4BN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C10 | sing | 1.53Å | 1.55Å | |
| C18 | C13 | sing | 1.53Å | 1.54Å | |
| S1P | C1' | sing | 1.71Å | 1.82Å | |
| S1P | C2P | sing | 1.81Å | 1.83Å | |
| C11 | C12 | sing | 1.54Å | 1.63Å | |
| C11 | C9 | sing | 1.52Å | 1.69Å | |
| C20 | C21 | sing | 1.53Å | 1.51Å | |
| C20 | C1' | sing | 1.51Å | 1.55Å | |
| C20 | C17 | sing | 1.53Å | 1.50Å | |
| C10 | C1 | sing | 1.50Å | 1.62Å | |
| C10 | C9 | sing | 1.53Å | 1.38Å | |
| C10 | C5 | sing | 1.50Å | 1.55Å | |
| C13 | C12 | sing | 1.52Å | 1.42Å | |
| C13 | C17 | sing | 1.52Å | 1.56Å | |
| C13 | C14 | sing | 1.55Å | 1.48Å | |
| C8 | C9 | sing | 1.54Å | 1.58Å | |
| C8 | C14 | sing | 1.52Å | 1.42Å | |
| C8 | C7 | sing | 1.53Å | 1.54Å | |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C6 | C5 | sing | 1.52Å | 1.49Å | |
| C6 | C7 | sing | 1.54Å | 1.54Å | |
| C5 | C4 | doub | 1.33Å | 1.34Å | |
| C15 | C14 | sing | 1.53Å | 1.58Å | |
| C15 | C16 | sing | 1.55Å | 1.65Å | |
| C1' | O1' | doub | 1.21Å | 1.22Å | |
| C2P | C3P | sing | 1.53Å | 1.55Å | |
| C17 | C16 | sing | 1.55Å | 1.54Å | |
| O1 | C3 | doub | 1.21Å | 1.22Å | |
| C4 | C3 | sing | 1.47Å | 1.46Å | |
| C3 | C2 | sing | 1.52Å | 1.47Å | |
| C3P | N4P | sing | 1.47Å | 1.44Å | |
| O5P | C5P | doub | 1.21Å | 1.24Å | |
| C5P | N4P | sing | 1.35Å | 1.47Å | |
| C5P | C6P | sing | 1.51Å | 1.53Å | |
| C6P | C7P | sing | 1.53Å | 1.54Å | |
| C7P | N8P | sing | 1.46Å | 1.45Å | |
| N8P | C9P | sing | 1.35Å | 1.46Å | |
| O9P | C9P | doub | 1.21Å | 1.22Å | |
| C9P | CAP | sing | 1.51Å | 1.53Å | |
| CAP | OAP | sing | 1.43Å | 1.39Å | |
| CAP | CBP | sing | 1.53Å | 1.54Å | |
| CBP | CDP | sing | 1.53Å | 1.55Å | |
| CBP | CEP | sing | 1.53Å | 1.53Å | |
| CBP | CCP | sing | 1.53Å | 1.57Å | |
| O6A | CCP | sing | 1.43Å | 1.42Å | |
| O6A | P2A | sing | 1.61Å | 1.61Å | |
| N6A | C6A | sing | 1.38Å | 1.45Å | |
| O5A | P2A | doub | 1.48Å | 1.49Å | |
| P2A | O3A | sing | 1.61Å | 1.61Å | |
| P2A | O4A | sing | 1.61Å | 1.48Å | |
| C6A | C5A | doub | 1.41Å | 1.44Å | Aromatic |
| C6A | N1A | sing | 1.33Å | 1.34Å | Aromatic |
| N7A | C5A | sing | 1.36Å | 1.41Å | Aromatic |
| N7A | C8A | doub | 1.30Å | 1.37Å | Aromatic |
| O3A | P1A | sing | 1.61Å | 1.62Å | |
| C5A | C4A | sing | 1.40Å | 1.46Å | Aromatic |
| N1A | C2A | doub | 1.32Å | 1.33Å | Aromatic |
| C8A | N9A | sing | 1.36Å | 1.37Å | Aromatic |
| P1A | O2A | doub | 1.48Å | 1.48Å | |
| P1A | O1A | sing | 1.61Å | 1.49Å | |
| P1A | O5B | sing | 1.61Å | 1.61Å | |
| C2A | N3A | sing | 1.32Å | 1.31Å | Aromatic |
| C4A | N9A | sing | 1.37Å | 1.39Å | Aromatic |
| C4A | N3A | doub | 1.33Å | 1.33Å | Aromatic |
| N9A | C1B | sing | 1.46Å | 1.43Å | |
| O5B | C5B | sing | 1.43Å | 1.42Å | |
| O4B | C1B | sing | 1.44Å | 1.45Å | |
| O4B | C4B | sing | 1.44Å | 1.45Å | |
| C1B | C2B | sing | 1.54Å | 1.49Å | |
| C5B | C4B | sing | 1.53Å | 1.49Å | |
| C2B | C3B | sing | 1.55Å | 1.47Å | |
| C2B | O2B | sing | 1.43Å | 1.42Å | |
| C4B | C3B | sing | 1.54Å | 1.49Å | |
| C3B | O3B | sing | 1.43Å | 1.43Å | |
| O3B | P3B | sing | 1.61Å | 1.59Å | |
| O9A | P3B | doub | 1.48Å | 1.50Å | |
| P3B | O7A | sing | 1.61Å | 1.49Å | |
| P3B | O8A | sing | 1.61Å | 1.47Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C19 | H6 | sing | 1.09Å | 1.10Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| C14 | H26 | sing | 1.09Å | 1.10Å | |
| C8 | H27 | sing | 1.09Å | 1.10Å | |
| C7 | H28 | sing | 1.09Å | 1.10Å | |
| C7 | H29 | sing | 1.09Å | 1.10Å | |
| C6 | H30 | sing | 1.09Å | 1.10Å | |
| C6 | H31 | sing | 1.09Å | 1.10Å | |
| C2P | H32 | sing | 1.09Å | 1.10Å | |
| C2P | H33 | sing | 1.09Å | 1.10Å | |
| C3P | H34 | sing | 1.09Å | 1.10Å | |
| C3P | H35 | sing | 1.09Å | 1.10Å | |
| N4P | H36 | sing | 0.97Å | 1.00Å | |
| C6P | H37 | sing | 1.09Å | 1.10Å | |
| C6P | H38 | sing | 1.09Å | 1.10Å | |
| C7P | H39 | sing | 1.09Å | 1.10Å | |
| C7P | H40 | sing | 1.09Å | 1.10Å | |
| N8P | H41 | sing | 0.97Å | 1.00Å | |
| CAP | H42 | sing | 1.09Å | 1.10Å | |
| OAP | H43 | sing | 0.97Å | 0.95Å | |
| CDP | H44 | sing | 1.09Å | 1.10Å | |
| CDP | H45 | sing | 1.09Å | 1.10Å | |
| CDP | H46 | sing | 1.09Å | 1.10Å | |
| CEP | H47 | sing | 1.09Å | 1.10Å | |
| CEP | H48 | sing | 1.09Å | 1.10Å | |
| CEP | H49 | sing | 1.09Å | 1.10Å | |
| CCP | H50 | sing | 1.09Å | 1.10Å | |
| CCP | H51 | sing | 1.09Å | 1.10Å | |
| O4A | H52 | sing | 0.97Å | 0.95Å | |
| O1A | H53 | sing | 0.97Å | 0.95Å | |
| C5B | H54 | sing | 1.09Å | 1.10Å | |
| C5B | H55 | sing | 1.09Å | 1.10Å | |
| C4B | H56 | sing | 1.09Å | 1.10Å | |
| C3B | H57 | sing | 1.09Å | 1.10Å | |
| O8A | H58 | sing | 0.97Å | 0.95Å | |
| O7A | H59 | sing | 0.97Å | 0.95Å | |
| C2B | H60 | sing | 1.09Å | 1.10Å | |
| O2B | H61 | sing | 0.97Å | 0.95Å | |
| C1B | H62 | sing | 1.09Å | 1.10Å | |
| C2A | H63 | sing | 1.08Å | 1.08Å | |
| C8A | H64 | sing | 1.08Å | 1.08Å | |
| N6A | H65 | sing | 0.97Å | 1.00Å | |
| N6A | H66 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C10 | C1 | 107.6° | 106.8° |
