6NB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C26 | sing | 1.53Å | 1.52Å | |
| C27 | O06 | sing | 1.43Å | 1.41Å | |
| C26 | O05 | sing | 1.43Å | 1.41Å | |
| C25 | O05 | sing | 1.43Å | 1.41Å | |
| C25 | C24 | sing | 1.53Å | 1.52Å | |
| O06 | C28 | sing | 1.43Å | 1.44Å | |
| C29 | O07 | sing | 1.43Å | 1.39Å | |
| C29 | C28 | sing | 1.53Å | 1.55Å | |
| O04 | C24 | sing | 1.43Å | 1.44Å | |
| O04 | C01 | sing | 1.36Å | 1.47Å | |
| O07 | C30 | sing | 1.36Å | 1.42Å | |
| C31 | C30 | doub | 1.39Å | 1.38Å | Aromatic |
| C31 | C32 | sing | 1.38Å | 1.38Å | Aromatic |
| C02 | C01 | doub | 1.39Å | 1.37Å | Aromatic |
| C02 | C03 | sing | 1.38Å | 1.42Å | Aromatic |
| C01 | C06 | sing | 1.39Å | 1.42Å | Aromatic |
| C30 | C35 | sing | 1.39Å | 1.43Å | Aromatic |
| C32 | C33 | doub | 1.39Å | 1.42Å | Aromatic |
| C03 | C04 | doub | 1.39Å | 1.39Å | Aromatic |
| O08 | C43 | doub | 1.22Å | 1.19Å | |
| F03 | C49 | sing | 1.35Å | 1.32Å | |
| O | S | doub | 1.42Å | 1.46Å | |
| O09 | S | doub | 1.42Å | 1.44Å | |
| C06 | C05 | doub | 1.38Å | 1.41Å | Aromatic |
| C35 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| O01 | C14 | doub | 1.22Å | 1.21Å | |
| N | C48 | sing | 1.40Å | 1.40Å | |
| N | S | sing | 1.66Å | 1.67Å | |
| C49 | C48 | doub | 1.39Å | 1.37Å | Aromatic |
| C49 | C44 | sing | 1.40Å | 1.37Å | Aromatic |
| C33 | C34 | sing | 1.39Å | 1.38Å | Aromatic |
| C33 | C36 | sing | 1.48Å | 1.52Å | |
| C43 | C44 | sing | 1.48Å | 1.57Å | |
| C43 | C41 | sing | 1.47Å | 1.50Å | |
| F01 | C20 | sing | 1.35Å | 1.36Å | |
| C48 | C47 | sing | 1.39Å | 1.42Å | Aromatic |
| S | C50 | sing | 1.81Å | 1.79Å | |
| C04 | C05 | sing | 1.39Å | 1.40Å | Aromatic |
| C04 | C07 | sing | 1.48Å | 1.53Å | |
| C44 | C45 | doub | 1.40Å | 1.40Å | Aromatic |
| C37 | C36 | doub | 1.39Å | 1.42Å | Aromatic |
| C37 | C38 | sing | 1.39Å | 1.42Å | Aromatic |
| O03 | S01 | doub | 1.42Å | 1.43Å | |
| C47 | C46 | doub | 1.38Å | 1.40Å | Aromatic |
| C08 | C07 | doub | 1.40Å | 1.44Å | Aromatic |
| C08 | C09 | sing | 1.39Å | 1.44Å | Aromatic |
| C45 | C46 | sing | 1.38Å | 1.40Å | Aromatic |
| C45 | F | sing | 1.35Å | 1.36Å | |
| N03 | C19 | sing | 1.40Å | 1.41Å | |
| N03 | S01 | sing | 1.66Å | 1.66Å | |
| C14 | C15 | sing | 1.48Å | 1.53Å | |
| C14 | C12 | sing | 1.47Å | 1.53Å | |
| C20 | C19 | doub | 1.39Å | 1.40Å | Aromatic |
