A85
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O2 | doub | 1.22Å | 1.22Å | |
| C1 | N3 | sing | 1.35Å | 1.35Å | |
| C1 | N21 | sing | 1.35Å | 1.35Å | |
| N3 | C4 | sing | 1.46Å | 1.46Å | |
| N3 | C5 | sing | 1.46Å | 1.44Å | |
| C4 | H12 | sing | 1.09Å | 1.09Å | |
| C4 | H13 | sing | 1.09Å | 1.09Å | |
| C4 | H14 | sing | 1.09Å | 1.09Å | |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| C5 | H15 | sing | 1.09Å | 1.09Å | |
| C5 | H16 | sing | 1.09Å | 1.09Å | |
| C6 | C7 | sing | 1.38Å | 1.42Å | Aromatic |
| C6 | N8 | doub | 1.32Å | 1.36Å | Aromatic |
| C7 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | H17 | sing | 1.08Å | 1.08Å | |
| N8 | C10 | sing | 1.32Å | 1.35Å | Aromatic |
| C9 | C11 | sing | 1.39Å | 1.40Å | Aromatic |
| C9 | H18 | sing | 1.08Å | 1.08Å | |
| C10 | C11 | doub | 1.38Å | 1.41Å | Aromatic |
| C10 | H19 | sing | 1.08Å | 1.08Å | |
| C11 | H20 | sing | 1.08Å | 1.08Å | |
| N21 | C22 | sing | 1.46Å | 1.46Å | |
| N21 | H28 | sing | 0.97Å | 1.00Å | |
| C22 | C23 | sing | 1.51Å | 1.53Å | |
| C22 | C25 | sing | 1.53Å | 1.53Å | |
| C22 | H29 | sing | 1.09Å | 1.09Å | |
| C23 | O24 | doub | 1.21Å | 1.23Å | |
| C23 | N37 | sing | 1.35Å | 1.33Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C25 | C27 | sing | 1.53Å | 1.54Å | |
| C25 | H30 | sing | 1.09Å | 1.09Å | |
| C26 | H31 | sing | 1.09Å | 1.09Å | |
| C26 | H32 | sing | 1.09Å | 1.09Å | |
| C26 | H33 | sing | 1.09Å | 1.09Å | |
| C27 | H34 | sing | 1.09Å | 1.09Å | |
| C27 | H35 | sing | 1.09Å | 1.09Å | |
| C27 | H36 | sing | 1.09Å | 1.09Å | |
| N37 | C38 | sing | 1.46Å | 1.46Å | |
| N37 | H59 | sing | 0.97Å | 1.00Å | |
| C38 | C39 | sing | 1.53Å | 1.51Å | |
| C38 | C46 | sing | 1.53Å | 1.53Å | |
| C38 | H60 | sing | 1.09Å | 1.09Å | |
| C39 | C40 | sing | 1.51Å | 1.48Å | |
| C39 | H61 | sing | 1.09Å | 1.09Å | |
| C39 | H62 | sing | 1.09Å | 1.09Å | |
| C40 | C41 | doub | 1.38Å | 1.40Å | Aromatic |
| C40 | C45 | sing | 1.38Å | 1.40Å | Aromatic |
| C41 | C42 | sing | 1.38Å | 1.40Å | Aromatic |
| C41 | H63 | sing | 1.08Å | 1.08Å | |
| C42 | C43 | doub | 1.38Å | 1.40Å | Aromatic |
| C42 | H64 | sing | 1.08Å | 1.08Å | |
| C43 | C44 | sing | 1.38Å | 1.40Å | Aromatic |
| C43 | H65 | sing | 1.08Å | 1.08Å | |
| C44 | C45 | doub | 1.38Å | 1.39Å | Aromatic |
| C44 | H66 | sing | 1.08Å | 1.08Å | |
| C45 | H67 | sing | 1.08Å | 1.08Å | |
| C46 | F1 | sing | 1.40Å | 1.35Å | |
| C46 | F2 | sing | 1.40Å | 1.35Å | |
| C46 | C49 | sing | 1.53Å | 1.54Å | |
| C49 | O47 | sing | 1.43Å | 1.39Å | |
| C49 | O48 | sing | 1.43Å | 1.39Å | |
| C49 | C51 | sing | 1.53Å | 1.54Å | |
| O47 | H68 | sing | 0.97Å | 0.94Å | |
| O48 | H69 | sing | 0.97Å | 0.94Å | |
| N50 | C51 | sing | 1.47Å | 1.45Å | |
| N50 | C83 | sing | 1.35Å | 1.33Å | |
| N50 | H72 | sing | 0.97Å | 1.00Å | |
| C51 | C52 | sing | 1.53Å | 1.54Å | |
| C51 | H73 | sing | 1.09Å | 1.09Å | |
| C52 | C53 | sing | 1.51Å | 1.50Å | |
| C52 | H74 | sing | 1.09Å | 1.09Å | |
| C52 | H75 | sing | 1.09Å | 1.09Å | |
| C53 | C54 | doub | 1.38Å | 1.40Å | Aromatic |
| C53 | C58 | sing | 1.38Å | 1.40Å | Aromatic |
| C54 | C55 | sing | 1.38Å | 1.41Å | Aromatic |
| C54 | H76 | sing | 1.08Å | 1.08Å | |
| C55 | C56 | doub | 1.38Å | 1.39Å | Aromatic |
| C55 | H77 | sing | 1.08Å | 1.08Å | |
| C56 | C57 | sing | 1.38Å | 1.39Å | Aromatic |
| C56 | H78 | sing | 1.08Å | 1.08Å | |
| C57 | C58 | doub | 1.38Å | 1.40Å | Aromatic |
| C57 | H79 | sing | 1.08Å | 1.08Å | |
| C58 | H80 | sing | 1.08Å | 1.08Å | |
| N81 | C82 | sing | 1.46Å | 1.44Å | |
| N81 | C97 | sing | 1.35Å | 1.36Å | |
| N81 | H88 | sing | 0.97Å | 1.01Å | |
| C82 | C83 | sing | 1.51Å | 1.53Å | |
| C82 | C85 | sing | 1.53Å | 1.52Å | |
| C82 | H89 | sing | 1.09Å | 1.09Å | |
| C83 | O84 | doub | 1.21Å | 1.21Å | |