| C19 | C10 | C9 | 109.8° | 106.6° |
| C19 | C10 | C5 | 109.5° | 105.9° |
| C10 | C19 | H6 | 109.5° | 109.5° |
| C10 | C19 | H7 | 109.5° | 109.5° |
| C10 | C19 | H8 | 109.5° | 109.4° |
| C18 | C13 | C12 | 111.2° | 109.8° |
| C18 | C13 | C17 | 109.4° | 109.8° |
| C18 | C13 | C14 | 110.0° | 110.0° |
| C13 | C18 | H14 | 109.5° | 109.5° |
| C13 | C18 | H15 | 109.5° | 109.4° |
| C13 | C18 | H16 | 109.5° | 109.5° |
| C1' | S1P | C2P | 103.7° | 100.0° |
| S1P | C1' | C20 | 120.5° | 120.0° |
| S1P | C1' | O1' | 117.7° | 120.0° |
| S1P | C2P | C3P | 107.4° | 109.5° |
| S1P | C2P | H32 | 110.0° | 109.5° |
| S1P | C2P | H33 | 110.0° | 109.5° |
| C12 | C11 | C9 | 109.6° | 111.6° |
| C11 | C12 | C13 | 111.7° | 107.2° |
| C12 | C11 | H10 | 109.4° | 109.1° |
| C12 | C11 | H11 | 109.5° | 109.0° |
| C11 | C12 | H12 | 108.9° | 109.9° |
| C11 | C12 | H13 | 108.9° | 109.9° |
| C11 | C9 | C10 | 110.6° | 109.5° |
| C11 | C9 | C8 | 107.4° | 111.0° |
| C11 | C9 | H9 | 107.7° | 109.3° |
| C9 | C11 | H10 | 109.4° | 109.1° |
| C9 | C11 | H11 | 109.4° | 109.0° |
| C21 | C20 | C1' | 105.4° | 109.5° |
| C21 | C20 | C17 | 115.3° | 109.4° |
| C21 | C20 | H18 | 109.9° | 109.4° |
| C20 | C21 | H19 | 109.5° | 109.5° |
| C20 | C21 | H20 | 109.4° | 109.4° |
| C20 | C21 | H21 | 109.5° | 109.5° |
| C1' | C20 | C17 | 106.6° | 109.5° |
| C20 | C1' | O1' | 120.3° | 120.0° |
| C1' | C20 | H18 | 109.3° | 109.5° |
| C20 | C17 | C13 | 117.4° | 110.3° |
| C20 | C17 | C16 | 108.1° | 110.2° |
| C20 | C17 | H17 | 109.3° | 110.3° |
| C17 | C20 | H18 | 110.1° | 109.5° |
| C1 | C10 | C9 | 109.0° | 111.9° |
| C1 | C10 | C5 | 113.1° | 115.4° |
| C10 | C1 | C2 | 114.0° | 112.3° |
| C10 | C1 | H4 | 108.3° | 108.9° |
| C10 | C1 | H5 | 108.3° | 108.9° |
| C9 | C10 | C5 | 107.9° | 109.5° |
| C10 | C9 | C8 | 110.1° | 108.6° |
| C10 | C9 | H9 | 111.9° | 109.2° |
| C10 | C5 | C6 | 120.9° | 117.4° |
| C10 | C5 | C4 | 119.9° | 123.8° |
| C12 | C13 | C17 | 112.2° | 116.5° |
| C12 | C13 | C14 | 111.5° | 107.2° |
| C13 | C12 | H12 | 108.9° | 109.9° |
| C13 | C12 | H13 | 108.9° | 110.0° |
| C17 | C13 | C14 | 102.2° | 103.3° |
| C13 | C17 | C16 | 104.5° | 105.3° |
| C13 | C17 | H17 | 108.4° | 110.3° |
| C13 | C14 | C8 | 114.5° | 106.4° |
| C13 | C14 | C15 | 104.7° | 101.7° |
| C13 | C14 | H26 | 108.5° | 110.5° |
| C9 | C8 | C14 | 108.1° | 107.4° |
| C9 | C8 | C7 | 108.1° | 109.9° |
| C8 | C9 | H9 | 108.9° | 109.2° |
| C9 | C8 | H27 | 109.2° | 109.6° |
| C14 | C8 | C7 | 110.0° | 109.3° |
| C8 | C14 | C15 | 112.1° | 115.8° |
| C8 | C14 | H26 | 109.3° | 111.6° |
| C14 | C8 | H27 | 111.5° | 110.3° |
| C8 | C7 | C6 | 112.4° | 109.8° |
| C7 | C8 | H27 | 109.7° | 110.2° |
| C8 | C7 | H28 | 108.7° | 109.3° |
| C8 | C7 | H29 | 108.7° | 109.4° |
| C1 | C2 | C3 | 99.5° | 107.6° |
| C1 | C2 | H1 | 111.9° | 109.9° |
| C1 | C2 | H2 | 111.9° | 109.9° |
| C2 | C1 | H4 | 108.3° | 108.9° |
| C2 | C1 | H5 | 108.3° | 108.9° |
| C5 | C6 | C7 | 105.9° | 107.3° |
| C6 | C5 | C4 | 119.2° | 118.7° |
| C5 | C6 | H30 | 110.3° | 109.8° |
| C5 | C6 | H31 | 110.3° | 109.9° |
| C6 | C7 | H28 | 108.7° | 109.7° |
| C6 | C7 | H29 | 108.7° | 109.2° |
| C7 | C6 | H30 | 110.3° | 110.1° |
| C7 | C6 | H31 | 110.4° | 109.9° |
| C5 | C4 | C3 | 119.0° | 119.1° |
| C5 | C4 | H3 | 120.5° | 120.4° |
| C14 | C15 | C16 | 100.4° | 103.0° |
| C14 | C15 | H24 | 111.7° | 110.7° |
| C14 | C15 | H25 | 111.7° | 110.7° |
| C15 | C14 | H26 | 107.3° | 110.3° |
| C15 | C16 | C17 | 105.6° | 106.4° |
| C15 | C16 | H22 | 110.4° | 110.1° |
| C15 | C16 | H23 | 110.4° | 110.1° |
| C16 | C15 | H24 | 111.7° | 110.7° |
| C16 | C15 | H25 | 111.7° | 110.7° |
| C2P | C3P | N4P | 116.2° | 109.5° |
| C3P | C2P | H32 | 110.0° | 109.5° |
| C3P | C2P | H33 | 110.0° | 109.4° |
| C2P | C3P | H34 | 107.8° | 109.5° |
| C2P | C3P | H35 | 107.8° | 109.5° |
| C16 | C17 | H17 | 108.7° | 110.3° |
| C17 | C16 | H22 | 110.4° | 110.1° |
| C17 | C16 | H23 | 110.5° | 110.1° |
| O1 | C3 | C4 | 121.0° | 122.0° |
| O1 | C3 | C2 | 120.5° | 121.9° |
| C4 | C3 | C2 | 118.5° | 116.1° |
| C3 | C4 | H3 | 120.5° | 120.5° |
| C3 | C2 | H1 | 111.9° | 109.8° |
| C3 | C2 | H2 | 111.9° | 109.8° |
| C3P | N4P | C5P | 128.0° | 120.0° |
| N4P | C3P | H34 | 107.7° | 109.5° |
| N4P | C3P | H35 | 107.8° | 109.5° |
| C3P | N4P | H36 | 116.0° | 119.9° |
| O5P | C5P | N4P | 123.0° | 120.0° |
| O5P | C5P | C6P | 118.8° | 120.0° |
| N4P | C5P | C6P | 118.2° | 120.0° |
| C5P | N4P | H36 | 116.0° | 120.0° |
| C5P | C6P | C7P | 110.4° | 109.5° |
| C5P | C6P | H37 | 109.2° | 109.5° |
| C5P | C6P | H38 | 109.3° | 109.6° |
| C6P | C7P | N8P | 112.1° | 109.5° |
| C7P | C6P | H37 | 109.2° | 109.4° |
| C7P | C6P | H38 | 109.3° | 109.5° |
| C6P | C7P | H39 | 108.8° | 109.4° |
| C6P | C7P | H40 | 108.8° | 109.5° |
| C7P | N8P | C9P | 121.8° | 120.0° |
| N8P | C7P | H39 | 108.8° | 109.4° |
| N8P | C7P | H40 | 108.8° | 109.5° |
| C7P | N8P | H41 | 119.1° | 120.0° |
