X9V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C44 | C41 | sing | 1.53Å | 1.53Å | |
| C43 | C41 | sing | 1.53Å | 1.53Å | |
| C41 | C38 | sing | 1.51Å | 1.51Å | |
| C41 | C42 | sing | 1.53Å | 1.53Å | |
| N39 | C38 | doub | 1.30Å | 1.31Å | Aromatic |
| N39 | O40 | sing | 1.21Å | 1.23Å | Aromatic |
| C38 | N37 | sing | 1.34Å | 1.35Å | Aromatic |
| O40 | C36 | sing | 1.34Å | 1.34Å | Aromatic |
| N37 | C36 | doub | 1.32Å | 1.33Å | Aromatic |
| C36 | C2 | sing | 1.48Å | 1.49Å | |
| C2 | O1 | doub | 1.22Å | 1.22Å | |
| C2 | N3 | sing | 1.35Å | 1.34Å | |
| N3 | C4 | sing | 1.47Å | 1.47Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C13 | sing | 1.51Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.54Å | |
| C12 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.53Å | 1.53Å | |
| C8 | C7 | sing | 1.51Å | 1.51Å | |
| C8 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| C10 | C14 | sing | 1.48Å | 1.49Å | |
| C15 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C23 | sing | 1.40Å | 1.42Å | Aromatic |
| C16 | N17 | doub | 1.32Å | 1.32Å | Aromatic |
| C23 | C18 | doub | 1.41Å | 1.41Å | Aromatic |
| C23 | N22 | sing | 1.38Å | 1.36Å | Aromatic |
| N17 | C18 | sing | 1.33Å | 1.33Å | Aromatic |
| C18 | N19 | sing | 1.35Å | 1.37Å | Aromatic |
| N22 | C21 | sing | 1.37Å | 1.32Å | Aromatic |
| N19 | C21 | doub | 1.31Å | 1.37Å | Aromatic |
| C21 | C24 | sing | 1.48Å | 1.48Å | |
| C29 | C28 | sing | 1.51Å | 1.51Å | |
| C24 | C28 | sing | 1.41Å | 1.42Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | N27 | doub | 1.31Å | 1.31Å | Aromatic |
| C25 | N26 | sing | 1.35Å | 1.34Å | Aromatic |
| N27 | N26 | sing | 1.40Å | 1.39Å | Aromatic |
| N26 | C30 | sing | 1.47Å | 1.47Å | |
| C30 | C35 | sing | 1.53Å | 1.53Å | |
| C30 | C31 | sing | 1.53Å | 1.54Å | |
| C35 | C34 | sing | 1.53Å | 1.53Å | |
| C31 | C32 | sing | 1.53Å | 1.54Å | |
| C34 | O33 | sing | 1.43Å | 1.43Å | |
| C32 | O33 | sing | 1.43Å | 1.43Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| C15 | H10 | sing | 1.08Å | 1.08Å | |
| C16 | H11 | sing | 1.08Å | 1.08Å | |
| N22 | H12 | sing | 0.97Å | 1.00Å | |
| C30 | H13 | sing | 1.09Å | 1.10Å | |
| C31 | H14 | sing | 1.09Å | 1.10Å | |
| C31 | H15 | sing | 1.09Å | 1.10Å | |
| C32 | H16 | sing | 1.09Å | 1.10Å | |
| C32 | H17 | sing | 1.09Å | 1.10Å | |
| C34 | H18 | sing | 1.09Å | 1.10Å | |
| C34 | H19 | sing | 1.09Å | 1.10Å | |
| C35 | H20 | sing | 1.09Å | 1.10Å | |
| C35 | H21 | sing | 1.09Å | 1.10Å | |
| N3 | H22 | sing | 0.97Å | 1.00Å | |
| C9 | H23 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| C42 | H29 | sing | 1.09Å | 1.10Å | |
| C42 | H30 | sing | 1.09Å | 1.10Å | |
| C42 | H31 | sing | 1.09Å | 1.10Å | |