| C85 | C86 | sing | 1.53Å | 1.53Å | |
| C85 | C87 | sing | 1.53Å | 1.55Å | |
| C85 | H90 | sing | 1.09Å | 1.09Å | |
| C86 | H91 | sing | 1.09Å | 1.09Å | |
| C86 | H92 | sing | 1.09Å | 1.09Å | |
| C86 | H93 | sing | 1.09Å | 1.09Å | |
| C87 | H94 | sing | 1.09Å | 1.09Å | |
| C87 | H95 | sing | 1.09Å | 1.09Å | |
| C87 | H96 | sing | 1.09Å | 1.09Å | |
| C97 | O98 | doub | 1.22Å | 1.23Å | |
| C97 | N99 | sing | 1.35Å | 1.35Å | |
| N99 | C2 | sing | 1.46Å | 1.47Å | |
| N99 | C3 | sing | 1.47Å | 1.46Å | |
| C2 | H1 | sing | 1.09Å | 1.09Å | |
| C2 | H10 | sing | 1.09Å | 1.09Å | |
| C2 | H11 | sing | 1.09Å | 1.09Å | |
| C3 | C8 | sing | 1.51Å | 1.52Å | |
| C3 | H2 | sing | 1.09Å | 1.09Å | |
| C3 | H3 | sing | 1.09Å | 1.09Å | |
| C8 | C12 | sing | 1.38Å | 1.41Å | Aromatic |
| C8 | N10 | doub | 1.32Å | 1.35Å | Aromatic |
| C12 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C12 | H4 | sing | 1.08Å | 1.08Å | |
| N10 | C14 | sing | 1.32Å | 1.33Å | Aromatic |
| C13 | C15 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | H5 | sing | 1.08Å | 1.08Å | |
| C14 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | H6 | sing | 1.08Å | 1.08Å | |
| C15 | H7 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C1 | N3 | 120.7° | 120.0° |
| O2 | C1 | N21 | 121.2° | 120.0° |
| N3 | C1 | N21 | 118.1° | 120.0° |
| C1 | N3 | C4 | 125.0° | 119.9° |
| C1 | N3 | C5 | 119.4° | 120.0° |
| C1 | N21 | C22 | 121.4° | 120.0° |
| C1 | N21 | H28 | 122.9° | 120.0° |
| C4 | N3 | C5 | 115.5° | 120.0° |
| N3 | C4 | H12 | 110.6° | 109.5° |
| N3 | C4 | H13 | 112.6° | 109.5° |
| N3 | C4 | H14 | 109.7° | 109.5° |
| N3 | C5 | C6 | 111.0° | 109.5° |
| N3 | C5 | H15 | 110.3° | 109.5° |
| N3 | C5 | H16 | 110.5° | 109.4° |
| H12 | C4 | H13 | 107.8° | 109.4° |
| H12 | C4 | H14 | 107.8° | 109.5° |
| H13 | C4 | H14 | 108.2° | 109.4° |
| C6 | C5 | H15 | 108.8° | 109.5° |
| C6 | C5 | H16 | 111.0° | 109.5° |
| C5 | C6 | C7 | 120.1° | 119.6° |
| C5 | C6 | N8 | 116.4° | 119.6° |
| H15 | C5 | H16 | 105.1° | 109.4° |
| C7 | C6 | N8 | 123.5° | 120.7° |
| C6 | C7 | C9 | 118.8° | 119.2° |
| C6 | C7 | H17 | 121.6° | 120.4° |
| C6 | N8 | C10 | 116.1° | 121.7° |
| C9 | C7 | H17 | 119.6° | 120.4° |
| C7 | C9 | C11 | 118.6° | 118.4° |
| C7 | C9 | H18 | 120.0° | 120.8° |
| N8 | C10 | C11 | 124.6° | 120.8° |
| N8 | C10 | H19 | 117.5° | 119.6° |
| C11 | C9 | H18 | 121.4° | 120.8° |
| C9 | C11 | C10 | 118.3° | 119.1° |
| C9 | C11 | H20 | 120.7° | 120.4° |
| C11 | C10 | H19 | 118.0° | 119.6° |
| C10 | C11 | H20 | 121.0° | 120.4° |
| C22 | N21 | H28 | 115.7° | 120.0° |
| N21 | C22 | C23 | 109.2° | 109.5° |
| N21 | C22 | C25 | 111.3° | 109.5° |
| N21 | C22 | H29 | 109.5° | 109.4° |
| C23 | C22 | C25 | 113.1° | 109.5° |
| C23 | C22 | H29 | 107.2° | 109.5° |
| C22 | C23 | O24 | 123.6° | 120.0° |
| C22 | C23 | N37 | 113.1° | 120.0° |
| C25 | C22 | H29 | 106.4° | 109.5° |
| C22 | C25 | C26 | 110.7° | 109.5° |
| C22 | C25 | C27 | 112.4° | 109.5° |
| C22 | C25 | H30 | 107.8° | 109.5° |
| O24 | C23 | N37 | 123.3° | 120.0° |
| C23 | N37 | C38 | 121.9° | 120.0° |
| C23 | N37 | H59 | 120.2° | 120.0° |
| C26 | C25 | C27 | 109.5° | 109.4° |
| C26 | C25 | H30 | 108.1° | 109.4° |
| C25 | C26 | H31 | 112.2° | 109.5° |
| C25 | C26 | H32 | 112.4° | 109.5° |
| C25 | C26 | H33 | 111.1° | 109.5° |
| C27 | C25 | H30 | 108.1° | 109.5° |
| C25 | C27 | H34 | 111.3° | 109.4° |
| C25 | C27 | H35 | 111.6° | 109.4° |
| C25 | C27 | H36 | 111.4° | 109.5° |
| H31 | C26 | H32 | 107.6° | 109.5° |
| H31 | C26 | H33 | 107.6° | 109.5° |
| H32 | C26 | H33 | 105.8° | 109.4° |
| H34 | C27 | H35 | 107.1° | 109.5° |
| H34 | C27 | H36 | 106.8° | 109.5° |
| H35 | C27 | H36 | 108.4° | 109.5° |
| C38 | N37 | H59 | 117.9° | 120.0° |
| N37 | C38 | C39 | 109.4° | 109.5° |