| N8P | C9P | O9P | 119.5° | 120.0° |
| N8P | C9P | CAP | 121.3° | 120.0° |
| C9P | N8P | H41 | 119.1° | 119.9° |
| O9P | C9P | CAP | 119.2° | 120.0° |
| C9P | CAP | OAP | 112.2° | 109.4° |
| C9P | CAP | CBP | 112.0° | 109.5° |
| C9P | CAP | H42 | 107.9° | 109.5° |
| OAP | CAP | CBP | 107.2° | 109.5° |
| OAP | CAP | H42 | 109.7° | 109.5° |
| CAP | OAP | H43 | 109.5° | 114.0° |
| CAP | CBP | CDP | 111.3° | 109.5° |
| CAP | CBP | CEP | 111.1° | 109.5° |
| CAP | CBP | CCP | 106.7° | 109.5° |
| CBP | CAP | H42 | 107.8° | 109.5° |
| CDP | CBP | CEP | 109.6° | 109.5° |
| CDP | CBP | CCP | 109.2° | 109.5° |
| CBP | CDP | H44 | 109.5° | 109.5° |
| CBP | CDP | H45 | 109.4° | 109.4° |
| CBP | CDP | H46 | 109.4° | 109.5° |
| CEP | CBP | CCP | 109.0° | 109.5° |
| CBP | CEP | H47 | 109.5° | 109.5° |
| CBP | CEP | H48 | 109.4° | 109.4° |
| CBP | CEP | H49 | 109.5° | 109.5° |
| CBP | CCP | O6A | 105.8° | 109.5° |
| CBP | CCP | H50 | 110.4° | 109.5° |
| CBP | CCP | H51 | 110.4° | 109.4° |
| CCP | O6A | P2A | 119.6° | 123.0° |
| O6A | CCP | H50 | 110.4° | 109.5° |
| O6A | CCP | H51 | 110.4° | 109.5° |
| O6A | P2A | O5A | 109.6° | 109.5° |
| O6A | P2A | O3A | 110.9° | 109.5° |
| O6A | P2A | O4A | 111.1° | 109.5° |
| N6A | C6A | C5A | 121.7° | 120.8° |
| N6A | C6A | N1A | 120.7° | 120.8° |
| C6A | N6A | H65 | 109.5° | 120.0° |
| C6A | N6A | H66 | 109.5° | 120.0° |
| O5A | P2A | O3A | 110.6° | 109.5° |
| O5A | P2A | O4A | 102.1° | 109.5° |
| O3A | P2A | O4A | 112.3° | 109.5° |
| P2A | O3A | P1A | 124.5° | 134.0° |
| P2A | O4A | H52 | 109.5° | 114.0° |
| C5A | C6A | N1A | 117.6° | 118.4° |
| C6A | C5A | N7A | 136.4° | 134.7° |
| C6A | C5A | C4A | 117.1° | 118.2° |
| C6A | N1A | C2A | 122.4° | 121.2° |
| C5A | N7A | C8A | 107.9° | 109.4° |
| N7A | C5A | C4A | 106.5° | 107.2° |
| N7A | C8A | N9A | 110.7° | 110.0° |
| N7A | C8A | H64 | 124.7° | 125.0° |
| O3A | P1A | O2A | 111.2° | 109.5° |
| O3A | P1A | O1A | 110.4° | 109.5° |
| O3A | P1A | O5B | 112.2° | 109.5° |
| C5A | C4A | N9A | 106.4° | 106.0° |
| C5A | C4A | N3A | 118.6° | 119.1° |
| N1A | C2A | N3A | 122.6° | 122.4° |
| N1A | C2A | H63 | 118.7° | 118.8° |
| C8A | N9A | C4A | 108.5° | 107.4° |
| C8A | N9A | C1B | 128.3° | 126.3° |
| N9A | C8A | H64 | 124.6° | 125.0° |
| O2A | P1A | O1A | 103.0° | 109.5° |
| O2A | P1A | O5B | 109.6° | 109.5° |
| O1A | P1A | O5B | 109.9° | 109.5° |
| P1A | O1A | H53 | 109.5° | 114.0° |
| P1A | O5B | C5B | 115.2° | 123.0° |
| C2A | N3A | C4A | 121.8° | 120.6° |
| N3A | C2A | H63 | 118.7° | 118.8° |
| N9A | C4A | N3A | 135.0° | 134.9° |
| C4A | N9A | C1B | 123.2° | 126.3° |
| N9A | C1B | O4B | 112.0° | 110.3° |
| N9A | C1B | C2B | 110.8° | 110.3° |
| N9A | C1B | H62 | 109.3° | 110.4° |
| O5B | C5B | C4B | 111.0° | 109.5° |
| O5B | C5B | H54 | 109.1° | 109.5° |
| O5B | C5B | H55 | 109.1° | 109.4° |
| C1B | O4B | C4B | 109.4° | 105.3° |
| O4B | C1B | C2B | 107.3° | 104.8° |
| O4B | C1B | H62 | 109.0° | 110.4° |
| O4B | C4B | C5B | 111.4° | 110.4° |
| O4B | C4B | C3B | 107.6° | 104.8° |
| O4B | C4B | H56 | 110.0° | 110.5° |
| C1B | C2B | C3B | 107.1° | 104.0° |
| C1B | C2B | O2B | 109.8° | 110.5° |
| C1B | C2B | H60 | 109.9° | 110.7° |
| C2B | C1B | H62 | 108.4° | 110.4° |
| C5B | C4B | C3B | 108.5° | 110.4° |
| C4B | C5B | H54 | 109.1° | 109.5° |
| C4B | C5B | H55 | 109.1° | 109.5° |
| C5B | C4B | H56 | 109.6° | 110.3° |
| C3B | C2B | O2B | 108.9° | 110.5° |
| C2B | C3B | C4B | 107.5° | 104.1° |
| C2B | C3B | O3B | 109.6° | 110.5° |
| C2B | C3B | H57 | 110.3° | 110.6° |
| C3B | C2B | H60 | 110.2° | 110.5° |
| O2B | C2B | H60 | 110.9° | 110.5° |
| C2B | O2B | H61 | 109.5° | 113.9° |
| C4B | C3B | O3B | 108.4° | 110.5° |
| C3B | C4B | H56 | 109.6° | 110.4° |
| C4B | C3B | H57 | 110.1° | 110.5° |
| C3B | O3B | P3B | 119.0° | 123.0° |
| O3B | C3B | H57 | 110.9° | 110.5° |
| O3B | P3B | O9A | 115.4° | 109.5° |
| O3B | P3B | O7A | 112.4° | 109.5° |
| O3B | P3B | O8A | 112.3° | 109.4° |
| O9A | P3B | O7A | 105.3° | 109.5° |
| O9A | P3B | O8A | 104.3° | 109.5° |
| O7A | P3B | O8A | 106.2° | 109.5° |
| P3B | O7A | H59 | 109.5° | 114.0° |
| P3B | O8A | H58 | 109.5° | 114.0° |
| H1 | C2 | H2 | 109.5° | 109.8° |
| H4 | C1 | H5 | 109.5° | 108.8° |
| H6 | C19 | H7 | 109.4° | 109.5° |
| H6 | C19 | H8 | 109.5° | 109.5° |
| H7 | C19 | H8 | 109.5° | 109.4° |
| H10 | C11 | H11 | 109.5° | 109.0° |
| H12 | C12 | H13 | 109.5° | 109.9° |
| H14 | C18 | H15 | 109.5° | 109.4° |
| H14 | C18 | H16 | 109.5° | 109.5° |
| H15 | C18 | H16 | 109.4° | 109.4° |
| H19 | C21 | H20 | 109.4° | 109.5° |
| H19 | C21 | H21 | 109.5° | 109.5° |
| H20 | C21 | H21 | 109.5° | 109.4° |
| H22 | C16 | H23 | 109.5° | 110.1° |
| H24 | C15 | H25 | 109.5° | 110.7° |
| H28 | C7 | H29 | 109.5° | 109.4° |
| H30 | C6 | H31 | 109.5° | 109.9° |
| H32 | C2P | H33 | 109.4° | 109.5° |
| H34 | C3P | H35 | 109.5° | 109.4° |
| H37 | C6P | H38 | 109.5° | 109.4° |
| H39 | C7P | H40 | 109.4° | 109.5° |
