° |
| C31 | C30 | H36 | H37 | 119.2° | 120.1° |
| N | C10 | C11 | C19 | 167.6° | 39.9° |
| N | C10 | C11 | C12 | 12.9° | 140.3° |
| N | C10 | C21 | H16 | 179.5° | 180.0° |
| C10 | C11 | C19 | O2 | 4.1° | 0.0° |
| C10 | C11 | C19 | C12 | 179.5° | 179.8° |
| C10 | C11 | C19 | N1 | 177.9° | 179.7° |
| C10 | C11 | C12 | C13 | 179.6° | 179.9° |
| C10 | C11 | C12 | H12 | 0.4° | 0.0° |
| C11 | C10 | C21 | H16 | 2.3° | 0.1° |
| C11 | C10 | N | H45 | 2.3° | 0.1° |
| C20 | O2 | C19 | C11 | 176.9° | 180.0° |
| C20 | O2 | C19 | N1 | 1.2° | 0.3° |
| O2 | C20 | H13 | H14 | 120.0° | 120.0° |
| O2 | C20 | H13 | H15 | 120.0° | 120.1° |
| O2 | C20 | H14 | H15 | 120.0° | 120.0° |
| O2 | C19 | C11 | N1 | 178.0° | 179.7° |
| O2 | C19 | C11 | C12 | 175.4° | 179.8° |
| O2 | C19 | N1 | C18 | 175.2° | 179.7° |
| C19 | O2 | C20 | H13 | 180.0° | 60.0° |
| C19 | O2 | C20 | H14 | 60.0° | 60.0° |
| C19 | O2 | C20 | H15 | 60.0° | 180.0° |
| C30 | N4 | C28 | C29 | 174.6° | 170.0° |
| C30 | N4 | C28 | H21 | 64.8° | 50.0° |
| C30 | N4 | C28 | H22 | 53.9° | 70.0° |
| N4 | C30 | C31 | H34 | 175.7° | 175.4° |
| N4 | C30 | C31 | H35 | 65.3° | 64.2° |
| N4 | C30 | H36 | H37 | 119.2° | 120.0° |
| C30 | N4 | C27 | H39 | 175.7° | 175.2° |
| C30 | N4 | C27 | H40 | 64.6° | 55.2° |
| N4 | C28 | C29 | H21 | 120.7° | 120.0° |
| N4 | C28 | C29 | H22 | 120.7° | 120.0° |
| N4 | C28 | H21 | H22 | 117.9° | 120.0° |
| N4 | C28 | C29 | H23 | 180.0° | 60.0° |
| N4 | C28 | C29 | H24 | 60.0° | 180.0° |
| N4 | C28 | C29 | H25 | 60.0° | 60.0° |
| C28 | N4 | C30 | H36 | 61.7° | 69.2° |
| C28 | N4 | C30 | H37 | 57.8° | 50.8° |
| C28 | N4 | C27 | H39 | 57.3° | 50.8° |
| C28 | N4 | C27 | H40 | 62.3° | 69.3° |
| C11 | C19 | N1 | C18 | 2.7° | 0.5° |
| C19 | C11 | C12 | C13 | 0.0° | 0.1° |
| C19 | C11 | C12 | H12 | 180.0° | 179.8° |
| C12 | C11 | C19 | N1 | 2.6° | 0.5° |
| C11 | C12 | C13 | H12 | 180.0° | 179.9° |
| C11 | C12 | C13 | C18 | 2.0° | 0.1° |
| C11 | C12 | C13 | C14 | 177.0° | 180.0° |
| C19 | N1 | C18 | C13 | 0.3° | 0.3° |
| C19 | N1 | C18 | C17 | 177.3° | 179.7° |
| C29 | C28 | H21 | H22 | 117.9° | 120.0° |
| C28 | C29 | H23 | H24 | 120.0° | 120.1° |
| C28 | C29 | H23 | H25 | 120.0° | 120.0° |
| C28 | C29 | H24 | H25 | 120.0° | 119.9° |
| N1 | C18 | C13 | C12 | 1.9° | 0.0° |
| N1 | C18 | C13 | C17 | 177.6° | 180.0° |
| N1 | C18 | C13 | C14 | 177.1° | 179.9° |
| N1 | C18 | C17 | C16 | 177.3° | 179.9° |
| N1 | C18 | C17 | H46 | 2.7° | 0.1° |
| C12 | C13 | C18 | C14 | 179.0° | 179.9° |
| C12 | C13 | C18 | C17 | 179.5° | 179.9° |
| C12 | C13 | C14 | C15 | 179.5° | 179.9° |
| C12 | C13 | C14 | H29 | 0.5° | 0.0° |
| C13 | C18 | C17 | C16 | 0.4° | 0.1° |
| C18 | C13 | C14 | C15 | 0.5° | 0.0° |