| N37 | C38 | C46 | 108.8° | 109.5° |
| N37 | C38 | H60 | 108.3° | 109.4° |
| C39 | C38 | C46 | 112.9° | 109.5° |
| C39 | C38 | H60 | 109.3° | 109.5° |
| C38 | C39 | C40 | 107.3° | 109.4° |
| C38 | C39 | H61 | 115.8° | 109.4° |
| C38 | C39 | H62 | 110.4° | 109.4° |
| C46 | C38 | H60 | 108.2° | 109.4° |
| C38 | C46 | F1 | 110.3° | 109.5° |
| C38 | C46 | F2 | 111.2° | 109.5° |
| C38 | C46 | C49 | 117.4° | 109.5° |
| C40 | C39 | H61 | 108.1° | 109.5° |
| C40 | C39 | H62 | 110.3° | 109.6° |
| C39 | C40 | C41 | 119.8° | 120.0° |
| C39 | C40 | C45 | 119.6° | 120.0° |
| H61 | C39 | H62 | 104.8° | 109.5° |
| C41 | C40 | C45 | 120.6° | 120.0° |
| C40 | C41 | C42 | 119.7° | 120.0° |
| C40 | C41 | H63 | 120.7° | 120.0° |
| C40 | C45 | C44 | 119.8° | 120.0° |
| C40 | C45 | H67 | 120.7° | 120.0° |
| C42 | C41 | H63 | 119.6° | 120.0° |
| C41 | C42 | C43 | 119.7° | 120.0° |
| C41 | C42 | H64 | 120.4° | 120.0° |
| C43 | C42 | H64 | 119.9° | 120.0° |
| C42 | C43 | C44 | 120.5° | 120.0° |
| C42 | C43 | H65 | 119.2° | 120.0° |
| C44 | C43 | H65 | 120.3° | 120.0° |
| C43 | C44 | C45 | 119.8° | 120.0° |
| C43 | C44 | H66 | 119.8° | 120.0° |
| C45 | C44 | H66 | 120.3° | 120.0° |
| C44 | C45 | H67 | 119.5° | 120.0° |
| F1 | C46 | F2 | 102.3° | 109.4° |
| F1 | C46 | C49 | 108.1° | 109.4° |
| F2 | C46 | C49 | 106.4° | 109.5° |
| C46 | C49 | O47 | 107.5° | 109.5° |
| C46 | C49 | O48 | 109.0° | 109.5° |
| C46 | C49 | C51 | 113.6° | 109.4° |
| O47 | C49 | O48 | 106.6° | 109.5° |
| O47 | C49 | C51 | 109.1° | 109.5° |
| C49 | O47 | H68 | 108.7° | 106.8° |
| O48 | C49 | C51 | 110.7° | 109.5° |
| C49 | O48 | H69 | 104.2° | 106.8° |
| C49 | C51 | N50 | 106.5° | 109.4° |
| C49 | C51 | C52 | 116.9° | 109.4° |
| C49 | C51 | H73 | 108.1° | 109.5° |
| C51 | N50 | C83 | 123.0° | 120.0° |
| C51 | N50 | H72 | 117.5° | 120.0° |
| N50 | C51 | C52 | 109.3° | 109.4° |
| N50 | C51 | H73 | 109.2° | 109.5° |
| C83 | N50 | H72 | 119.5° | 120.0° |
| N50 | C83 | C82 | 113.7° | 120.0° |
| N50 | C83 | O84 | 122.2° | 120.0° |
| C52 | C51 | H73 | 106.6° | 109.5° |
| C51 | C52 | C53 | 109.0° | 109.4° |
| C51 | C52 | H74 | 112.1° | 109.5° |
| C51 | C52 | H75 | 110.9° | 109.4° |
| C53 | C52 | H74 | 109.4° | 109.5° |
| C53 | C52 | H75 | 109.4° | 109.5° |
| C52 | C53 | C54 | 120.7° | 120.0° |
| C52 | C53 | C58 | 120.4° | 120.0° |
| H74 | C52 | H75 | 106.0° | 109.6° |
| C54 | C53 | C58 | 118.8° | 120.0° |
| C53 | C54 | C55 | 120.7° | 120.0° |
| C53 | C54 | H76 | 119.4° | 120.0° |
| C53 | C58 | C57 | 120.2° | 120.0° |
| C53 | C58 | H80 | 120.3° | 120.0° |
| C55 | C54 | H76 | 119.9° | 120.0° |
| C54 | C55 | C56 | 120.0° | 120.0° |
| C54 | C55 | H77 | 119.8° | 120.0° |
| C56 | C55 | H77 | 120.2° | 120.0° |
| C55 | C56 | C57 | 119.1° | 120.0° |
| C55 | C56 | H78 | 121.5° | 120.0° |
| C57 | C56 | H78 | 119.3° | 120.0° |
| C56 | C57 | C58 | 121.1° | 120.0° |
| C56 | C57 | H79 | 119.6° | 120.0° |
| C58 | C57 | H79 | 119.3° | 120.0° |
| C57 | C58 | H80 | 119.5° | 120.0° |
| C82 | N81 | C97 | 123.4° | 120.0° |
| C82 | N81 | H88 | 114.2° | 120.0° |
| N81 | C82 | C83 | 109.0° | 109.5° |
| N81 | C82 | C85 | 111.3° | 109.4° |
| N81 | C82 | H89 | 108.5° | 109.5° |
| C97 | N81 | H88 | 122.4° | 120.0° |
| N81 | C97 | O98 | 122.1° | 120.0° |
| N81 | C97 | N99 | 117.9° | 120.0° |
| C83 | C82 | C85 | 114.6° | 109.5° |
| C83 | C82 | H89 | 106.4° | 109.5° |
| C82 | C83 | O84 | 124.1° | 120.0° |
| C85 | C82 | H89 | 106.8° | 109.4° |
| C82 | C85 | C86 | 106.4° | 109.5° |
| C82 | C85 | C87 | 112.0° | 109.4° |
| C82 | C85 | H90 | 109.1° | 109.5° |
| C86 | C85 | C87 | 112.5° | 109.5° |
| C86 | C85 | H90 | 108.7° | 109.5° |
| C85 | C86 | H91 | 111.2° | 109.4° |
| C85 | C86 | H92 | 111.5° | 109.4° |
| C85 | C86 | H93 | 111.9° | 109.5° |