| C20 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| C36 | C40 | sing | 1.40Å | 1.40Å | Aromatic |
| O02 | S01 | doub | 1.42Å | 1.42Å | |
| C07 | C11 | sing | 1.40Å | 1.38Å | Aromatic |
| C41 | C38 | sing | 1.47Å | 1.47Å | Aromatic |
| C41 | C42 | doub | 1.37Å | 1.38Å | Aromatic |
| C19 | C18 | sing | 1.39Å | 1.41Å | Aromatic |
| C15 | C16 | doub | 1.40Å | 1.40Å | Aromatic |
| C38 | C39 | doub | 1.41Å | 1.37Å | Aromatic |
| S01 | C21 | sing | 1.81Å | 1.78Å | |
| C09 | C12 | sing | 1.47Å | 1.46Å | Aromatic |
| C09 | C10 | doub | 1.41Å | 1.37Å | Aromatic |
| C50 | C51 | sing | 1.53Å | 1.52Å | |
| C12 | C13 | doub | 1.37Å | 1.42Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.42Å | Aromatic |
| C16 | F02 | sing | 1.35Å | 1.35Å | |
| C16 | C17 | sing | 1.38Å | 1.41Å | Aromatic |
| C40 | N04 | doub | 1.31Å | 1.30Å | Aromatic |
| C11 | N01 | doub | 1.31Å | 1.34Å | Aromatic |
| C42 | N05 | sing | 1.35Å | 1.35Å | Aromatic |
| C39 | N04 | sing | 1.33Å | 1.37Å | Aromatic |
| C39 | N05 | sing | 1.38Å | 1.34Å | Aromatic |
| C51 | C | sing | 1.53Å | 1.51Å | |
| C10 | N01 | sing | 1.33Å | 1.35Å | Aromatic |
| C10 | N02 | sing | 1.38Å | 1.37Å | Aromatic |
| C21 | C22 | sing | 1.53Å | 1.56Å | |
| C13 | N02 | sing | 1.35Å | 1.31Å | Aromatic |
| C22 | C23 | sing | 1.53Å | 1.55Å | |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.08Å | 1.08Å | |
| C21 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H6 | sing | 1.09Å | 1.10Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C26 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C28 | H12 | sing | 1.09Å | 1.10Å | |
| N03 | H13 | sing | 0.97Å | 1.00Å | |
| N05 | H14 | sing | 0.97Å | 1.00Å | |
| N | H15 | sing | 0.97Å | 1.00Å | |
| C02 | H16 | sing | 1.08Å | 1.08Å | |
| C03 | H17 | sing | 1.08Å | 1.08Å | |
| C05 | H18 | sing | 1.08Å | 1.08Å | |
| C06 | H19 | sing | 1.08Å | 1.08Å | |
| C08 | H20 | sing | 1.08Å | 1.08Å | |
| C11 | H21 | sing | 1.08Å | 1.08Å | |
| C18 | H23 | sing | 1.08Å | 1.08Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C29 | H31 | sing | 1.09Å | 1.10Å | |
| C29 | H32 | sing | 1.09Å | 1.10Å | |
| C31 | H33 | sing | 1.08Å | 1.08Å | |
| C32 | H34 | sing | 1.08Å | 1.08Å | |
| C34 | H35 | sing | 1.08Å | 1.08Å | |
| C35 | H36 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C40 | H38 | sing | 1.08Å | 1.08Å | |
| C42 | H39 | sing | 1.08Å | 1.08Å | |
| C46 | H40 | sing | 1.08Å | 1.08Å | |