| H44 | CDP | H45 | 109.4° | 109.5° |
| H44 | CDP | H46 | 109.5° | 109.5° |
| H45 | CDP | H46 | 109.5° | 109.5° |
| H47 | CEP | H48 | 109.5° | 109.5° |
| H47 | CEP | H49 | 109.5° | 109.5° |
| H48 | CEP | H49 | 109.5° | 109.5° |
| H50 | CCP | H51 | 109.5° | 109.5° |
| H54 | C5B | H55 | 109.5° | 109.5° |
| H65 | N6A | H66 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C10 | C9 | C11 | 58.0° | 62.5° |
| C19 | C10 | C1 | C9 | 119.0° | 116.3° |
| C19 | C10 | C1 | C5 | 121.1° | 117.5° |
| C19 | C10 | C9 | C5 | 119.3° | 114.2° |
| C19 | C10 | C9 | C8 | 60.5° | 58.9° |
| C19 | C10 | C1 | C2 | 149.3° | 150.7° |
| C19 | C10 | C5 | C6 | 63.6° | 60.6° |
| C19 | C10 | C5 | C4 | 115.4° | 121.3° |
| C19 | C10 | C1 | H4 | 28.7° | 88.6° |
| C19 | C10 | C1 | H5 | 90.0° | 30.0° |
| C10 | C19 | H6 | H7 | 120.0° | 120.1° |
| C10 | C19 | H6 | H8 | 120.0° | 120.0° |
| C10 | C19 | H7 | H8 | 120.0° | 119.9° |
| C19 | C10 | C9 | H9 | 178.2° | 177.9° |
| C18 | C13 | C12 | C11 | 67.7° | 54.7° |
| C18 | C13 | C17 | C20 | 43.7° | 30.9° |
| C18 | C13 | C12 | C17 | 122.9° | 125.5° |
| C18 | C13 | C12 | C14 | 123.2° | 119.4° |
| C18 | C13 | C17 | C14 | 116.6° | 117.3° |
| C18 | C13 | C14 | C8 | 55.6° | 48.7° |
| C18 | C13 | C14 | C15 | 67.6° | 72.8° |
| C18 | C13 | C17 | C16 | 76.1° | 88.1° |
| C18 | C13 | C12 | H12 | 172.0° | 174.1° |
| C18 | C13 | C12 | H13 | 52.7° | 64.8° |
| C13 | C18 | H14 | H15 | 120.0° | 120.0° |
| C13 | C18 | H14 | H16 | 120.0° | 120.1° |
| C13 | C18 | H15 | H16 | 120.0° | 120.0° |
| C18 | C13 | C17 | H17 | 168.1° | 153.0° |
| C18 | C13 | C14 | H26 | 178.1° | 170.0° |
| S1P | C1' | C20 | C21 | 91.5° | 60.0° |
| S1P | C1' | C20 | O1' | 165.7° | 180.0° |
| S1P | C1' | C20 | C17 | 145.6° | 180.0° |
| C1' | S1P | C2P | C3P | 95.4° | 180.0° |
| S1P | C1' | C20 | H18 | 26.6° | 60.0° |
| C1' | S1P | C2P | H32 | 144.9° | 60.0° |
| C1' | S1P | C2P | H33 | 24.3° | 60.0° |
| C2P | S1P | C1' | C20 | 150.4° | 180.0° |
| C2P | S1P | C1' | O1' | 43.6° | 0.0° |
| S1P | C2P | C3P | H32 | 119.7° | 120.0° |
| S1P | C2P | C3P | H33 | 119.7° | 120.0° |
| S1P | C2P | C3P | N4P | 166.3° | 180.0° |
| S1P | C2P | H32 | H33 | 121.0° | 120.0° |
| S1P | C2P | C3P | H34 | 45.4° | 60.0° |
| S1P | C2P | C3P | H35 | 72.7° | 60.0° |
| C12 | C11 | C9 | H10 | 120.0° | 120.6° |
| C12 | C11 | C9 | H11 | 120.0° | 120.5° |
| C12 | C11 | C9 | C10 | 167.4° | 174.6° |
| C11 | C12 | C13 | H12 | 120.3° | 119.4° |
| C11 | C12 | C13 | H13 | 120.4° | 119.5° |
| C11 | C12 | C13 | C17 | 169.5° | 179.7° |
| C11 | C12 | C13 | C14 | 55.5° | 64.7° |
| C12 | C11 | C9 | C8 | 47.2° | 54.7° |
| C12 | C11 | C9 | H9 | 70.0° | 65.8° |
| C12 | C11 | H10 | H11 | 120.0° | 118.9° |
| C11 | C12 | H12 | H13 | 119.0° | 121.0° |
| C11 | C9 | C10 | C1 | 59.5° | 54.0° |
| C11 | C9 | C10 | C8 | 118.6° | 121.3° |
| C11 | C9 | C10 | H9 | 120.1° | 119.6° |
| C11 | C9 | C10 | C5 | 177.4° | 176.7° |
| C9 | C11 | C12 | C13 | 48.5° | 57.4° |
| C11 | C9 | C8 | H9 | 116.4° | 120.5° |
| C11 | C9 | C8 | C14 | 55.6° | 58.4° |
| C11 | C9 | C8 | C7 | 174.7° | 177.2° |
| C9 | C11 | H10 | H11 | 119.9° | 118.9° |
| C9 | C11 | C12 | H12 | 71.8° | 62.0° |
| C9 | C11 | C12 | H13 | 168.8° | 177.0° |
| C11 | C9 | C8 | H27 | 65.9° | 61.5° |
| C21 | C20 | C1' | C17 | 123.0° | 120.0° |
| C21 | C20 | C1' | H18 | 118.1° | 120.0° |
| C21 | C20 | C17 | H18 | 125.1° | 119.9° |
| C21 | C20 | C17 | C13 | 71.8° | 65.7° |
| C21 | C20 | C1' | O1' | 74.2° | 120.0° |
| C21 | C20 | C17 | C16 | 170.4° | 178.5° |
| C21 | C20 | C17 | H17 | 52.2° | 56.4° |
| C20 | C21 | H19 | H20 | 120.0° | 120.0° |
| C20 | C21 | H19 | H21 | 120.0° | 120.0° |
| C20 | C21 | H20 | H21 | 120.0° | 119.9° |
| C1' | C20 | C17 | H18 | 118.4° | 120.1° |
| C1' | C20 | C17 | C13 | 171.7° | 174.3° |
| C1' | C20 | C17 | C16 | 53.8° | 58.5° |
| C1' | C20 | C17 | H17 | 64.4° | 63.6° |
| C1' | C20 | C21 | H19 | 180.0° | 174.9° |
| C1' | C20 | C21 | H20 | 60.0° | 54.9° |
| C1' | C20 | C21 | H21 | 60.0° | 65.0° |
| C20 | C17 | C13 | C12 | 80.2° | 94.6° |
| C20 | C17 | C13 | C16 | 119.7° | 118.9° |
| C20 | C17 | C13 | H17 | 124.4° | 122.1° |
| C20 | C17 | C13 | C14 | 160.3° | 148.2° |
| C20 | C17 | C16 | C15 | 142.6° | 122.4° |
| C17 | C20 | C1' | O1' | 48.8° | 0.0° |
| C20 | C17 | C16 | H17 | 118.6° | 122.1° |
| C17 | C20 | C21 | H19 | 62.8° | 65.0° |
| C17 | C20 | C21 | H20 | 177.2° | 175.0° |
| C17 | C20 | C21 | H21 | 57.2° | 55.1° |
| C20 | C17 | C16 | H22 | 23.3° | 118.3° |
| C20 | C17 | C16 | H23 | 98.0° | 3.1° |
| C1 | C10 | C9 | C5 | 123.1° | 129.3° |
| C1 | C10 | C9 | C8 | 178.1° | 175.3° |
| C10 | C1 | C2 | H4 | 120.7° | 120.7° |
| C10 | C1 | C2 | H5 | 120.7° | 120.7° |
| C1 | C10 | C5 | C6 | 176.4° | 178.6° |
| C1 | C10 | C5 | C4 | 4.6° | 3.3° |
| C10 | C1 | C2 | C3 | 58.1° | 55.4° |
| C10 | C1 | C2 | H1 | 176.4° | 64.1° |
| C10 | C1 | C2 | H2 | 60.3° | 175.0° |
| C10 | C1 | H4 | H5 | 118.0° | 118.6° |
| C1 | C10 | C19 | H6 | 180.0° | 60.0° |