| C87 | C85 | H90 | 108.1° | 109.5° |
| C85 | C87 | H94 | 111.5° | 109.4° |
| C85 | C87 | H95 | 111.0° | 109.5° |
| C85 | C87 | H96 | 112.2° | 109.5° |
| H91 | C86 | H92 | 106.8° | 109.5° |
| H91 | C86 | H93 | 107.2° | 109.5° |
| H92 | C86 | H93 | 108.0° | 109.5° |
| H94 | C87 | H95 | 106.3° | 109.5° |
| H94 | C87 | H96 | 108.2° | 109.4° |
| H95 | C87 | H96 | 107.3° | 109.5° |
| O98 | C97 | N99 | 120.0° | 120.0° |
| C97 | N99 | C2 | 122.2° | 120.0° |
| C97 | N99 | C3 | 120.2° | 120.0° |
| C2 | N99 | C3 | 117.6° | 120.0° |
| N99 | C2 | H1 | 110.1° | 109.5° |
| N99 | C2 | H10 | 111.2° | 109.4° |
| N99 | C2 | H11 | 111.0° | 109.5° |
| N99 | C3 | C8 | 111.0° | 109.5° |
| N99 | C3 | H2 | 109.3° | 109.4° |
| N99 | C3 | H3 | 110.4° | 109.4° |
| H1 | C2 | H10 | 108.4° | 109.4° |
| H1 | C2 | H11 | 108.5° | 109.5° |
| H10 | C2 | H11 | 107.4° | 109.5° |
| C8 | C3 | H2 | 109.1° | 109.5° |
| C8 | C3 | H3 | 111.1° | 109.5° |
| C3 | C8 | C12 | 119.9° | 119.6° |
| C3 | C8 | N10 | 117.4° | 119.6° |
| H2 | C3 | H3 | 105.8° | 109.5° |
| C12 | C8 | N10 | 122.7° | 120.8° |
| C8 | C12 | C13 | 118.6° | 119.1° |
| C8 | C12 | H4 | 120.6° | 120.5° |
| C8 | N10 | C14 | 117.8° | 121.7° |
| C13 | C12 | H4 | 120.8° | 120.4° |
| C12 | C13 | C15 | 118.4° | 118.4° |
| C12 | C13 | H5 | 120.3° | 120.8° |
| N10 | C14 | C15 | 123.7° | 120.8° |
| N10 | C14 | H6 | 117.7° | 119.6° |
| C15 | C13 | H5 | 121.3° | 120.8° |
| C13 | C15 | C14 | 118.8° | 119.1° |
| C13 | C15 | H7 | 120.8° | 120.4° |
| C15 | C14 | H6 | 118.6° | 119.6° |
| C14 | C15 | H7 | 120.4° | 120.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C1 | N3 | N21 | 179.3° | 179.9° |
| O2 | C1 | N3 | C4 | 173.5° | 4.5° |
| O2 | C1 | N3 | C5 | 3.9° | 175.5° |
| O2 | C1 | N21 | C22 | 5.5° | 5.1° |
| O2 | C1 | N21 | H28 | 176.6° | 175.0° |
| C1 | N3 | C4 | C5 | 177.4° | 180.0° |
| C1 | N3 | C4 | H12 | 53.6° | 5.1° |
| C1 | N3 | C4 | H13 | 174.2° | 114.9° |
| C1 | N3 | C4 | H14 | 65.2° | 125.1° |
| C1 | N3 | C5 | C6 | 86.4° | 90.0° |
| C1 | N3 | C5 | H15 | 152.9° | 149.9° |
| C1 | N3 | C5 | H16 | 37.1° | 30.0° |
| N3 | C1 | N21 | C22 | 175.2° | 174.9° |
| N3 | C1 | N21 | H28 | 2.7° | 5.1° |
| N21 | C1 | N3 | C4 | 7.2° | 175.6° |
| N21 | C1 | N3 | C5 | 175.5° | 4.4° |
| C1 | N21 | C22 | H28 | 178.1° | 179.9° |
| C1 | N21 | C22 | C23 | 107.3° | 150.0° |
| C1 | N21 | C22 | C25 | 127.1° | 90.0° |
| C1 | N21 | C22 | H29 | 9.8° | 30.0° |
| N3 | C4 | H12 | H13 | 123.4° | 120.0° |
| N3 | C4 | H12 | H14 | 120.0° | 120.0° |
| N3 | C4 | H13 | H14 | 121.4° | 120.0° |
| C4 | N3 | C5 | C6 | 91.2° | 90.0° |
| C4 | N3 | C5 | H15 | 29.5° | 30.1° |
| C4 | N3 | C5 | H16 | 145.3° | 150.0° |
| C5 | N3 | C4 | H12 | 123.9° | 174.9° |
| C5 | N3 | C4 | H13 | 3.2° | 65.1° |
| C5 | N3 | C4 | H14 | 117.3° | 54.8° |
| N3 | C5 | C6 | H15 | 121.6° | 120.0° |
| N3 | C5 | C6 | H16 | 123.3° | 120.0° |
| N3 | C5 | H15 | H16 | 119.1° | 119.9° |
| N3 | C5 | C6 | C7 | 80.1° | 180.0° |
| N3 | C5 | C6 | N8 | 102.2° | 0.3° |
| H12 | C4 | H13 | H14 | 116.3° | 120.0° |
| C6 | C5 | H15 | H16 | 118.9° | 120.0° |
| C5 | C6 | C7 | N8 | 177.6° | 179.7° |
| C5 | C6 | C7 | C9 | 177.2° | 180.0° |
| C5 | C6 | C7 | H17 | 2.9° | 0.1° |
| C5 | C6 | N8 | C10 | 176.1° | 179.8° |
| H15 | C5 | C6 | C7 | 158.4° | 60.0° |
| H15 | C5 | C6 | N8 | 19.4° | 120.3° |
| H16 | C5 | C6 | C7 | 43.2° | 60.0° |
| H16 | C5 | C6 | N8 | 134.6° | 119.7° |
| C6 | C7 | C9 | H17 | 180.0° | 180.0° |
| C7 | C6 | N8 | C10 | 1.6° | 0.5° |
| C6 | C7 | C9 | C11 | 0.8° | 0.0° |
| C6 | C7 | C9 | H18 | 178.4° | 180.0° |
| N8 | C6 | C7 | C9 | 0.4° | 0.3° |
| N8 | C6 | C7 | H17 | 179.5° | 179.8° |
| C6 | N8 | C10 | C11 | 1.6° | 0.5° |
| C6 | N8 | C10 | H19 | 179.9° | 179.7° |
| C7 | C9 | C11 | H18 | 179.1° | 180.0° |
| C7 | C9 | C11 | C10 | 0.8° | 0.0° |