| C47 | H41 | sing | 1.08Å | 1.08Å | |
| C50 | H42 | sing | 1.09Å | 1.10Å | |
| C50 | H43 | sing | 1.09Å | 1.10Å | |
| C51 | H44 | sing | 1.09Å | 1.10Å | |
| C51 | H45 | sing | 1.09Å | 1.10Å | |
| C | H46 | sing | 1.09Å | 1.10Å | |
| C | H47 | sing | 1.09Å | 1.10Å | |
| C | H48 | sing | 1.09Å | 1.10Å | |
| N02 | H49 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C26 | C27 | O06 | 106.9° | 109.5° |
| C27 | C26 | O05 | 108.9° | 109.5° |
| C27 | C26 | H9 | 109.6° | 109.5° |
| C27 | C26 | H10 | 109.6° | 109.5° |
| C26 | C27 | H29 | 110.1° | 109.5° |
| C26 | C27 | H30 | 110.1° | 109.5° |
| C27 | O06 | C28 | 114.3° | 114.0° |
| O06 | C27 | H29 | 110.1° | 109.5° |
| O06 | C27 | H30 | 110.1° | 109.5° |
| C26 | O05 | C25 | 113.3° | 114.0° |
| O05 | C26 | H9 | 109.6° | 109.4° |
| O05 | C26 | H10 | 109.6° | 109.4° |
| O05 | C25 | C24 | 108.9° | 109.5° |
| O05 | C25 | H27 | 109.6° | 109.4° |
| O05 | C25 | H28 | 109.6° | 109.4° |
| C25 | C24 | O04 | 107.1° | 109.4° |
| C25 | C24 | H7 | 110.1° | 109.5° |
| C25 | C24 | H8 | 110.0° | 109.5° |
| C24 | C25 | H27 | 109.6° | 109.4° |
| C24 | C25 | H28 | 109.6° | 109.5° |
| O06 | C28 | C29 | 104.0° | 109.5° |
| O06 | C28 | H11 | 110.8° | 109.5° |
| O06 | C28 | H12 | 110.8° | 109.5° |
| O07 | C29 | C28 | 104.5° | 109.5° |
| C29 | O07 | C30 | 110.3° | 117.0° |
| O07 | C29 | H31 | 110.7° | 109.5° |
| O07 | C29 | H32 | 110.7° | 109.5° |
| C29 | C28 | H11 | 110.8° | 109.5° |
| C29 | C28 | H12 | 110.8° | 109.5° |
| C28 | C29 | H31 | 110.7° | 109.5° |
| C28 | C29 | H32 | 110.7° | 109.5° |
| C24 | O04 | C01 | 113.7° | 117.0° |
| O04 | C24 | H7 | 110.1° | 109.4° |
| O04 | C24 | H8 | 110.1° | 109.4° |
| O04 | C01 | C02 | 118.8° | 119.9° |
| O04 | C01 | C06 | 121.0° | 119.9° |
| O07 | C30 | C31 | 118.4° | 119.9° |
| O07 | C30 | C35 | 119.4° | 119.9° |
| C30 | C31 | C32 | 119.9° | 120.1° |
| C31 | C30 | C35 | 122.2° | 120.1° |
| C30 | C31 | H33 | 120.0° | 119.9° |
| C31 | C32 | C33 | 118.2° | 120.0° |
| C32 | C31 | H33 | 120.1° | 120.0° |
| C31 | C32 | H34 | 120.9° | 120.0° |
| C01 | C02 | C03 | 120.3° | 120.0° |
| C02 | C01 | C06 | 120.1° | 120.2° |
| C01 | C02 | H16 | 119.8° | 120.0° |
| C02 | C03 | C04 | 119.7° | 119.9° |
| C03 | C02 | H16 | 119.8° | 119.9° |
| C02 | C03 | H17 | 120.1° | 120.0° |
| C01 | C06 | C05 | 119.7° | 120.1° |
| C01 | C06 | H19 | 120.1° | 120.0° |