| C18 | C13 | C12 | H12 | 178.0° | 180.0° |
| C18 | C13 | C14 | H29 | 179.5° | 179.9° |
| C13 | C18 | C17 | H46 | 179.6° | 180.0° |
| C17 | C18 | C13 | C14 | 0.5° | 0.0° |
| C18 | C17 | C16 | H46 | 180.0° | 179.9° |
| C18 | C17 | C16 | C15 | 0.3° | 0.2° |
| C18 | C17 | C16 | H47 | 179.7° | 180.0° |
| C13 | C14 | C15 | H29 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.4° | 0.0° |
| C14 | C13 | C12 | H12 | 3.0° | 0.1° |
| C13 | C14 | C15 | H32 | 179.6° | 180.0° |
| C17 | C16 | C15 | C14 | 0.3° | 0.1° |
| C17 | C16 | C15 | H47 | 180.0° | 179.8° |
| C17 | C16 | C15 | H32 | 179.7° | 179.9° |
| C14 | C15 | C16 | H32 | 180.0° | 180.0° |
| C14 | C15 | C16 | H47 | 179.7° | 180.0° |
| C16 | C15 | C14 | H29 | 179.6° | 179.9° |
| C15 | C16 | C17 | H46 | 179.7° | 179.9° |
| H1 | C1 | C | H42 | 59.2° | 59.9° |
| H1 | C1 | C | H43 | 179.2° | 180.0° |
| H1 | C1 | C | H44 | 60.8° | 60.0° |
| H2 | C1 | C | H42 | 59.3° | 60.0° |
| H2 | C1 | C | H43 | 60.7° | 60.0° |
| H2 | C1 | C | H44 | 179.3° | 180.0° |
| H4 | C3 | C4 | H6 | 156.6° | 60.0° |
| H4 | C3 | C4 | H7 | 84.1° | 180.0° |
| H5 | C3 | C4 | H6 | 38.4° | 180.0° |
| H5 | C3 | C4 | H7 | 157.8° | 60.0° |
| H6 | C4 | C5 | H8 | 174.2° | 180.0° |
| H6 | C4 | C5 | H9 | 67.6° | 60.0° |
| H7 | C4 | C5 | H8 | 54.8° | 60.0° |
| H7 | C4 | C5 | H9 | 173.0° | 180.0° |
| H8 | C5 | C6 | H10 | 173.3° | 179.9° |
| H8 | C5 | C6 | H11 | 67.8° | 60.0° |
| H9 | C5 | C6 | H10 | 55.1° | 59.9° |
| H9 | C5 | C6 | H11 | 174.0° | 180.0° |
| H10 | C6 | C7 | H26 | 179.3° | 180.0° |
| H10 | C6 | C7 | H27 | 61.5° | 60.0° |
| H11 | C6 | C7 | H26 | 60.5° | 60.0° |
| H11 | C6 | C7 | H27 | 179.6° | NaN° |
| H13 | C20 | H14 | H15 | 120.0° | 119.9° |
| H17 | C24 | C23 | H33 | 3.7° | 145.1° |
| H18 | C24 | C23 | H33 | 144.5° | 0.0° |
| H19 | C26 | C27 | H39 | 56.7° | 55.9° |
| H19 | C26 | C27 | H40 | 176.3° | 175.8° |
| H20 | C26 | C27 | H39 | 62.5° | 64.7° |
| H20 | C26 | C27 | H40 | 57.1° | 55.3° |
| H21 | C28 | C29 | H23 | 59.4° | 180.0° |
| H21 | C28 | C29 | H24 | 179.4° | 59.9° |
| H21 | C28 | C29 | H25 | 60.7° | 60.0° |
| H22 | C28 | C29 | H23 | 59.3° | 60.0° |
| H22 | C28 | C29 | H24 | 60.7° | 60.0° |
| H22 | C28 | C29 | H25 | 179.3° | 180.0° |
| H23 | C29 | H24 | H25 | 120.0° | 120.0° |
| H26 | C7 | C8 | H28 | 65.3° | 65.0° |
| H27 | C7 | C8 | H28 | 175.5° | 175.0° |
| H28 | C8 | N3 | H30 | 147.3° | 145.0° |
| H29 | C14 | C15 | H32 | 0.4° | 0.1° |
| H32 | C15 | C16 | H47 | 0.3° | 0.1° |
| H34 | C31 | C30 | H36 | 55.4° | 55.4° |
| H34 | C31 | C30 | H37 | 64.1° | 64.6° |
| H35 | C31 | C30 | H36 | 174.5° | 175.9° |
| H35 | C31 | C30 | H37 | 55.0° | 55.8° |
| H42 | C | H43 | H44 | 120.0° | 120.0° |
| H46 | C17 | C16 | H47 | 0.3° | 0.1° |