| C43 | H32 | sing | 1.09Å | 1.10Å | |
| C43 | H33 | sing | 1.09Å | 1.10Å | |
| C43 | H34 | sing | 1.09Å | 1.10Å | |
| C44 | H35 | sing | 1.09Å | 1.10Å | |
| C44 | H36 | sing | 1.09Å | 1.10Å | |
| C44 | H37 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C44 | C41 | C43 | 109.1° | 109.5° |
| C44 | C41 | C38 | 110.2° | 109.5° |
| C44 | C41 | C42 | 108.1° | 109.5° |
| C41 | C44 | H35 | 109.5° | 109.5° |
| C41 | C44 | H36 | 109.4° | 109.5° |
| C41 | C44 | H37 | 109.5° | 109.5° |
| C43 | C41 | C38 | 109.9° | 109.5° |
| C43 | C41 | C42 | 110.0° | 109.5° |
| C41 | C43 | H32 | 109.5° | 109.5° |
| C41 | C43 | H33 | 109.5° | 109.5° |
| C41 | C43 | H34 | 109.5° | 109.5° |
| C38 | C41 | C42 | 109.5° | 109.5° |
| C41 | C38 | N39 | 126.2° | 126.2° |
| C41 | C38 | N37 | 126.6° | 126.2° |
| C41 | C42 | H29 | 109.5° | 109.4° |
| C41 | C42 | H30 | 109.4° | 109.5° |
| C41 | C42 | H31 | 109.5° | 109.4° |
| C38 | N39 | O40 | 110.7° | 110.5° |
| N39 | C38 | N37 | 107.2° | 107.6° |
| N39 | O40 | C36 | 109.5° | 109.6° |
| C38 | N37 | C36 | 105.9° | 105.6° |
| O40 | C36 | N37 | 106.6° | 106.7° |
| O40 | C36 | C2 | 127.2° | 126.6° |
| N37 | C36 | C2 | 126.1° | 126.6° |
| C36 | C2 | O1 | 122.6° | 120.0° |
| C36 | C2 | N3 | 115.7° | 120.0° |
| O1 | C2 | N3 | 121.8° | 120.0° |
| C2 | N3 | C4 | 125.2° | 120.0° |
| C2 | N3 | H22 | 117.4° | 120.0° |
| N3 | C4 | C5 | 113.8° | 109.3° |
| N3 | C4 | C13 | 115.0° | 109.2° |
| N3 | C4 | H1 | 104.5° | 109.2° |
| C4 | N3 | H22 | 117.4° | 120.0° |
| C5 | C4 | C13 | 113.8° | 110.6° |
| C4 | C5 | C6 | 107.2° | 108.4° |
| C5 | C4 | H1 | 104.0° | 109.2° |
| C4 | C5 | H2 | 110.0° | 109.7° |
| C4 | C5 | H3 | 110.0° | 109.6° |
| C4 | C13 | C12 | 119.6° | 117.7° |
| C4 | C13 | C8 | 121.5° | 122.5° |
| C13 | C4 | H1 | 104.0° | 109.3° |
| C5 | C6 | C7 | 112.4° | 108.4° |
| C6 | C5 | H2 | 110.0° | 109.7° |
| C6 | C5 | H3 | 110.0° | 109.7° |
| C5 | C6 | H4 | 108.7° | 109.6° |
| C5 | C6 | H5 | 108.7° | 109.7° |
| C13 | C12 | C11 | 120.7° | 120.8° |
| C12 | C13 | C8 | 118.7° | 119.8° |
| C13 | C12 | H9 | 119.7° | 119.6° |
| C12 | C11 | C10 | 121.2° | 119.6° |
| C12 | C11 | H8 | 119.4° | 120.2° |
| C11 | C12 | H9 | 119.6° | 119.6° |
| C13 | C8 | C7 | 121.5° | 122.5° |
| C13 | C8 | C9 | 120.9° | 119.8° |
| C11 | C10 | C9 | 117.5° | 119.5° |
| C11 | C10 | C14 | 117.9° | 120.2° |
| C10 | C11 | H8 | 119.4° | 120.2° |
| C6 | C7 | C8 | 113.3° | 110.6° |
| C7 | C6 | H4 | 108.7° | 109.7° |
| C7 | C6 | H5 | 108.8° | 109.7° |
| C6 | C7 | H6 | 108.5° | 109.3° |
| C6 | C7 | H7 | 108.5° | 109.2° |
| C7 | C8 | C9 | 117.6° | 117.6° |
| C8 | C7 | H6 | 108.5° | 109.2° |
| C8 | C7 | H7 | 108.5° | 109.2° |
| C8 | C9 | C10 | 120.9° | 120.4° |
| C8 | C9 | H23 | 119.6° | 119.8° |