| C1 | C10 | C19 | H7 | 60.0° | 179.9° |
| C1 | C10 | C19 | H8 | 60.0° | 60.0° |
| C1 | C10 | C9 | H9 | 60.6° | 65.6° |
| C10 | C9 | C8 | H9 | 123.1° | 119.0° |
| C10 | C9 | C8 | C14 | 176.1° | 178.8° |
| C10 | C9 | C8 | C7 | 64.8° | 62.3° |
| C9 | C10 | C1 | C2 | 91.7° | 93.0° |
| C9 | C10 | C5 | C6 | 55.9° | 54.0° |
| C9 | C10 | C5 | C4 | 125.1° | 124.0° |
| C9 | C10 | C1 | H4 | 147.6° | 27.8° |
| C9 | C10 | C1 | H5 | 28.9° | 146.3° |
| C9 | C10 | C19 | H6 | 61.5° | 179.7° |
| C9 | C10 | C19 | H7 | 58.4° | 60.2° |
| C9 | C10 | C19 | H8 | 178.4° | 59.7° |
| C10 | C9 | C11 | H10 | 47.4° | 64.8° |
| C10 | C9 | C11 | H11 | 72.6° | 54.1° |
| C10 | C9 | C8 | H27 | 54.6° | 58.9° |
| C5 | C10 | C9 | C8 | 58.8° | 55.4° |
| C5 | C10 | C1 | C2 | 28.3° | 33.2° |
| C10 | C5 | C6 | C4 | 179.0° | 178.2° |
| C10 | C5 | C6 | C7 | 48.2° | 53.2° |
| C10 | C5 | C4 | C3 | 1.2° | 1.9° |
| C10 | C5 | C4 | H3 | 178.8° | 178.0° |
| C5 | C10 | C1 | H4 | 92.4° | 153.9° |
| C5 | C10 | C1 | H5 | 148.9° | 87.5° |
| C5 | C10 | C19 | H6 | 56.8° | 63.6° |
| C5 | C10 | C19 | H7 | 176.7° | 56.5° |
| C5 | C10 | C19 | H8 | 63.3° | 176.4° |
| C5 | C10 | C9 | H9 | 62.5° | 63.7° |
| C10 | C5 | C6 | H30 | 71.2° | 66.4° |
| C10 | C5 | C6 | H31 | 167.6° | 172.7° |
| C12 | C13 | C17 | C14 | 119.5° | 117.2° |
| C12 | C13 | C14 | C8 | 68.2° | 70.5° |
| C12 | C13 | C14 | C15 | 168.6° | 167.9° |
| C12 | C13 | C17 | C16 | 160.1° | 146.4° |
| C13 | C12 | C11 | H10 | 71.5° | 178.0° |
| C13 | C12 | C11 | H11 | 168.5° | 63.1° |
| C13 | C12 | H12 | H13 | 119.0° | 121.2° |
| C12 | C13 | C18 | H14 | 180.0° | 57.2° |
| C12 | C13 | C18 | H15 | 60.0° | 177.1° |
| C12 | C13 | C18 | H16 | 60.0° | 62.9° |
| C12 | C13 | C17 | H17 | 44.2° | 27.5° |
| C12 | C13 | C14 | H26 | 54.2° | 50.8° |
| C17 | C13 | C14 | C8 | 171.8° | 165.9° |
| C17 | C13 | C14 | C15 | 48.6° | 44.3° |
| C13 | C17 | C16 | C15 | 16.9° | 3.4° |
| C13 | C17 | C16 | H17 | 115.7° | 119.0° |
| C17 | C13 | C12 | H12 | 49.1° | 60.3° |
| C17 | C13 | C12 | H13 | 70.2° | 60.8° |
| C17 | C13 | C18 | H14 | 55.6° | 173.6° |
| C17 | C13 | C18 | H15 | 64.4° | 53.6° |
| C17 | C13 | C18 | H16 | 175.6° | 66.4° |
| C13 | C17 | C20 | H18 | 53.2° | 54.3° |
| C13 | C17 | C16 | H22 | 102.5° | 122.7° |
| C13 | C17 | C16 | H23 | 136.3° | 115.8° |
| C17 | C13 | C14 | H26 | 65.8° | 72.8° |
| C13 | C14 | C8 | C9 | 67.1° | 65.5° |
| C13 | C14 | C8 | C15 | 119.1° | 112.1° |
| C13 | C14 | C8 | H26 | 122.0° | 120.6° |
| C13 | C14 | C8 | C7 | 175.0° | 175.3° |
| C13 | C14 | C15 | H26 | 115.2° | 117.3° |
| C13 | C14 | C15 | C16 | 36.7° | 41.6° |
| C14 | C13 | C17 | C16 | 40.5° | 29.2° |
| C14 | C13 | C12 | H12 | 64.8° | 54.8° |
| C14 | C13 | C12 | H13 | 175.9° | 175.9° |
| C14 | C13 | C18 | H14 | 56.0° | 60.5° |
| C14 | C13 | C18 | H15 | 176.0° | 59.5° |
| C14 | C13 | C18 | H16 | 64.1° | 179.4° |
| C14 | C13 | C17 | H17 | 75.3° | 89.7° |
| C13 | C14 | C15 | H24 | 81.9° | 160.0° |
| C13 | C14 | C15 | H25 | 155.2° | 76.8° |
| C13 | C14 | C8 | H27 | 53.0° | 54.0° |
| C9 | C8 | C14 | C7 | 117.9° | 119.2° |
| C9 | C8 | C14 | H27 | 120.1° | 119.5° |
| C9 | C8 | C7 | H27 | 119.1° | 120.9° |
| C9 | C8 | C7 | C6 | 58.5° | 63.3° |
| C9 | C8 | C14 | C15 | 173.8° | 177.6° |
| C8 | C9 | C11 | H10 | 72.8° | 175.3° |
| C8 | C9 | C11 | H11 | 167.2° | 65.8° |
| C9 | C8 | C14 | H26 | 54.9° | 55.1° |
| C9 | C8 | C7 | H28 | 61.9° | 57.0° |
| C9 | C8 | C7 | H29 | 178.9° | 176.8° |
| C14 | C8 | C7 | H27 | 123.1° | 121.4° |
| C14 | C8 | C7 | C6 | 176.4° | 179.0° |
| C8 | C14 | C15 | H26 | 120.1° | 127.9° |
| C8 | C14 | C15 | C16 | 161.4° | 156.4° |
| C14 | C8 | C9 | H9 | 60.7° | 62.2° |
| C8 | C14 | C15 | H24 | 42.8° | 85.2° |
| C8 | C14 | C15 | H25 | 80.1° | 38.0° |
| C14 | C8 | C7 | H28 | 56.0° | 60.6° |
| C14 | C8 | C7 | H29 | 63.2° | 59.1° |
| C8 | C7 | C6 | C5 | 49.4° | 55.5° |
| C8 | C7 | C6 | H28 | 120.4° | 120.2° |
| C8 | C7 | C6 | H29 | 120.4° | 120.0° |
| C7 | C8 | C14 | C15 | 55.9° | 63.2° |
| C7 | C8 | C9 | H9 | 58.3° | 56.7° |
| C7 | C8 | C14 | H26 | 63.0° | 64.1° |
| C8 | C7 | H28 | H29 | 118.7° | 119.8° |
| C8 | C7 | C6 | H30 | 70.0° | 63.9° |
| C8 | C7 | C6 | H31 | 168.8° | 175.0° |
| C1 | C2 | C3 | O1 | 113.2° | 127.8° |
| C1 | C2 | C3 | C4 | 66.4° | 51.8° |
| C1 | C2 | C3 | H1 | 118.4° | 119.6° |
| C1 | C2 | C3 | H2 | 118.3° | 119.6° |
| C1 | C2 | H1 | H2 | 124.6° | 121.0° |
| C2 | C1 | H4 | H5 | 117.9° | 118.6° |
| C5 | C6 | C7 | H30 | 119.4° | 119.4° |
| C5 | C6 | C7 | H31 | 119.4° | 119.4° |
| C6 | C5 | C4 | C3 | 179.8° | 176.2° |
| C6 | C5 | C4 | H3 | 0.2° | 3.9° |
| C5 | C6 | C7 | H28 | 71.0° | 64.6° |
| C5 | C6 | C7 | H29 | 169.8° | 175.5° |
| C5 | C6 | H30 | H31 | 121.6° | 120.9° |
| C7 | C6 | C5 | C4 | 132.8° | 124.9° |
| C6 | C7 | C8 | H27 | 60.5° | 57.6° |
| C6 | C7 | H28 | H29 | 118.7° | 119.8° |
| C7 | C6 | H30 | H31 | 121.7° | 121.1° |
| C5 | C4 | C3 | O1 | 140.4° | 155.6° |
| C5 | C4 | C3 | H3 | 180.0° | 179.9° |
| C5 | C4 | C3 | C2 | 39.2° | 24.1° |