| C7 | C9 | C11 | H20 | 179.5° | 180.0° |
| H17 | C7 | C9 | C11 | 179.3° | 180.0° |
| H17 | C7 | C9 | H18 | 1.6° | 0.0° |
| N8 | C10 | C11 | C9 | 0.5° | 0.3° |
| N8 | C10 | C11 | H19 | 178.3° | 179.8° |
| N8 | C10 | C11 | H20 | 178.3° | 179.7° |
| C9 | C11 | C10 | H20 | 178.7° | 180.0° |
| C9 | C11 | C10 | H19 | 178.7° | 180.0° |
| H18 | C9 | C11 | C10 | 178.4° | 180.0° |
| H18 | C9 | C11 | H20 | 0.4° | 0.0° |
| H19 | C10 | C11 | H20 | 0.0° | 0.0° |
| N21 | C22 | C23 | C25 | 124.5° | 120.1° |
| N21 | C22 | C23 | H29 | 118.5° | 119.9° |
| N21 | C22 | C25 | H29 | 119.2° | 120.0° |
| N21 | C22 | C23 | O24 | 97.0° | 19.9° |
| N21 | C22 | C23 | N37 | 83.8° | 160.2° |
| N21 | C22 | C25 | C26 | 179.3° | 66.0° |
| N21 | C22 | C25 | C27 | 57.9° | 174.0° |
| N21 | C22 | C25 | H30 | 61.2° | 54.0° |
| H28 | N21 | C22 | C23 | 70.8° | 30.1° |
| H28 | N21 | C22 | C25 | 54.8° | 90.0° |
| H28 | N21 | C22 | H29 | 172.1° | 150.0° |
| C23 | C22 | C25 | H29 | 117.4° | 120.0° |
| C22 | C23 | O24 | N37 | 179.1° | 180.0° |
| C23 | C22 | C25 | C26 | 55.9° | 54.0° |
| C23 | C22 | C25 | C27 | 178.7° | 66.0° |
| C23 | C22 | C25 | H30 | 62.2° | 174.0° |
| C22 | C23 | N37 | C38 | 167.9° | 173.1° |
| C22 | C23 | N37 | H59 | 10.1° | 6.9° |
| C25 | C22 | C23 | O24 | 27.5° | 100.2° |
| C25 | C22 | C23 | N37 | 151.7° | 79.7° |
| C22 | C25 | C26 | C27 | 124.5° | 120.0° |
| C22 | C25 | C26 | H30 | 117.9° | 120.0° |
| C22 | C25 | C27 | H30 | 118.9° | 120.1° |
| C22 | C25 | C26 | H31 | 61.0° | 180.0° |
| C22 | C25 | C26 | H32 | 60.4° | 60.0° |
| C22 | C25 | C26 | H33 | 178.6° | 60.0° |
| C22 | C25 | C27 | H34 | 61.0° | 61.7° |
| C22 | C25 | C27 | H35 | 58.6° | 58.3° |
| C22 | C25 | C27 | H36 | 179.9° | 178.3° |
| H29 | C22 | C23 | O24 | 144.5° | 139.8° |
| H29 | C22 | C23 | N37 | 34.7° | 40.3° |
| H29 | C22 | C25 | C26 | 61.6° | 174.0° |
| H29 | C22 | C25 | C27 | 61.2° | 54.0° |
| H29 | C22 | C25 | H30 | 179.7° | 66.0° |
| O24 | C23 | N37 | C38 | 11.3° | 7.0° |
| O24 | C23 | N37 | H59 | 170.8° | 173.1° |
| C23 | N37 | C38 | H59 | 178.0° | 180.0° |
| C23 | N37 | C38 | C39 | 139.9° | 97.9° |
| C23 | N37 | C38 | C46 | 96.5° | 142.0° |
| C23 | N37 | C38 | H60 | 20.9° | 22.1° |
| C26 | C25 | C27 | H30 | 117.6° | 119.9° |
| C25 | C26 | H31 | H32 | 124.0° | 120.0° |
| C25 | C26 | H31 | H33 | 122.4° | 120.1° |
| C25 | C26 | H32 | H33 | 121.4° | 120.0° |
| C26 | C25 | C27 | H34 | 175.5° | 58.3° |
| C26 | C25 | C27 | H35 | 64.9° | 178.3° |
| C26 | C25 | C27 | H36 | 56.4° | 61.7° |
| C27 | C25 | C26 | H31 | 63.5° | 60.0° |
| C27 | C25 | C26 | H32 | 175.1° | 180.0° |
| C27 | C25 | C26 | H33 | 56.9° | 60.1° |
| C25 | C27 | H34 | H35 | 122.2° | 119.9° |
| C25 | C27 | H34 | H36 | 121.8° | 120.0° |
| C25 | C27 | H35 | H36 | 123.1° | 120.0° |
| H30 | C25 | C26 | H31 | 178.9° | 60.0° |
| H30 | C25 | C26 | H32 | 57.6° | 60.0° |
| H30 | C25 | C26 | H33 | 60.7° | 180.0° |
| H30 | C25 | C27 | H34 | 57.9° | 178.2° |
| H30 | C25 | C27 | H35 | 177.5° | 61.8° |
| H30 | C25 | C27 | H36 | 61.2° | 58.2° |
| H31 | C26 | H32 | H33 | 114.7° | 119.9° |
| H34 | C27 | H35 | H36 | 114.9° | 120.1° |
| N37 | C38 | C39 | C46 | 121.2° | 120.0° |
| N37 | C38 | C39 | H60 | 118.4° | 120.0° |
| N37 | C38 | C46 | H60 | 117.4° | 119.9° |
| N37 | C38 | C39 | C40 | 57.4° | 60.0° |
| N37 | C38 | C39 | H61 | 178.2° | 60.0° |
| N37 | C38 | C39 | H62 | 62.9° | 179.9° |
| N37 | C38 | C46 | F1 | 78.4° | 55.5° |
| N37 | C38 | C46 | F2 | 34.4° | 175.5° |
| N37 | C38 | C46 | C49 | 157.3° | 64.4° |
| H59 | N37 | C38 | C39 | 42.2° | 82.0° |
| H59 | N37 | C38 | C46 | 81.5° | 38.0° |
| H59 | N37 | C38 | H60 | 161.2° | 157.9° |
| C39 | C38 | C46 | H60 | 121.0° | 120.0° |
| C38 | C39 | C40 | H61 | 125.6° | 119.9° |
| C38 | C39 | C40 | H62 | 120.4° | 120.0° |