| C9 | C10 | C14 | 124.1° | 120.2° |
| C10 | C9 | H23 | 119.5° | 119.8° |
| C10 | C14 | C15 | 124.0° | 121.0° |
| C10 | C14 | C23 | 119.6° | 121.0° |
| C14 | C15 | C16 | 120.3° | 119.3° |
| C15 | C14 | C23 | 116.1° | 118.0° |
| C14 | C15 | H10 | 119.8° | 120.3° |
| C15 | C16 | N17 | 122.5° | 121.6° |
| C16 | C15 | H10 | 119.8° | 120.4° |
| C15 | C16 | H11 | 118.7° | 119.2° |
| C14 | C23 | C18 | 119.6° | 119.4° |
| C14 | C23 | N22 | 133.8° | 134.2° |
| C16 | N17 | C18 | 120.3° | 121.8° |
| N17 | C16 | H11 | 118.7° | 119.2° |
| C18 | C23 | N22 | 106.6° | 106.4° |
| C23 | C18 | N17 | 121.1° | 119.9° |
| C23 | C18 | N19 | 106.5° | 107.1° |
| C23 | N22 | C21 | 110.0° | 107.0° |
| C23 | N22 | H12 | 125.0° | 126.4° |
| N17 | C18 | N19 | 132.4° | 133.0° |
| C18 | N19 | C21 | 107.8° | 109.8° |
| N22 | C21 | N19 | 109.1° | 109.7° |
| N22 | C21 | C24 | 127.1° | 125.1° |
| C21 | N22 | H12 | 125.0° | 126.5° |
| N19 | C21 | C24 | 123.7° | 125.2° |
| C21 | C24 | C28 | 128.3° | 126.4° |
| C21 | C24 | C25 | 124.8° | 126.4° |
| C29 | C28 | C24 | 127.5° | 126.0° |
| C29 | C28 | N27 | 124.7° | 126.0° |
| C28 | C29 | H26 | 109.5° | 109.5° |
| C28 | C29 | H27 | 109.5° | 109.5° |
| C28 | C29 | H28 | 109.5° | 109.4° |
| C28 | C24 | C25 | 106.9° | 107.2° |
| C24 | C28 | N27 | 107.8° | 108.0° |
| C24 | C25 | N26 | 107.8° | 107.4° |
| C24 | C25 | H25 | 126.1° | 126.3° |
| C28 | N27 | N26 | 109.3° | 108.9° |
| C25 | N26 | N27 | 108.2° | 108.4° |
| C25 | N26 | C30 | 126.0° | 125.8° |
| N26 | C25 | H25 | 126.1° | 126.3° |
| N27 | N26 | C30 | 125.8° | 125.8° |
| N26 | C30 | C35 | 109.7° | 109.5° |
| N26 | C30 | C31 | 111.6° | 109.5° |
| N26 | C30 | H13 | 109.8° | 109.6° |
| C35 | C30 | C31 | 107.6° | 109.0° |
| C30 | C35 | C34 | 109.0° | 109.2° |
| C35 | C30 | H13 | 109.1° | 109.6° |
| C30 | C35 | H20 | 109.6° | 109.6° |
| C30 | C35 | H21 | 109.6° | 109.5° |
| C30 | C31 | C32 | 108.8° | 109.1° |
| C31 | C30 | H13 | 109.0° | 109.5° |
| C30 | C31 | H14 | 109.6° | 109.5° |
| C30 | C31 | H15 | 109.6° | 109.6° |
| C35 | C34 | O33 | 109.8° | 109.4° |
| C35 | C34 | H18 | 109.4° | 109.5° |
| C35 | C34 | H19 | 109.4° | 109.5° |
| C34 | C35 | H20 | 109.6° | 109.5° |
| C34 | C35 | H21 | 109.6° | 109.5° |
| C31 | C32 | O33 | 110.5° | 109.4° |
| C32 | C31 | H14 | 109.6° | 109.5° |
| C32 | C31 | H15 | 109.6° | 109.5° |
| C31 | C32 | H16 | 109.2° | 109.5° |
| C31 | C32 | H17 | 109.2° | 109.5° |
| C34 | O33 | C32 | 116.0° | 114.1° |
| O33 | C34 | H18 | 109.4° | 109.5° |
| O33 | C34 | H19 | 109.4° | 109.5° |
| O33 | C32 | H16 | 109.2° | 109.5° |
| O33 | C32 | H17 | 109.2° | 109.5° |
| H2 | C5 | H3 | 109.5° | 109.7° |
| H4 | C6 | H5 | 109.5° | 109.8° |
| H6 | C7 | H7 | 109.5° | 109.3° |