| C30 | C35 | C34 | 117.6° | 120.1° |
| C30 | C35 | H36 | 121.2° | 120.0° |
| C32 | C33 | C34 | 121.9° | 119.9° |
| C32 | C33 | C36 | 118.6° | 120.1° |
| C33 | C32 | H34 | 120.9° | 120.0° |
| C03 | C04 | C05 | 121.0° | 119.9° |
| C03 | C04 | C07 | 118.4° | 120.0° |
| C04 | C03 | H17 | 120.2° | 120.0° |
| O08 | C43 | C44 | 119.3° | 120.0° |
| O08 | C43 | C41 | 122.3° | 120.0° |
| F03 | C49 | C48 | 121.9° | 120.1° |
| F03 | C49 | C44 | 118.5° | 120.1° |
| O | S | O09 | 104.0° | 121.0° |
| O | S | N | 107.7° | 104.3° |
| O | S | C50 | 107.9° | 110.5° |
| O09 | S | N | 105.7° | 104.3° |
| O09 | S | C50 | 117.7° | 110.5° |
| C06 | C05 | C04 | 119.1° | 119.9° |
| C06 | C05 | H18 | 120.4° | 120.1° |
| C05 | C06 | H19 | 120.1° | 119.9° |
| C35 | C34 | C33 | 120.2° | 119.9° |
| C35 | C34 | H35 | 119.9° | 120.0° |
| C34 | C35 | H36 | 121.2° | 119.9° |
| O01 | C14 | C15 | 121.1° | 120.0° |
| O01 | C14 | C12 | 121.8° | 120.0° |
| C48 | N | S | 121.1° | 120.0° |
| N | C48 | C49 | 116.8° | 120.0° |
| N | C48 | C47 | 122.1° | 120.0° |
| C48 | N | H15 | 106.5° | 120.0° |
| N | S | C50 | 113.1° | 104.5° |
| S | N | H15 | 106.5° | 120.0° |
| C48 | C49 | C44 | 119.6° | 119.8° |
| C49 | C48 | C47 | 121.1° | 120.0° |
| C49 | C44 | C43 | 116.7° | 120.2° |
| C49 | C44 | C45 | 120.6° | 119.7° |
| C34 | C33 | C36 | 119.5° | 120.1° |
| C33 | C34 | H35 | 119.9° | 120.0° |
| C33 | C36 | C37 | 120.5° | 120.5° |
| C33 | C36 | C40 | 118.4° | 120.4° |
| C44 | C43 | C41 | 118.2° | 120.0° |
| C43 | C44 | C45 | 122.8° | 120.2° |
| C43 | C41 | C38 | 127.6° | 126.9° |
| C43 | C41 | C42 | 125.8° | 126.8° |
| F01 | C20 | C19 | 121.4° | 120.1° |
| F01 | C20 | C15 | 118.9° | 120.2° |
| C48 | C47 | C46 | 119.5° | 120.3° |
| C48 | C47 | H41 | 120.2° | 119.8° |
| S | C50 | C51 | 114.5° | 109.5° |
| S | C50 | H42 | 108.2° | 109.5° |
| S | C50 | H43 | 108.2° | 109.5° |
| C05 | C04 | C07 | 120.6° | 120.1° |
| C04 | C05 | H18 | 120.4° | 120.1° |
| C04 | C07 | C08 | 120.9° | 120.5° |
| C04 | C07 | C11 | 119.1° | 120.5° |
| C44 | C45 | C46 | 121.2° | 120.0° |
| C44 | C45 | F | 116.4° | 120.0° |
| C36 | C37 | C38 | 116.3° | 118.0° |
| C37 | C36 | C40 | 121.1° | 119.1° |
| C36 | C37 | H37 | 121.9° | 121.0° |
| C37 | C38 | C41 | 135.8° | 134.2° |
| C37 | C38 | C39 | 118.8° | 119.8° |
| C38 | C37 | H37 | 121.9° | 121.0° |
| O03 | S01 | N03 | 104.5° | 104.3° |