| C4 | C5 | C6 | H30 | 107.8° | 115.4° |
| C4 | C5 | C6 | H31 | 13.4° | 5.5° |
| C14 | C15 | C16 | H24 | 118.5° | 118.4° |
| C14 | C15 | C16 | H25 | 118.5° | 118.4° |
| C14 | C15 | C16 | C17 | 10.8° | 23.9° |
| C14 | C15 | C16 | H22 | 130.2° | 95.3° |
| C14 | C15 | C16 | H23 | 108.6° | 143.2° |
| C14 | C15 | H24 | H25 | 124.2° | 123.2° |
| C15 | C14 | C8 | H27 | 66.1° | 58.1° |
| C15 | C16 | C17 | H22 | 119.4° | 119.2° |
| C15 | C16 | C17 | H23 | 119.4° | 119.3° |
| C15 | C16 | C17 | H17 | 98.8° | 115.5° |
| C15 | C16 | H22 | H23 | 121.8° | 121.6° |
| C16 | C15 | H24 | H25 | 124.2° | 123.3° |
| C16 | C15 | C14 | H26 | 78.5° | 75.7° |
| O1' | C1' | C20 | H18 | 167.7° | 120.0° |
| C2P | C3P | N4P | H34 | 121.0° | 120.1° |
| C2P | C3P | N4P | H35 | 121.0° | 120.0° |
| C2P | C3P | N4P | C5P | 32.9° | 180.0° |
| C3P | C2P | H32 | H33 | 120.9° | 120.0° |
| C2P | C3P | H34 | H35 | 116.9° | 120.0° |
| C2P | C3P | N4P | H36 | 147.1° | 0.1° |
| C16 | C17 | C20 | H18 | 64.6° | 61.6° |
| C17 | C16 | H22 | H23 | 121.8° | 121.5° |
| C17 | C16 | C15 | H24 | 107.7° | 142.3° |
| C17 | C16 | C15 | H25 | 129.4° | 94.4° |
| O1 | C3 | C4 | C2 | 179.6° | 179.7° |
| O1 | C3 | C2 | H1 | 5.2° | 112.6° |
| O1 | C3 | C2 | H2 | 128.5° | 8.2° |
| O1 | C3 | C4 | H3 | 39.7° | 24.3° |
| C4 | C3 | C2 | H1 | 175.2° | 67.7° |
| C4 | C3 | C2 | H2 | 51.9° | 171.5° |
| C3 | C2 | H1 | H2 | 124.7° | 120.8° |
| C2 | C3 | C4 | H3 | 140.8° | 156.0° |
| C3 | C2 | C1 | H4 | 62.6° | 176.2° |
| C3 | C2 | C1 | H5 | 178.8° | 65.3° |
| C3P | N4P | C5P | O5P | 1.4° | 0.0° |
| C3P | N4P | C5P | H36 | 180.0° | 180.0° |
| C3P | N4P | C5P | C6P | 178.5° | 179.9° |
| N4P | C3P | C2P | H32 | 74.0° | 60.0° |
| N4P | C3P | C2P | H33 | 46.6° | 60.1° |
| N4P | C3P | H34 | H35 | 116.9° | 120.0° |
| O5P | C5P | N4P | C6P | 179.9° | 179.9° |
| O5P | C5P | C6P | C7P | 158.0° | 0.1° |
| O5P | C5P | N4P | H36 | 178.6° | 180.0° |
| O5P | C5P | C6P | H37 | 81.9° | 120.0° |
| O5P | C5P | C6P | H38 | 37.8° | 120.0° |
| N4P | C5P | C6P | C7P | 22.1° | 180.0° |
| C5P | N4P | C3P | H34 | 153.9° | 60.0° |
| C5P | N4P | C3P | H35 | 88.1° | 60.0° |
| N4P | C5P | C6P | H37 | 98.0° | 60.1° |
| N4P | C5P | C6P | H38 | 142.3° | 60.0° |
| C5P | C6P | C7P | H37 | 120.1° | 120.0° |
| C5P | C6P | C7P | H38 | 120.2° | 120.1° |
| C5P | C6P | C7P | N8P | 165.2° | 180.0° |
| C6P | C5P | N4P | H36 | 1.5° | 0.0° |
| C5P | C6P | H37 | H38 | 119.6° | 120.1° |
| C5P | C6P | C7P | H39 | 74.4° | 60.1° |
| C5P | C6P | C7P | H40 | 44.8° | 60.0° |
| C6P | C7P | N8P | H39 | 120.4° | 119.9° |
| C6P | C7P | N8P | H40 | 120.4° | 120.0° |
| C6P | C7P | N8P | C9P | 61.1° | 179.9° |
| C7P | C6P | H37 | H38 | 119.6° | 119.9° |
| C6P | C7P | H39 | H40 | 118.8° | 120.0° |
| C6P | C7P | N8P | H41 | 118.9° | 0.0° |
| C7P | N8P | C9P | H41 | 180.0° | 180.0° |
| C7P | N8P | C9P | O9P | 0.9° | 4.7° |
| C7P | N8P | C9P | CAP | 179.3° | 175.1° |
| N8P | C7P | C6P | H37 | 45.1° | 60.0° |
| N8P | C7P | C6P | H38 | 74.6° | 59.9° |
| N8P | C7P | H39 | H40 | 118.8° | 120.0° |
| N8P | C9P | O9P | CAP | 179.8° | 179.9° |
| N8P | C9P | CAP | OAP | 23.3° | 6.7° |
| N8P | C9P | CAP | CBP | 97.4° | 113.3° |
| C9P | N8P | C7P | H39 | 59.3° | 60.0° |
| C9P | N8P | C7P | H40 | 178.5° | 60.1° |
| N8P | C9P | CAP | H42 | 144.1° | 126.7° |
| O9P | C9P | CAP | OAP | 156.6° | 173.4° |
| O9P | C9P | CAP | CBP | 82.8° | 66.6° |
| O9P | C9P | N8P | H41 | 179.1° | 175.2° |
| O9P | C9P | CAP | H42 | 35.7° | 53.4° |
| C9P | CAP | OAP | CBP | 123.4° | 120.0° |
| C9P | CAP | OAP | H42 | 119.8° | 120.0° |
| C9P | CAP | CBP | H42 | 118.5° | 120.0° |
| C9P | CAP | CBP | CDP | 58.2° | 65.7° |
| C9P | CAP | CBP | CEP | 64.1° | 54.4° |
| C9P | CAP | CBP | CCP | 177.2° | 174.4° |
| CAP | C9P | N8P | H41 | 0.7° | 4.9° |
| C9P | CAP | OAP | H43 | 180.0° | 60.1° |
| OAP | CAP | CBP | H42 | 118.0° | 120.0° |
| OAP | CAP | CBP | CDP | 178.3° | 174.4° |
| OAP | CAP | CBP | CEP | 59.3° | 65.6° |
| OAP | CAP | CBP | CCP | 59.3° | 54.4° |
| CAP | CBP | CDP | CEP | 123.2° | 120.0° |
| CAP | CBP | CDP | CCP | 117.5° | 120.0° |
| CAP | CBP | CEP | CCP | 117.3° | 120.0° |
| CAP | CBP | CCP | O6A | 74.3° | 180.0° |
| CBP | CAP | OAP | H43 | 56.6° | 59.9° |
| CAP | CBP | CDP | H44 | 180.0° | 67.3° |
| CAP | CBP | CDP | H45 | 60.0° | 172.6° |
| CAP | CBP | CDP | H46 | 60.0° | 52.7° |
| CAP | CBP | CEP | H47 | 180.0° | 60.0° |
| CAP | CBP | CEP | H48 | 60.0° | 180.0° |
| CAP | CBP | CEP | H49 | 60.0° | 60.0° |
| CAP | CBP | CCP | H50 | 166.3° | 60.0° |
| CAP | CBP | CCP | H51 | 45.1° | 60.0° |
| CDP | CBP | CEP | CCP | 119.4° | 120.0° |
| CDP | CBP | CCP | O6A | 46.1° | 60.0° |
| CDP | CBP | CAP | H42 | 60.3° | 54.4° |
| CBP | CDP | H44 | H45 | 120.0° | 120.0° |
| CBP | CDP | H44 | H46 | 120.0° | 120.0° |
| CBP | CDP | H45 | H46 | 120.0° | 120.0° |
| CDP | CBP | CEP | H47 | 56.6° | 180.0° |
| CDP | CBP | CEP | H48 | 63.4° | 60.0° |
| CDP | CBP | CEP | H49 | 176.6° | 60.0° |