| H14 | C31 | H15 | 109.5° | 109.6° |
| H16 | C32 | H17 | 109.5° | 109.5° |
| H18 | C34 | H19 | 109.4° | 109.4° |
| H20 | C35 | H21 | 109.5° | 109.6° |
| H26 | C29 | H27 | 109.5° | 109.5° |
| H26 | C29 | H28 | 109.5° | 109.5° |
| H27 | C29 | H28 | 109.5° | 109.4° |
| H29 | C42 | H30 | 109.5° | 109.5° |
| H29 | C42 | H31 | 109.5° | 109.5° |
| H30 | C42 | H31 | 109.5° | 109.5° |
| H32 | C43 | H33 | 109.5° | 109.4° |
| H32 | C43 | H34 | 109.5° | 109.5° |
| H33 | C43 | H34 | 109.5° | 109.4° |
| H35 | C44 | H36 | 109.5° | 109.4° |
| H35 | C44 | H37 | 109.4° | 109.4° |
| H36 | C44 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C44 | C41 | C43 | C38 | 120.9° | 120.0° |
| C44 | C41 | C43 | C42 | 118.4° | 120.0° |
| C44 | C41 | C38 | C42 | 118.8° | 120.0° |
| C44 | C41 | C38 | N39 | 0.6° | 120.2° |
| C44 | C41 | C38 | N37 | 179.5° | 60.0° |
| C44 | C41 | C42 | H29 | 180.0° | 180.0° |
| C44 | C41 | C42 | H30 | 60.0° | 60.0° |
| C44 | C41 | C42 | H31 | 60.0° | 60.0° |
| C44 | C41 | C43 | H32 | 180.0° | 60.0° |
| C44 | C41 | C43 | H33 | 60.0° | 60.0° |
| C44 | C41 | C43 | H34 | 60.0° | 180.0° |
| C41 | C44 | H35 | H36 | 120.0° | 120.0° |
| C41 | C44 | H35 | H37 | 120.0° | 120.0° |
| C41 | C44 | H36 | H37 | 120.0° | 120.1° |
| C43 | C41 | C38 | C42 | 120.9° | 120.0° |
| C43 | C41 | C38 | N39 | 120.8° | 0.2° |
| C43 | C41 | C38 | N37 | 59.2° | 180.0° |
| C43 | C41 | C42 | H29 | 61.0° | 60.0° |
| C43 | C41 | C42 | H30 | 179.0° | 60.0° |
| C43 | C41 | C42 | H31 | 59.0° | 180.0° |
| C41 | C43 | H32 | H33 | 120.0° | 120.0° |
| C41 | C43 | H32 | H34 | 120.0° | 120.0° |
| C41 | C43 | H33 | H34 | 120.0° | 120.0° |
| C43 | C41 | C44 | H35 | 180.0° | 180.0° |
| C43 | C41 | C44 | H36 | 60.0° | 60.0° |
| C43 | C41 | C44 | H37 | 60.0° | 60.0° |
| C41 | C38 | N39 | N37 | 180.0° | 179.8° |
| C41 | C38 | N39 | O40 | 179.7° | 179.9° |
| C41 | C38 | N37 | C36 | 178.9° | 180.0° |
| C38 | C41 | C42 | H29 | 59.9° | 60.0° |
| C38 | C41 | C42 | H30 | 60.1° | 180.0° |
| C38 | C41 | C42 | H31 | 179.9° | 60.0° |
| C38 | C41 | C43 | H32 | 59.1° | 60.0° |
| C38 | C41 | C43 | H33 | 179.1° | 180.0° |
| C38 | C41 | C43 | H34 | 60.9° | 60.0° |
| C38 | C41 | C44 | H35 | 59.3° | 60.0° |
| C38 | C41 | C44 | H36 | 60.8° | 180.0° |
| C38 | C41 | C44 | H37 | 179.2° | 60.0° |
| C42 | C41 | C38 | N39 | 118.3° | 119.8° |
| C42 | C41 | C38 | N37 | 61.7° | 60.0° |
| C41 | C42 | H29 | H30 | 120.0° | 120.0° |
| C41 | C42 | H29 | H31 | 120.0° | 119.9° |
| C41 | C42 | H30 | H31 | 120.0° | 120.0° |
| C42 | C41 | C43 | H32 | 61.6° | 180.0° |
| C42 | C41 | C43 | H33 | 58.4° | 60.0° |
| C42 | C41 | C43 | H34 | 178.4° | 60.0° |
| C42 | C41 | C44 | H35 | 60.4° | 60.0° |