| C38 | C39 | H61 | H62 | 122.0° | 119.9° |
| C38 | C39 | C40 | C41 | 97.0° | 90.0° |
| C38 | C39 | C40 | C45 | 80.4° | 90.4° |
| C39 | C38 | C46 | F1 | 43.2° | 64.5° |
| C39 | C38 | C46 | F2 | 156.0° | 55.5° |
| C39 | C38 | C46 | C49 | 81.2° | 175.5° |
| C46 | C38 | C39 | C40 | 178.6° | 180.0° |
| C46 | C38 | C39 | H61 | 60.6° | 60.0° |
| C46 | C38 | C39 | H62 | 58.3° | 59.9° |
| C38 | C46 | F1 | F2 | 118.4° | 120.0° |
| C38 | C46 | F1 | C49 | 129.5° | 120.0° |
| C38 | C46 | F2 | C49 | 128.9° | 120.1° |
| C38 | C46 | C49 | O47 | 41.8° | 30.6° |
| C38 | C46 | C49 | O48 | 157.0° | 150.6° |
| C38 | C46 | C49 | C51 | 79.0° | 89.4° |
| H60 | C38 | C39 | C40 | 61.0° | 60.0° |
| H60 | C38 | C39 | H61 | 59.8° | 180.0° |
| H60 | C38 | C39 | H62 | 178.7° | 60.1° |
| H60 | C38 | C46 | F1 | 164.2° | 175.5° |
| H60 | C38 | C46 | F2 | 83.0° | 64.6° |
| H60 | C38 | C46 | C49 | 39.9° | 55.5° |
| C40 | C39 | H61 | H62 | 117.6° | 120.2° |
| C39 | C40 | C41 | C45 | 177.4° | 179.6° |
| C39 | C40 | C41 | C42 | 177.1° | 179.9° |
| C39 | C40 | C41 | H63 | 3.3° | 0.1° |
| C39 | C40 | C45 | C44 | 176.8° | 179.8° |
| C39 | C40 | C45 | H67 | 3.1° | 0.4° |
| H61 | C39 | C40 | C41 | 137.4° | 29.9° |
| H61 | C39 | C40 | C45 | 45.2° | 149.7° |
| H62 | C39 | C40 | C41 | 23.3° | 150.0° |
| H62 | C39 | C40 | C45 | 159.2° | 29.6° |
| C40 | C41 | C42 | H63 | 179.5° | 180.0° |
| C40 | C41 | C42 | C43 | 0.4° | 0.0° |
| C40 | C41 | C42 | H64 | 178.7° | 179.9° |
| C41 | C40 | C45 | C44 | 0.6° | 0.5° |
| C41 | C40 | C45 | H67 | 179.5° | 180.0° |
| C45 | C40 | C41 | C42 | 0.2° | 0.3° |
| C45 | C40 | C41 | H63 | 179.3° | 179.7° |
| C40 | C45 | C44 | C43 | 0.2° | 0.5° |
| C40 | C45 | C44 | H67 | 179.9° | 179.5° |
| C40 | C45 | C44 | H66 | 179.9° | 179.6° |
| C41 | C42 | C43 | H64 | 179.2° | 179.9° |
| C41 | C42 | C43 | C44 | 0.8° | 0.1° |
| C41 | C42 | C43 | H65 | 179.0° | 179.9° |
| H63 | C41 | C42 | C43 | 180.0° | 180.0° |
| H63 | C41 | C42 | H64 | 0.8° | 0.1° |
| C42 | C43 | C44 | H65 | 179.8° | 180.0° |
| C42 | C43 | C44 | C45 | 0.5° | 0.2° |
| C42 | C43 | C44 | H66 | 179.4° | 179.9° |
| H64 | C42 | C43 | C44 | 178.4° | 180.0° |
| H64 | C42 | C43 | H65 | 1.8° | 0.0° |
| C43 | C44 | C45 | H66 | 179.8° | 179.9° |
| C43 | C44 | C45 | H67 | 179.9° | 180.0° |
| H65 | C43 | C44 | C45 | 179.3° | 179.8° |
| H65 | C43 | C44 | H66 | 0.9° | 0.0° |
| H66 | C44 | C45 | H67 | 0.0° | 0.2° |
| F1 | C46 | F2 | C49 | 113.3° | 120.0° |
| F1 | C46 | C49 | O47 | 83.7° | 89.4° |
| F1 | C46 | C49 | O48 | 31.5° | 30.6° |
| F1 | C46 | C49 | C51 | 155.5° | 150.6° |
| F2 | C46 | C49 | O47 | 167.0° | 150.6° |
| F2 | C46 | C49 | O48 | 77.8° | 89.4° |
| F2 | C46 | C49 | C51 | 46.2° | 30.6° |
| C46 | C49 | O47 | O48 | 116.7° | 120.0° |
| C46 | C49 | O47 | C51 | 123.6° | 119.9° |
| C46 | C49 | O48 | C51 | 125.6° | 119.9° |
| C46 | C49 | O47 | H68 | 67.4° | 60.0° |
| C46 | C49 | O48 | H69 | 24.1° | 55.2° |
| C46 | C49 | C51 | N50 | 155.6° | 174.3° |
| C46 | C49 | C51 | C52 | 81.9° | 65.8° |
| C46 | C49 | C51 | H73 | 38.3° | 54.2° |
| O47 | C49 | O48 | C51 | 118.6° | 120.0° |
| O47 | C49 | O48 | H69 | 139.9° | 175.3° |
| O47 | C49 | C51 | N50 | 35.6° | 65.7° |
| O47 | C49 | C51 | C52 | 158.1° | 54.2° |
| O47 | C49 | C51 | H73 | 81.7° | 174.2° |
| O48 | C49 | O47 | H68 | 175.9° | 180.0° |
| O48 | C49 | C51 | N50 | 81.4° | 54.3° |
| O48 | C49 | C51 | C52 | 41.1° | 174.2° |
| O48 | C49 | C51 | H73 | 161.3° | 65.8° |
| C51 | C49 | O47 | H68 | 56.2° | 59.9° |
| C51 | C49 | O48 | H69 | 101.5° | 64.7° |
| C49 | C51 | N50 | C52 | 127.2° | 119.9° |
| C49 | C51 | N50 | H73 | 116.6° | 120.0° |
| C49 | C51 | N50 | C83 | 100.0° | 150.0° |
| C49 | C51 | N50 | H72 | 78.9° | 29.9° |
| C49 | C51 | C52 | H73 | 121.0° | 120.0° |