| CDP | CBP | CCP | H50 | 73.4° | 180.0° |
| CDP | CBP | CCP | H51 | 165.5° | 60.0° |
| CEP | CBP | CCP | O6A | 165.7° | 60.0° |
| CEP | CBP | CAP | H42 | 177.4° | 174.4° |
| CEP | CBP | CDP | H44 | 56.8° | 52.7° |
| CEP | CBP | CDP | H45 | 176.8° | 67.4° |
| CEP | CBP | CDP | H46 | 63.2° | 172.7° |
| CBP | CEP | H47 | H48 | 120.0° | 120.0° |
| CBP | CEP | H47 | H49 | 120.0° | 120.0° |
| CBP | CEP | H48 | H49 | 120.0° | 120.0° |
| CEP | CBP | CCP | H50 | 46.3° | 60.0° |
| CEP | CBP | CCP | H51 | 74.9° | 180.0° |
| CBP | CCP | O6A | H50 | 119.4° | 120.0° |
| CBP | CCP | O6A | H51 | 119.4° | 120.0° |
| CBP | CCP | O6A | P2A | 164.9° | 180.0° |
| CCP | CBP | CAP | H42 | 58.7° | 65.6° |
| CCP | CBP | CDP | H44 | 62.5° | 172.7° |
| CCP | CBP | CDP | H45 | 57.5° | 52.7° |
| CCP | CBP | CDP | H46 | 177.5° | 67.3° |
| CCP | CBP | CEP | H47 | 62.8° | 60.0° |
| CCP | CBP | CEP | H48 | 177.3° | 60.0° |
| CCP | CBP | CEP | H49 | 57.2° | 180.0° |
| CBP | CCP | H50 | H51 | 121.7° | 120.0° |
| CCP | O6A | P2A | O5A | 159.2° | 55.0° |
| CCP | O6A | P2A | O3A | 36.8° | 175.0° |
| CCP | O6A | P2A | O4A | 88.8° | 65.0° |
| O6A | CCP | H50 | H51 | 121.7° | 120.1° |
| O6A | P2A | O5A | O3A | 122.6° | 120.0° |
| O6A | P2A | O5A | O4A | 117.8° | 120.0° |
| O6A | P2A | O3A | O4A | 124.9° | 120.0° |
| O6A | P2A | O3A | P1A | 139.2° | 165.0° |
| P2A | O6A | CCP | H50 | 45.4° | 60.0° |
| P2A | O6A | CCP | H51 | 75.7° | 60.1° |
| O6A | P2A | O4A | H52 | 116.7° | 60.0° |
| N6A | C6A | C5A | N1A | 179.8° | 179.7° |
| N6A | C6A | C5A | N7A | 0.4° | 0.1° |
| N6A | C6A | C5A | C4A | 180.0° | 179.9° |
| N6A | C6A | N1A | C2A | 180.0° | 179.9° |
| C6A | N6A | H65 | H66 | 120.0° | 179.9° |
| O5A | P2A | O3A | O4A | 113.2° | 120.0° |
| O5A | P2A | O3A | P1A | 98.9° | 45.0° |
| O5A | P2A | O4A | H52 | 0.0° | 180.0° |
| P2A | O3A | P1A | O2A | 177.6° | 40.0° |
| P2A | O3A | P1A | O1A | 63.9° | 80.0° |
| P2A | O3A | P1A | O5B | 59.2° | 160.0° |
| O3A | P2A | O4A | H52 | 118.4° | 60.0° |
| O4A | P2A | O3A | P1A | 14.3° | 75.0° |
| C6A | C5A | N7A | C4A | 179.7° | 180.0° |
| C6A | C5A | N7A | C8A | 179.7° | 180.0° |
| C5A | C6A | N1A | C2A | 0.2° | 0.2° |
| C6A | C5A | C4A | N9A | 179.8° | 179.8° |
| C6A | C5A | C4A | N3A | 0.0° | 0.1° |
| C5A | C6A | N6A | H65 | 179.8° | 0.1° |
| C5A | C6A | N6A | H66 | 60.2° | 180.0° |
| N1A | C6A | C5A | N7A | 179.8° | 179.8° |
| N1A | C6A | C5A | C4A | 0.2° | 0.2° |
| C6A | N1A | C2A | N3A | 0.0° | 0.1° |
| C6A | N1A | C2A | H63 | 180.0° | 179.9° |
| N1A | C6A | N6A | H65 | 0.0° | 179.8° |
| N1A | C6A | N6A | H66 | 120.0° | 0.3° |
| C5A | N7A | C8A | N9A | 0.0° | 0.1° |
| N7A | C5A | C4A | N9A | 0.1° | 0.2° |
| N7A | C5A | C4A | N3A | 179.8° | 179.9° |
| C5A | N7A | C8A | H64 | 179.9° | 179.9° |
| C8A | N7A | C5A | C4A | 0.1° | 0.0° |
| N7A | C8A | N9A | H64 | 180.0° | 180.0° |
| N7A | C8A | N9A | C4A | 0.0° | 0.2° |
| N7A | C8A | N9A | C1B | 179.9° | 179.9° |
| O3A | P1A | O2A | O1A | 118.3° | 120.0° |
| O3A | P1A | O2A | O5B | 124.7° | 120.0° |
| O3A | P1A | O1A | O5B | 124.4° | 120.0° |
| O3A | P1A | O5B | C5B | 174.5° | 175.0° |
| O3A | P1A | O1A | H53 | 118.8° | 60.0° |
| C5A | C4A | N9A | C8A | 0.1° | 0.3° |
| C5A | C4A | N3A | C2A | 0.1° | 0.0° |
| C5A | C4A | N9A | N3A | 179.9° | 179.9° |
| C5A | C4A | N9A | C1B | 179.9° | 180.0° |
| N1A | C2A | N3A | H63 | 180.0° | 180.0° |
| N1A | C2A | N3A | C4A | 0.2° | 0.0° |
| C8A | N9A | C4A | C1B | 179.8° | 179.7° |
| C8A | N9A | C4A | N3A | 179.8° | 179.8° |
| C8A | N9A | C1B | O4B | 25.7° | 23.2° |
| C8A | N9A | C1B | C2B | 94.0° | 92.2° |
| C8A | N9A | C1B | H62 | 146.6° | 145.5° |
| O2A | P1A | O1A | O5B | 116.8° | 120.0° |
| O2A | P1A | O5B | C5B | 50.3° | 55.0° |
| O2A | P1A | O1A | H53 | 0.0° | 180.0° |
| O1A | P1A | O5B | C5B | 62.2° | 65.0° |
| P1A | O5B | C5B | C4B | 156.1° | 180.0° |
| O5B | P1A | O1A | H53 | 116.8° | 60.0° |
| P1A | O5B | C5B | H54 | 35.9° | 60.0° |
| P1A | O5B | C5B | H55 | 83.6° | 60.0° |
| C2A | N3A | C4A | N9A | 180.0° | 179.9° |
| C4A | N9A | C1B | O4B | 154.1° | 156.4° |
| C4A | N9A | C1B | C2B | 86.2° | 88.2° |
| C4A | N9A | C1B | H62 | 33.2° | 34.1° |
| C4A | N9A | C8A | H64 | 180.0° | 179.7° |
| N3A | C4A | N9A | C1B | 0.1° | 0.1° |
| C4A | N3A | C2A | H63 | 179.8° | 180.0° |
| N9A | C1B | O4B | C2B | 121.7° | 118.8° |
| N9A | C1B | O4B | H62 | 121.1° | 122.3° |
| N9A | C1B | O4B | C4B | 130.6° | 159.3° |
| N9A | C1B | C2B | H62 | 119.9° | 122.3° |
| N9A | C1B | C2B | C3B | 133.2° | 142.8° |
| N9A | C1B | C2B | O2B | 108.7° | 98.6° |
| N9A | C1B | C2B | H60 | 13.5° | 24.1° |
| C1B | N9A | C8A | H64 | 0.2° | 0.0° |
| O5B | C5B | C4B | O4B | 8.8° | 69.6° |
| O5B | C5B | C4B | H54 | 120.2° | 120.1° |
| O5B | C5B | C4B | H55 | 120.2° | 120.0° |
| O5B | C5B | C4B | C3B | 127.1° | 175.0° |
| O5B | C5B | H54 | H55 | 119.3° | 120.0° |
| O5B | C5B | C4B | H56 | 113.3° | 52.7° |
| O4B | C1B | C2B | H62 | 117.5° | 118.9° |