| C42 | C41 | C44 | H36 | 179.5° | 60.0° |
| C42 | C41 | C44 | H37 | 59.6° | 180.0° |
| C38 | N39 | O40 | C36 | 0.5° | 0.1° |
| N39 | C38 | N37 | C36 | 1.1° | 0.2° |
| O40 | N39 | C38 | N37 | 0.4° | 0.0° |
| N39 | O40 | C36 | N37 | 1.2° | 0.2° |
| N39 | O40 | C36 | C2 | 178.2° | 180.0° |
| C38 | N37 | C36 | O40 | 1.4° | 0.2° |
| C38 | N37 | C36 | C2 | 178.4° | 180.0° |
| O40 | C36 | N37 | C2 | 177.0° | 179.7° |
| O40 | C36 | C2 | O1 | 18.2° | 179.7° |
| O40 | C36 | C2 | N3 | 160.5° | 0.6° |
| N37 | C36 | C2 | O1 | 165.4° | 0.0° |
| N37 | C36 | C2 | N3 | 15.9° | 179.8° |
| C36 | C2 | O1 | N3 | 178.6° | 179.7° |
| C36 | C2 | N3 | C4 | 178.6° | 179.7° |
| C36 | C2 | N3 | H22 | 1.4° | 0.2° |
| O1 | C2 | N3 | C4 | 0.1° | 0.0° |
| O1 | C2 | N3 | H22 | 179.9° | 179.9° |
| C2 | N3 | C4 | H22 | 180.0° | 179.9° |
| C2 | N3 | C4 | C5 | 68.6° | 154.9° |
| C2 | N3 | C4 | C13 | 65.3° | 83.9° |
| C2 | N3 | C4 | H1 | 178.7° | 35.5° |
| N3 | C4 | C5 | C13 | 134.4° | 120.3° |
| N3 | C4 | C5 | H1 | 113.0° | 119.4° |
| N3 | C4 | C13 | H1 | 113.7° | 119.4° |
| N3 | C4 | C5 | C6 | 175.1° | 171.4° |
| N3 | C4 | C13 | C12 | 27.9° | 42.2° |
| N3 | C4 | C13 | C8 | 157.5° | 137.9° |
| N3 | C4 | C5 | H2 | 55.4° | 68.8° |
| N3 | C4 | C5 | H3 | 65.3° | 51.7° |
| C5 | C4 | C13 | H1 | 112.5° | 120.3° |
| C4 | C5 | C6 | H2 | 119.7° | 119.8° |
| C4 | C5 | C6 | H3 | 119.7° | 119.7° |
| C5 | C4 | C13 | C12 | 161.7° | 162.5° |
| C5 | C4 | C13 | C8 | 23.7° | 17.6° |
| C4 | C5 | C6 | C7 | 62.2° | 69.9° |
| C4 | C5 | H2 | H3 | 121.0° | 120.5° |
| C4 | C5 | C6 | H4 | 58.2° | 49.7° |
| C4 | C5 | C6 | H5 | 177.4° | 170.3° |
| C5 | C4 | N3 | H22 | 111.4° | 25.0° |
| C13 | C4 | C5 | C6 | 50.5° | 51.1° |
| C4 | C13 | C12 | C8 | 174.7° | 179.9° |
| C4 | C13 | C12 | C11 | 176.7° | 179.8° |
| C4 | C13 | C8 | C7 | 4.7° | 0.4° |
| C4 | C13 | C8 | C9 | 176.7° | 179.7° |
| C13 | C4 | C5 | H2 | 170.2° | 170.9° |
| C13 | C4 | C5 | H3 | 69.1° | 68.5° |
| C4 | C13 | C12 | H9 | 3.3° | 0.3° |
| C13 | C4 | N3 | H22 | 114.7° | 96.2° |
| C5 | C6 | C7 | H4 | 120.4° | 119.7° |
| C5 | C6 | C7 | H5 | 120.4° | 119.7° |
| C5 | C6 | C7 | C8 | 44.6° | 51.1° |
| C6 | C5 | C4 | H1 | 62.0° | 69.2° |
| C6 | C5 | H2 | H3 | 121.0° | 120.5° |
| C5 | C6 | H4 | H5 | 118.7° | 120.5° |
| C5 | C6 | C7 | H6 | 165.2° | 171.3° |
| C5 | C6 | C7 | H7 | 76.0° | 69.2° |
| C13 | C12 | C11 | H9 | 180.0° | 179.9° |
| C13 | C12 | C11 | C10 | 0.6° | 0.1° |
| C12 | C13 | C8 | C7 | 179.3° | 179.7° |
| C12 | C13 | C8 | C9 | 2.1° | 0.2° |
| C12 | C13 | C4 | H1 | 85.7° | 77.2° |
| C13 | C12 | C11 | H8 | 179.4° | 180.0° |
| C11 | C12 | C13 | C8 | 1.9° | 0.1° |
| C12 | C11 | C10 | H8 | 180.0° | 180.0° |
| C12 | C11 | C10 | C9 | 2.9° | 0.1° |