| C49 | C51 | C52 | C53 | 173.6° | 176.6° |
| C49 | C51 | C52 | H74 | 65.1° | 63.4° |
| C49 | C51 | C52 | H75 | 53.1° | 56.6° |
| C51 | N50 | C83 | H72 | 178.9° | 179.9° |
| N50 | C51 | C52 | H73 | 117.9° | 120.0° |
| N50 | C51 | C52 | C53 | 52.5° | 63.5° |
| N50 | C51 | C52 | H74 | 173.8° | 56.5° |
| N50 | C51 | C52 | H75 | 67.9° | 176.6° |
| C51 | N50 | C83 | C82 | 167.7° | 175.4° |
| C51 | N50 | C83 | O84 | 9.5° | 4.7° |
| C83 | N50 | C51 | C52 | 132.8° | 90.0° |
| C83 | N50 | C51 | H73 | 16.6° | 30.0° |
| N50 | C83 | C82 | N81 | 84.2° | 176.5° |
| N50 | C83 | C82 | O84 | 177.1° | 179.9° |
| N50 | C83 | C82 | C85 | 150.3° | 63.5° |
| N50 | C83 | C82 | H89 | 32.5° | 56.4° |
| H72 | N50 | C51 | C52 | 48.2° | 90.0° |
| H72 | N50 | C51 | H73 | 164.5° | 150.0° |
| H72 | N50 | C83 | C82 | 11.2° | 4.7° |
| H72 | N50 | C83 | O84 | 171.6° | 175.2° |
| C51 | C52 | C53 | H74 | 122.9° | 120.0° |
| C51 | C52 | C53 | H75 | 121.4° | 119.9° |
| C51 | C52 | H74 | H75 | 121.1° | 120.0° |
| C51 | C52 | C53 | C54 | 76.6° | 90.0° |
| C51 | C52 | C53 | C58 | 99.8° | 90.3° |
| H73 | C51 | C52 | C53 | 65.4° | 56.6° |
| H73 | C51 | C52 | H74 | 55.9° | 176.5° |
| H73 | C51 | C52 | H75 | 174.1° | 63.4° |
| C53 | C52 | H74 | H75 | 117.8° | 120.1° |
| C52 | C53 | C54 | C58 | 176.5° | 179.7° |
| C52 | C53 | C54 | C55 | 176.5° | 180.0° |
| C52 | C53 | C54 | H76 | 3.9° | 0.0° |
| C52 | C53 | C58 | C57 | 176.0° | 179.8° |
| C52 | C53 | C58 | H80 | 3.8° | 0.2° |
| H74 | C52 | C53 | C54 | 46.4° | 29.9° |
| H74 | C52 | C53 | C58 | 137.2° | 149.8° |
| H75 | C52 | C53 | C54 | 162.0° | 150.1° |
| H75 | C52 | C53 | C58 | 21.6° | 29.6° |
| C53 | C54 | C55 | H76 | 179.6° | 180.0° |
| C53 | C54 | C55 | C56 | 0.6° | 0.1° |
| C53 | C54 | C55 | H77 | 179.4° | 180.0° |
| C54 | C53 | C58 | C57 | 0.5° | 0.5° |
| C54 | C53 | C58 | H80 | 179.8° | 180.0° |
| C58 | C53 | C54 | C55 | 0.1° | 0.3° |
| C58 | C53 | C54 | H76 | 179.7° | 179.7° |
| C53 | C58 | C57 | C56 | 0.6° | 0.5° |
| C53 | C58 | C57 | H80 | 179.7° | 179.6° |
| C53 | C58 | C57 | H79 | 179.8° | 179.7° |
| C54 | C55 | C56 | H77 | 180.0° | 179.9° |
| C54 | C55 | C56 | C57 | 0.6° | 0.1° |
| C54 | C55 | C56 | H78 | 179.3° | 179.9° |
| H76 | C54 | C55 | C56 | 179.8° | 179.9° |
| H76 | C54 | C55 | H77 | 0.2° | 0.0° |
| C55 | C56 | C57 | H78 | 179.9° | 179.9° |
| C55 | C56 | C57 | C58 | 0.0° | 0.3° |
| C55 | C56 | C57 | H79 | 179.2° | 179.9° |
| H77 | C55 | C56 | C57 | 179.4° | 180.0° |
| H77 | C55 | C56 | H78 | 0.6° | 0.1° |
| C56 | C57 | C58 | H79 | 179.2° | 179.8° |
| C56 | C57 | C58 | H80 | 179.7° | 180.0° |
| H78 | C56 | C57 | C58 | 179.9° | 179.8° |
| H78 | C56 | C57 | H79 | 0.9° | 0.1° |
| H79 | C57 | C58 | H80 | 0.5° | 0.2° |
| C82 | N81 | C97 | H88 | 176.1° | 179.9° |
| N81 | C82 | C83 | C85 | 125.4° | 120.0° |
| N81 | C82 | C83 | H89 | 116.8° | 120.1° |
| N81 | C82 | C85 | H89 | 118.2° | 120.0° |
| N81 | C82 | C83 | O84 | 98.6° | 3.6° |
| N81 | C82 | C85 | C86 | 50.1° | 61.9° |
| N81 | C82 | C85 | C87 | 173.4° | 58.2° |
| N81 | C82 | C85 | H90 | 67.0° | 178.1° |
| C82 | N81 | C97 | O98 | 6.2° | 3.3° |
| C82 | N81 | C97 | N99 | 175.8° | 176.8° |
| C97 | N81 | C82 | C83 | 111.7° | 150.0° |
| C97 | N81 | C82 | C85 | 121.0° | 90.0° |
| C97 | N81 | C82 | H89 | 3.8° | 29.9° |
| N81 | C97 | O98 | N99 | 177.9° | 180.0° |
| N81 | C97 | N99 | C2 | 2.8° | 175.9° |
| N81 | C97 | N99 | C3 | 178.4° | 4.1° |
| H88 | N81 | C82 | C83 | 64.7° | 30.0° |
| H88 | N81 | C82 | C85 | 62.6° | 90.0° |
| H88 | N81 | C82 | H89 | 179.8° | 150.0° |
| H88 | N81 | C97 | O98 | 177.7° | 176.8° |
| H88 | N81 | C97 | N99 | 0.3° | 3.2° |
| C83 | C82 | C85 | H89 | 117.5° | 119.9° |
| C83 | C82 | C85 | C86 | 174.3° | 178.1° |
| C83 | C82 | C85 | C87 | 62.3° | 61.9° |
| C83 | C82 | C85 | H90 | 57.2° | 58.1° |