| C1B | O4B | C4B | C5B | 122.4° | 159.4° |
| O4B | C1B | C2B | C3B | 10.7° | 24.0° |
| O4B | C1B | C2B | O2B | 128.8° | 142.6° |
| C1B | O4B | C4B | C3B | 3.6° | 40.5° |
| C1B | O4B | C4B | H56 | 115.7° | 78.4° |
| O4B | C1B | C2B | H60 | 109.0° | 94.7° |
| C4B | O4B | C1B | C2B | 8.9° | 40.5° |
| O4B | C4B | C5B | C3B | 118.3° | 115.4° |
| O4B | C4B | C5B | H56 | 122.1° | 122.3° |
| O4B | C4B | C3B | C2B | 3.1° | 24.0° |
| O4B | C4B | C3B | H56 | 119.7° | 119.0° |
| O4B | C4B | C3B | O3B | 115.3° | 142.6° |
| O4B | C4B | C5B | H54 | 111.5° | 50.5° |
| O4B | C4B | C5B | H55 | 129.0° | 170.4° |
| O4B | C4B | C3B | H57 | 123.3° | 94.8° |
| C4B | O4B | C1B | H62 | 108.3° | 78.3° |
| C1B | C2B | C3B | O2B | 118.7° | 118.6° |
| C1B | C2B | C3B | H60 | 119.5° | 118.8° |
| C1B | C2B | O2B | H60 | 121.6° | 122.8° |
| C1B | C2B | C3B | C4B | 8.4° | 0.0° |
| C1B | C2B | C3B | O3B | 109.2° | 118.6° |
| C1B | C2B | C3B | H57 | 128.4° | 118.7° |
| C1B | C2B | O2B | H61 | 180.0° | 65.4° |
| C5B | C4B | C3B | C2B | 117.6° | 142.8° |
| C5B | C4B | C3B | H56 | 119.6° | 122.2° |
| C5B | C4B | C3B | O3B | 124.0° | 98.6° |
| C4B | C5B | H54 | H55 | 119.3° | 120.0° |
| C5B | C4B | C3B | H57 | 2.5° | 24.0° |
| C3B | C2B | O2B | H60 | 121.4° | 122.6° |
| C2B | C3B | C4B | O3B | 118.4° | 118.6° |
| C2B | C3B | C4B | H57 | 120.1° | 118.8° |
| C2B | C3B | O3B | H57 | 122.0° | 122.8° |
| C2B | C3B | O3B | P3B | 157.3° | 125.4° |
| C2B | C3B | C4B | H56 | 122.8° | 95.0° |
| C3B | C2B | O2B | H61 | 63.0° | 180.0° |
| C3B | C2B | C1B | H62 | 106.9° | 94.9° |
| O2B | C2B | C3B | C4B | 127.1° | 118.7° |
| O2B | C2B | C3B | O3B | 9.5° | 0.0° |
| O2B | C2B | C3B | H57 | 112.9° | 122.6° |
| O2B | C2B | C1B | H62 | 11.2° | 23.8° |
| C4B | C3B | O3B | H57 | 120.9° | 122.6° |
| C4B | C3B | O3B | P3B | 85.6° | 120.0° |
| C3B | C4B | C5B | H54 | 6.9° | 65.0° |
| C3B | C4B | C5B | H55 | 112.7° | 55.0° |
| C4B | C3B | C2B | H60 | 111.0° | 118.8° |
| C3B | O3B | P3B | O9A | 25.9° | 55.0° |
| C3B | O3B | P3B | O7A | 94.9° | 65.0° |
| C3B | O3B | P3B | O8A | 145.3° | 175.0° |
| O3B | C3B | C4B | H56 | 4.4° | 23.6° |
| O3B | C3B | C2B | H60 | 131.4° | 122.6° |
| O3B | P3B | O9A | O7A | 124.6° | 120.0° |
| O3B | P3B | O9A | O8A | 123.7° | 120.0° |
| O3B | P3B | O7A | O8A | 123.2° | 120.0° |
| P3B | O3B | C3B | H57 | 35.3° | 2.6° |
| O3B | P3B | O8A | H58 | 125.6° | 180.0° |
| O3B | P3B | O7A | H59 | 126.4° | 59.9° |
| O9A | P3B | O7A | O8A | 110.3° | 120.0° |
| O9A | P3B | O8A | H58 | 0.0° | 59.9° |
| O9A | P3B | O7A | H59 | 0.0° | 180.0° |
| O7A | P3B | O8A | H58 | 111.0° | 60.1° |
| O8A | P3B | O7A | H59 | 110.3° | 60.0° |
| H1 | C2 | C1 | H4 | 55.8° | 56.6° |
| H1 | C2 | C1 | H5 | 62.9° | 175.1° |
| H2 | C2 | C1 | H4 | 179.1° | 64.3° |
| H2 | C2 | C1 | H5 | 60.4° | 54.2° |
| H6 | C19 | H7 | H8 | 120.0° | 120.0° |
| H9 | C9 | C11 | H10 | 170.0° | 54.8° |
| H9 | C9 | C11 | H11 | 50.0° | 173.7° |
| H9 | C9 | C8 | H27 | 177.7° | 177.9° |
| H10 | C11 | C12 | H12 | 168.2° | 58.6° |
| H10 | C11 | C12 | H13 | 48.8° | 62.4° |
| H11 | C11 | C12 | H12 | 48.2° | 177.4° |
| H11 | C11 | C12 | H13 | 71.2° | 56.5° |
| H14 | C18 | H15 | H16 | 120.0° | 120.0° |
| H17 | C17 | C20 | H18 | 177.2° | 176.4° |
| H17 | C17 | C16 | H22 | 141.8° | 3.7° |
| H17 | C17 | C16 | H23 | 20.6° | 125.2° |
| H18 | C20 | C21 | H19 | 62.3° | 54.9° |
| H18 | C20 | C21 | H20 | 57.6° | 65.1° |
| H18 | C20 | C21 | H21 | 177.7° | 175.0° |
| H19 | C21 | H20 | H21 | 120.0° | 120.0° |
| H22 | C16 | C15 | H24 | 11.7° | 23.1° |
| H22 | C16 | C15 | H25 | 111.3° | 146.4° |
| H23 | C16 | C15 | H24 | 132.9° | 98.5° |
| H23 | C16 | C15 | H25 | 9.9° | 24.8° |
| H24 | C15 | C14 | H26 | 162.9° | 42.7° |
| H25 | C15 | C14 | H26 | 40.0° | 165.9° |
| H26 | C14 | C8 | H27 | 175.0° | 174.6° |
| H27 | C8 | C7 | H28 | 179.0° | 178.0° |
| H27 | C8 | C7 | H29 | 59.9° | 62.3° |
| H28 | C7 | C6 | H30 | 169.6° | 175.9° |
| H28 | C7 | C6 | H31 | 48.4° | 54.8° |
| H29 | C7 | C6 | H30 | 50.4° | 56.1° |
| H29 | C7 | C6 | H31 | 70.8° | 65.1° |
| H32 | C2P | C3P | H34 | 165.1° | 180.0° |
| H32 | C2P | C3P | H35 | 47.0° | 60.0° |
| H33 | C2P | C3P | H34 | 74.3° | 60.0° |
| H33 | C2P | C3P | H35 | 167.6° | 180.0° |
| H34 | C3P | N4P | H36 | 26.1° | 120.0° |
| H35 | C3P | N4P | H36 | 92.0° | 120.0° |
| H37 | C6P | C7P | H39 | 165.5° | 179.9° |
| H37 | C6P | C7P | H40 | 75.3° | 60.0° |
| H38 | C6P | C7P | H39 | 45.8° | 60.0° |
| H38 | C6P | C7P | H40 | 165.0° | 179.9° |
| H39 | C7P | N8P | H41 | 120.7° | 120.0° |
| H40 | C7P | N8P | H41 | 1.5° | 120.0° |
| H42 | CAP | OAP | H43 | 60.2° | 180.0° |
| H44 | CDP | H45 | H46 | 120.0° | 120.0° |
| H47 | CEP | H48 | H49 | 120.0° | 120.0° |
| H54 | C5B | C4B | H56 | 126.5° | 172.8° |
| H55 | C5B | C4B | H56 | 6.9° | 67.3° |
| H56 | C4B | C3B | H57 | 117.1° | 146.2° |
| H57 | C3B | C2B | H60 | 9.0° | 0.1° |
| H60 | C2B | O2B | H61 | 58.4° | 57.4° |
| H60 | C2B | C1B | H62 | 133.5° | 146.5° |