| C12 | C11 | C10 | C14 | 175.7° | 179.9° |
| C13 | C8 | C7 | C6 | 15.0° | 17.5° |
| C13 | C8 | C7 | C9 | 178.7° | 179.9° |
| C13 | C8 | C9 | C10 | 0.3° | 0.1° |
| C8 | C13 | C4 | H1 | 88.8° | 102.7° |
| C13 | C8 | C7 | H6 | 135.6° | 137.8° |
| C13 | C8 | C7 | H7 | 105.5° | 102.7° |
| C8 | C13 | C12 | H9 | 178.1° | 179.8° |
| C13 | C8 | C9 | H23 | 179.6° | 179.9° |
| C11 | C10 | C9 | C8 | 2.8° | 0.0° |
| C11 | C10 | C9 | C14 | 172.3° | 180.0° |
| C11 | C10 | C14 | C15 | 36.4° | 130.0° |
| C11 | C10 | C14 | C23 | 136.0° | 50.0° |
| C10 | C11 | C12 | H9 | 179.4° | 180.0° |
| C11 | C10 | C9 | H23 | 177.2° | 179.9° |
| C6 | C7 | C8 | H6 | 120.6° | 120.3° |
| C6 | C7 | C8 | H7 | 120.5° | 120.3° |
| C6 | C7 | C8 | C9 | 166.3° | 162.5° |
| C7 | C6 | C5 | H2 | 178.2° | 170.3° |
| C7 | C6 | C5 | H3 | 57.5° | 49.7° |
| C7 | C6 | H4 | H5 | 118.7° | 120.6° |
| C6 | C7 | H6 | H7 | 118.2° | 119.5° |
| C7 | C8 | C9 | C10 | 178.3° | 179.8° |
| C8 | C7 | C6 | H4 | 75.8° | 68.6° |
| C8 | C7 | C6 | H5 | 165.0° | 170.8° |
| C8 | C7 | H6 | H7 | 118.3° | 119.4° |
| C7 | C8 | C9 | H23 | 1.7° | 0.2° |
| C8 | C9 | C10 | H23 | 180.0° | 180.0° |
| C8 | C9 | C10 | C14 | 175.1° | 180.0° |
| C9 | C8 | C7 | H6 | 45.7° | 42.2° |
| C9 | C8 | C7 | H7 | 73.1° | 77.2° |
| C9 | C10 | C14 | C15 | 151.3° | 50.1° |
| C9 | C10 | C14 | C23 | 36.3° | 130.0° |
| C9 | C10 | C11 | H8 | 177.1° | 179.9° |
| C10 | C14 | C15 | C23 | 172.6° | 180.0° |
| C10 | C14 | C15 | C16 | 175.4° | 180.0° |
| C10 | C14 | C23 | C18 | 175.6° | 180.0° |
| C10 | C14 | C23 | N22 | 6.4° | 0.1° |
| C14 | C10 | C11 | H8 | 4.3° | 0.1° |
| C10 | C14 | C15 | H10 | 4.6° | 0.3° |
| C14 | C10 | C9 | H23 | 4.9° | 0.0° |
| C14 | C15 | C16 | H10 | 180.0° | 179.7° |
| C14 | C15 | C16 | N17 | 1.6° | 0.1° |
| C15 | C14 | C23 | C18 | 2.7° | 0.1° |
| C15 | C14 | C23 | N22 | 179.3° | 179.9° |
| C14 | C15 | C16 | H11 | 178.4° | 180.0° |
| C16 | C15 | C14 | C23 | 2.8° | 0.1° |
| C15 | C16 | N17 | H11 | 180.0° | 179.9° |
| C15 | C16 | N17 | C18 | 0.3° | 0.1° |
| C14 | C23 | C18 | N22 | 178.5° | 179.9° |
| C14 | C23 | C18 | N17 | 1.5° | 0.1° |
| C14 | C23 | C18 | N19 | 178.9° | 179.9° |
| C14 | C23 | N22 | C21 | 178.9° | 179.9° |
| C23 | C14 | C15 | H10 | 177.3° | 179.8° |
| C14 | C23 | N22 | H12 | 1.1° | 0.1° |
| C16 | N17 | C18 | C23 | 0.2° | 0.1° |
| C16 | N17 | C18 | N19 | 179.7° | 179.9° |
| N17 | C16 | C15 | H10 | 178.4° | 179.8° |
| C23 | C18 | N17 | N19 | 179.5° | 179.9° |
| C18 | C23 | N22 | C21 | 0.7° | 0.0° |
| C23 | C18 | N19 | C21 | 0.0° | 0.0° |
| C18 | C23 | N22 | H12 | 179.3° | 180.0° |
| N22 | C23 | C18 | N17 | 179.9° | 180.0° |
| N22 | C23 | C18 | N19 | 0.4° | 0.0° |
| C23 | N22 | C21 | H12 | 180.0° | 180.0° |