| O03 | S01 | O02 | 108.4° | 121.0° |
| O03 | S01 | C21 | 114.0° | 110.5° |
| C47 | C46 | C45 | 118.0° | 120.3° |
| C47 | C46 | H40 | 121.0° | 119.8° |
| C46 | C47 | H41 | 120.2° | 119.9° |
| C07 | C08 | C09 | 116.2° | 118.0° |
| C08 | C07 | C11 | 119.9° | 119.0° |
| C07 | C08 | H20 | 122.0° | 121.0° |
| C08 | C09 | C12 | 135.1° | 134.2° |
| C08 | C09 | C10 | 120.0° | 119.7° |
| C09 | C08 | H20 | 121.9° | 121.0° |
| C46 | C45 | F | 122.4° | 120.0° |
| C45 | C46 | H40 | 121.0° | 119.9° |
| C19 | N03 | S01 | 120.8° | 120.0° |
| N03 | C19 | C20 | 117.0° | 120.0° |
| N03 | C19 | C18 | 122.1° | 120.0° |
| C19 | N03 | H13 | 106.6° | 120.0° |
| N03 | S01 | O02 | 107.1° | 104.3° |
| N03 | S01 | C21 | 118.0° | 104.5° |
| S01 | N03 | H13 | 106.6° | 120.0° |
| C15 | C14 | C12 | 117.1° | 120.0° |
| C14 | C15 | C20 | 118.3° | 120.1° |
| C14 | C15 | C16 | 121.3° | 120.1° |
| C14 | C12 | C09 | 127.8° | 126.9° |
| C14 | C12 | C13 | 126.2° | 126.8° |
| C19 | C20 | C15 | 119.7° | 119.7° |
| C20 | C19 | C18 | 120.8° | 120.1° |
| C20 | C15 | C16 | 120.4° | 119.7° |
| C36 | C40 | N04 | 120.5° | 121.3° |
| C36 | C40 | H38 | 119.8° | 119.3° |
| O02 | S01 | C21 | 104.5° | 110.6° |
| C07 | C11 | N01 | 121.5° | 121.3° |
| C07 | C11 | H21 | 119.3° | 119.3° |
| C38 | C41 | C42 | 106.5° | 106.3° |
| C41 | C38 | C39 | 105.5° | 106.1° |
| C41 | C42 | N05 | 107.7° | 109.7° |
| C41 | C42 | H39 | 126.1° | 125.1° |
| C19 | C18 | C17 | 119.7° | 120.3° |
| C19 | C18 | H23 | 120.2° | 119.9° |
| C15 | C16 | F02 | 116.4° | 120.1° |
| C15 | C16 | C17 | 121.1° | 120.0° |
| C38 | C39 | N04 | 122.8° | 120.0° |
| C38 | C39 | N05 | 109.2° | 107.3° |
| S01 | C21 | C22 | 112.0° | 109.5° |
| S01 | C21 | H3 | 108.8° | 109.5° |
| S01 | C21 | H4 | 108.8° | 109.5° |
| C12 | C09 | C10 | 104.9° | 106.1° |
| C09 | C12 | C13 | 106.0° | 106.3° |
| C09 | C10 | N01 | 121.0° | 119.9° |
| C09 | C10 | N02 | 109.8° | 107.3° |
| C50 | C51 | C | 108.9° | 109.5° |
| C51 | C50 | H42 | 108.2° | 109.4° |
| C51 | C50 | H43 | 108.2° | 109.5° |
| C50 | C51 | H44 | 109.6° | 109.5° |
| C50 | C51 | H45 | 109.6° | 109.4° |
| C12 | C13 | N02 | 108.8° | 109.7° |
| C12 | C13 | H1 | 125.6° | 125.2° |
| C18 | C17 | C16 | 118.3° | 120.2° |
| C18 | C17 | H2 | 120.8° | 119.8° |
| C17 | C18 | H23 | 120.2° | 119.8° |
| F02 | C16 | C17 | 122.5° | 120.0° |
| C16 | C17 | H2 | 120.8° | 119.9° |