| C85 | C82 | C83 | O84 | 26.8° | 116.4° |
| C82 | C85 | C86 | C87 | 123.0° | 120.0° |
| C82 | C85 | C86 | H90 | 117.3° | 120.0° |
| C82 | C85 | C87 | H90 | 120.1° | 120.0° |
| C82 | C85 | C86 | H91 | 167.2° | 180.0° |
| C82 | C85 | C86 | H92 | 73.7° | 60.0° |
| C82 | C85 | C86 | H93 | 47.4° | 60.0° |
| C82 | C85 | C87 | H94 | 62.2° | 64.6° |
| C82 | C85 | C87 | H95 | 179.5° | 55.4° |
| C82 | C85 | C87 | H96 | 59.3° | 175.4° |
| H89 | C82 | C83 | O84 | 144.6° | 123.7° |
| H89 | C82 | C85 | C86 | 68.1° | 58.2° |
| H89 | C82 | C85 | C87 | 55.2° | 178.2° |
| H89 | C82 | C85 | H90 | 174.8° | 61.9° |
| C86 | C85 | C87 | H90 | 120.1° | 120.0° |
| C85 | C86 | H91 | H92 | 121.8° | 119.9° |
| C85 | C86 | H91 | H93 | 122.6° | 120.0° |
| C85 | C86 | H92 | H93 | 123.3° | 120.0° |
| C86 | C85 | C87 | H94 | 178.0° | 55.4° |
| C86 | C85 | C87 | H95 | 59.6° | 175.4° |
| C86 | C85 | C87 | H96 | 60.5° | 64.6° |
| C87 | C85 | C86 | H91 | 44.3° | 60.0° |
| C87 | C85 | C86 | H92 | 163.3° | 180.0° |
| C87 | C85 | C86 | H93 | 75.6° | 60.0° |
| C85 | C87 | H94 | H95 | 121.1° | 120.0° |
| C85 | C87 | H94 | H96 | 123.9° | 120.0° |
| C85 | C87 | H95 | H96 | 123.0° | 120.0° |
| H90 | C85 | C86 | H91 | 75.5° | 60.0° |
| H90 | C85 | C86 | H92 | 43.6° | 60.0° |
| H90 | C85 | C86 | H93 | 164.7° | NaN° |
| H90 | C85 | C87 | H94 | 57.9° | 175.4° |
| H90 | C85 | C87 | H95 | 60.4° | 64.6° |
| H90 | C85 | C87 | H96 | 179.5° | 55.4° |
| H91 | C86 | H92 | H93 | 115.1° | 120.1° |
| H94 | C87 | H95 | H96 | 115.6° | 120.0° |
| O98 | C97 | N99 | C2 | 179.2° | 4.2° |
| O98 | C97 | N99 | C3 | 0.4° | 175.8° |
| C97 | N99 | C2 | C3 | 178.8° | 180.0° |
| C97 | N99 | C2 | H1 | 67.3° | 5.2° |
| C97 | N99 | C2 | H10 | 52.9° | 125.1° |
| C97 | N99 | C2 | H11 | 172.5° | 114.8° |
| C97 | N99 | C3 | C8 | 92.5° | 90.0° |
| C97 | N99 | C3 | H2 | 147.1° | 150.0° |
| C97 | N99 | C3 | H3 | 31.1° | 30.0° |
| N99 | C2 | H1 | H10 | 121.9° | 119.9° |
| N99 | C2 | H1 | H11 | 121.7° | 120.0° |
| N99 | C2 | H10 | H11 | 121.6° | 120.1° |
| C2 | N99 | C3 | C8 | 86.3° | 90.0° |
| C2 | N99 | C3 | H2 | 34.1° | 30.0° |
| C2 | N99 | C3 | H3 | 150.1° | 150.0° |
| C3 | N99 | C2 | H1 | 113.9° | 174.8° |
| C3 | N99 | C2 | H10 | 125.9° | 55.0° |
| C3 | N99 | C2 | H11 | 6.3° | 65.1° |
| N99 | C3 | C8 | H2 | 120.5° | 120.0° |
| N99 | C3 | C8 | H3 | 123.2° | 120.0° |
| N99 | C3 | H2 | H3 | 118.9° | 119.9° |
| N99 | C3 | C8 | C12 | 84.8° | 180.0° |
| N99 | C3 | C8 | N10 | 95.0° | 0.2° |
| H1 | C2 | H10 | H11 | 117.1° | 120.0° |
| C8 | C3 | H2 | H3 | 119.6° | 120.1° |
| C3 | C8 | C12 | N10 | 179.8° | 179.8° |
| C3 | C8 | C12 | C13 | 179.6° | 180.0° |
| C3 | C8 | C12 | H4 | 1.1° | 0.0° |
| C3 | C8 | N10 | C14 | 179.0° | 179.8° |
| H2 | C3 | C8 | C12 | 154.6° | 60.0° |
| H2 | C3 | C8 | N10 | 25.5° | 120.2° |
| H3 | C3 | C8 | C12 | 38.4° | 60.0° |
| H3 | C3 | C8 | N10 | 141.8° | 119.7° |
| C8 | C12 | C13 | H4 | 178.5° | 179.9° |
| C12 | C8 | N10 | C14 | 0.9° | 0.5° |
| C8 | C12 | C13 | C15 | 0.4° | 0.0° |
| C8 | C12 | C13 | H5 | 179.3° | 180.0° |
| N10 | C8 | C12 | C13 | 0.2° | 0.3° |
| N10 | C8 | C12 | H4 | 178.7° | 179.8° |
| C8 | N10 | C14 | C15 | 1.0° | 0.4° |
| C8 | N10 | C14 | H6 | 178.3° | 179.8° |
| C12 | C13 | C15 | H5 | 178.9° | 180.0° |
| C12 | C13 | C15 | C14 | 0.3° | 0.0° |
| C12 | C13 | C15 | H7 | 179.2° | 180.0° |
| H4 | C12 | C13 | C15 | 178.1° | 180.0° |
| H4 | C12 | C13 | H5 | 0.8° | 0.0° |
| N10 | C14 | C15 | C13 | 0.4° | 0.2° |
| N10 | C14 | C15 | H6 | 179.3° | 179.8° |
| N10 | C14 | C15 | H7 | 179.9° | 179.8° |
| C13 | C15 | C14 | H7 | 179.6° | 179.9° |
| C13 | C15 | C14 | H6 | 178.9° | 180.0° |
| H5 | C13 | C15 | C14 | 179.2° | 180.0° |
| H5 | C13 | C15 | H7 | 0.3° | 0.0° |
| H6 | C14 | C15 | H7 | 0.6° | 0.1° |