| C23 | N22 | C21 | N19 | 0.7° | 0.0° |
| C23 | N22 | C21 | C24 | 179.1° | 180.0° |
| N17 | C18 | N19 | C21 | 179.6° | 180.0° |
| C18 | N17 | C16 | H11 | 179.7° | 180.0° |
| C18 | N19 | C21 | N22 | 0.4° | 0.0° |
| C18 | N19 | C21 | C24 | 178.9° | 180.0° |
| N22 | C21 | N19 | C24 | 178.5° | 180.0° |
| N22 | C21 | C24 | C28 | 9.1° | 180.0° |
| N22 | C21 | C24 | C25 | 169.3° | 0.3° |
| N19 | C21 | C24 | C28 | 172.7° | 0.0° |
| N19 | C21 | C24 | C25 | 8.9° | 179.7° |
| N19 | C21 | N22 | H12 | 179.3° | 180.0° |
| C21 | C24 | C28 | C29 | 1.5° | 0.0° |
| C21 | C24 | C28 | C25 | 178.6° | 179.7° |
| C21 | C24 | C28 | N27 | 178.9° | 179.8° |
| C21 | C24 | C25 | N26 | 179.3° | 180.0° |
| C24 | C21 | N22 | H12 | 0.9° | 0.0° |
| C21 | C24 | C25 | H25 | 0.7° | 0.0° |
| C29 | C28 | C24 | N27 | 179.6° | 179.8° |
| C29 | C28 | C24 | C25 | 179.9° | 179.7° |
| C29 | C28 | N27 | N26 | 179.5° | 179.7° |
| C28 | C29 | H26 | H27 | 120.0° | 120.0° |
| C28 | C29 | H26 | H28 | 120.0° | 120.0° |
| C28 | C29 | H27 | H28 | 120.0° | 119.9° |
| C28 | C24 | C25 | N26 | 0.6° | 0.3° |
| C24 | C28 | N27 | N26 | 0.1° | 0.5° |
| C28 | C24 | C25 | H25 | 179.4° | 179.7° |
| C24 | C28 | C29 | H26 | 179.5° | 89.9° |
| C24 | C28 | C29 | H27 | 59.5° | 150.0° |
| C24 | C28 | C29 | H28 | 60.5° | 30.1° |
| C25 | C24 | C28 | N27 | 0.3° | 0.5° |
| C24 | C25 | N26 | H25 | 180.0° | 180.0° |
| C24 | C25 | N26 | N27 | 0.7° | 0.0° |
| C24 | C25 | N26 | C30 | 179.6° | 180.0° |
| C28 | N27 | N26 | C25 | 0.5° | 0.3° |
| C28 | N27 | N26 | C30 | 179.4° | 179.7° |
| N27 | C28 | C29 | H26 | 0.0° | 89.8° |
| N27 | C28 | C29 | H27 | 120.0° | 30.2° |
| N27 | C28 | C29 | H28 | 120.0° | 150.1° |
| C25 | N26 | N27 | C30 | 179.0° | 180.0° |
| C25 | N26 | C30 | C35 | 113.3° | 85.0° |
| C25 | N26 | C30 | C31 | 127.5° | 34.5° |
| C25 | N26 | C30 | H13 | 6.6° | 154.7° |
| N27 | N26 | C30 | C35 | 65.5° | 95.0° |
| N27 | N26 | C30 | C31 | 53.7° | 145.5° |
| N27 | N26 | C30 | H13 | 174.6° | 25.2° |
| N27 | N26 | C25 | H25 | 179.3° | 180.0° |
| N26 | C30 | C35 | C31 | 121.6° | 119.9° |
| N26 | C30 | C35 | H13 | 120.4° | 120.3° |
| N26 | C30 | C31 | H13 | 121.4° | 120.3° |
| N26 | C30 | C35 | C34 | 177.7° | 176.9° |
| N26 | C30 | C31 | C32 | 179.9° | 176.9° |
| N26 | C30 | C31 | H14 | 60.0° | 63.3° |
| N26 | C30 | C31 | H15 | 60.3° | 56.9° |
| N26 | C30 | C35 | H20 | 62.4° | 57.0° |
| N26 | C30 | C35 | H21 | 57.8° | 63.3° |
| C30 | N26 | C25 | H25 | 0.4° | 0.0° |
| C35 | C30 | C31 | H13 | 118.1° | 119.9° |
| C30 | C35 | C34 | H20 | 119.9° | 120.0° |
| C30 | C35 | C34 | H21 | 119.9° | 119.9° |
| C35 | C30 | C31 | C32 | 59.7° | 57.0° |
| C30 | C35 | C34 | O33 | 57.8° | 57.7° |
| C35 | C30 | C31 | H14 | 179.6° | 176.9° |
| C35 | C30 | C31 | H15 | 60.2° | 62.9° |
| C30 | C35 | C34 | H18 | 177.9° | 177.7° |
| C30 | C35 | C34 | H19 | 62.3° | 62.4° |
| C30 | C35 | H20 | H21 | 120.2° | 120.2° |
| C31 | C30 | C35 | C34 | 60.7° | 57.0° |
| C30 | C31 | C32 | H14 | 119.9° | 119.9° |
| C30 | C31 | C32 | H15 | 119.9° | 119.9° |
| C30 | C31 | C32 | O33 | 56.1° | 57.6° |
| C30 | C31 | H14 | H15 | 120.3° | 120.2° |
| C30 | C31 | C32 | H16 | 64.0° | 62.4° |
| C30 | C31 | C32 | H17 | 176.3° | 177.6° |
| C31 | C30 | C35 | H20 | 59.2° | 62.9° |
| C31 | C30 | C35 | H21 | 179.3° | 176.9° |
| C35 | C34 | O33 | H18 | 120.1° | 120.0° |
| C35 | C34 | O33 | H19 | 120.1° | 120.0° |
| C35 | C34 | O33 | C32 | 56.5° | 61.1° |
| C34 | C35 | C30 | H13 | 57.3° | 62.8° |
| C35 | C34 | H18 | H19 | 119.8° | 120.0° |
| C34 | C35 | H20 | H21 | 120.2° | 120.1° |
| C31 | C32 | O33 | C34 | 55.9° | 61.2° |
| C31 | C32 | O33 | H16 | 120.1° | 120.0° |
| C31 | C32 | O33 | H17 | 120.2° | 120.0° |
| C32 | C31 | C30 | H13 | 58.4° | 62.9° |
| C32 | C31 | H14 | H15 | 120.3° | 120.1° |
| C31 | C32 | H16 | H17 | 119.5° | 120.0° |
| C34 | O33 | C32 | H16 | 64.2° | 58.9° |
| C34 | O33 | C32 | H17 | 176.1° | 178.9° |
| O33 | C34 | H18 | H19 | 119.8° | 120.0° |
| O33 | C34 | C35 | H20 | 62.1° | 62.3° |
| O33 | C34 | C35 | H21 | 177.7° | 177.5° |
| O33 | C32 | C31 | H14 | 176.0° | 177.5° |
| O33 | C32 | C31 | H15 | 63.7° | 62.3° |
| O33 | C32 | H16 | H17 | 119.5° | 120.0° |
| C32 | O33 | C34 | H18 | 176.5° | 178.9° |
| C32 | O33 | C34 | H19 | 63.6° | 58.9° |
| H1 | C4 | C5 | H2 | 57.6° | 50.6° |
| H1 | C4 | C5 | H3 | 178.3° | 171.1° |
| H1 | C4 | N3 | H22 | 1.3° | 144.4° |
| H2 | C5 | C6 | H4 | 61.4° | 70.1° |
| H2 | C5 | C6 | H5 | 57.7° | 50.5° |
| H3 | C5 | C6 | H4 | 177.9° | 169.4° |
| H3 | C5 | C6 | H5 | 62.9° | 70.0° |
| H4 | C6 | C7 | H6 | 44.8° | 51.7° |
| H4 | C6 | C7 | H7 | 163.6° | 171.2° |
| H5 | C6 | C7 | H6 | 74.4° | 68.9° |
| H5 | C6 | C7 | H7 | 44.5° | 50.5° |
| H8 | C11 | C12 | H9 | 0.6° | 0.0° |
| H10 | C15 | C16 | H11 | 1.6° | 0.3° |
| H13 | C30 | C31 | H14 | 61.5° | 57.0° |
| H13 | C30 | C31 | H15 | 178.3° | 177.2° |
| H13 | C30 | C35 | H20 | 177.3° | 177.2° |
| H13 | C30 | C35 | H21 | 62.6° | 57.0° |
| H14 | C31 | C32 | H16 | 55.9° | 57.5° |
| H14 | C31 | C32 | H17 | 63.8° | 62.5° |
| H15 | C31 | C32 | H16 | 176.1° | 177.7° |
| H15 | C31 | C32 | H17 | 56.4° | 57.7° |
| H18 | C34 | C35 | H20 | 57.9° | 57.7° |
| H18 | C34 | C35 | H21 | 62.2° | 62.5° |
| H19 | C34 | C35 | H20 | 177.8° | 177.7° |
| H19 | C34 | C35 | H21 | 57.7° | 57.5° |
| H26 | C29 | H27 | H28 | 120.0° | 120.0° |
| H29 | C42 | H30 | H31 | 120.0° | 120.1° |
| H32 | C43 | H33 | H34 | 120.0° | 120.0° |
| H35 | C44 | H36 | H37 | 120.0° | 119.9° |