| C40 | N04 | C39 | 120.6° | 121.9° |
| N04 | C40 | H38 | 119.8° | 119.3° |
| C11 | N01 | C10 | 121.5° | 122.0° |
| N01 | C11 | H21 | 119.2° | 119.4° |
| C42 | N05 | C39 | 111.0° | 110.6° |
| C42 | N05 | H14 | 124.5° | 124.7° |
| N05 | C42 | H39 | 126.2° | 125.1° |
| N04 | C39 | N05 | 127.9° | 132.7° |
| C39 | N05 | H14 | 124.5° | 124.7° |
| C | C51 | H44 | 109.6° | 109.5° |
| C | C51 | H45 | 109.6° | 109.5° |
| C51 | C | H46 | 109.5° | 109.5° |
| C51 | C | H47 | 109.5° | 109.5° |
| C51 | C | H48 | 109.5° | 109.5° |
| N01 | C10 | N02 | 129.2° | 132.8° |
| C10 | N02 | C13 | 110.5° | 110.6° |
| C10 | N02 | H49 | 124.7° | 124.6° |
| C21 | C22 | C23 | 109.2° | 109.5° |
| C22 | C21 | H3 | 108.8° | 109.5° |
| C22 | C21 | H4 | 108.8° | 109.5° |
| C21 | C22 | H5 | 109.5° | 109.5° |
| C21 | C22 | H6 | 109.5° | 109.5° |
| N02 | C13 | H1 | 125.6° | 125.1° |
| C13 | N02 | H49 | 124.7° | 124.7° |
| C23 | C22 | H5 | 109.6° | 109.5° |
| C23 | C22 | H6 | 109.5° | 109.5° |
| C22 | C23 | H24 | 109.5° | 109.4° |
| C22 | C23 | H25 | 109.4° | 109.4° |
| C22 | C23 | H26 | 109.5° | 109.5° |
| H3 | C21 | H4 | 109.5° | 109.4° |
| H5 | C22 | H6 | 109.5° | 109.4° |
| H7 | C24 | H8 | 109.5° | 109.5° |
| H9 | C26 | H10 | 109.5° | 109.5° |
| H11 | C28 | H12 | 109.4° | 109.5° |
| H24 | C23 | H25 | 109.5° | 109.5° |
| H24 | C23 | H26 | 109.5° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.5° |
| H27 | C25 | H28 | 109.5° | 109.5° |
| H29 | C27 | H30 | 109.5° | 109.5° |
| H31 | C29 | H32 | 109.4° | 109.4° |
| H42 | C50 | H43 | 109.5° | 109.5° |
| H44 | C51 | H45 | 109.5° | 109.4° |
| H46 | C | H47 | 109.5° | 109.5° |
| H46 | C | H48 | 109.5° | 109.4° |
| H47 | C | H48 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C26 | C27 | O06 | H29 | 119.6° | 120.0° |
| C26 | C27 | O06 | H30 | 119.6° | 120.0° |
| C27 | C26 | O05 | H9 | 119.9° | 120.0° |
| C27 | C26 | O05 | H10 | 119.9° | 120.0° |
| C27 | C26 | O05 | C25 | 170.1° | 180.0° |
| C26 | C27 | O06 | C28 | 150.2° | 180.0° |
| C27 | C26 | H9 | H10 | 120.3° | 120.1° |
| C26 | C27 | H29 | H30 | 121.2° | 120.0° |
| O06 | C27 | C26 | O05 | 9.2° | 65.0° |
| C27 | O06 | C28 | C29 | 8.6° | 180.0° |
| O06 | C27 | C26 | H9 | 129.1° | 175.0° |
| O06 | C27 | C26 | H10 | 110.8° | 55.0° |
| C27 | O06 | C28 | H11 | 127.7° | 60.0° |
| C27 | O06 | C28 | H12 | 110.6° | 60.0° |
| O06 | C27 | H29 | H30 | 121.2° | 120.0° |
| C26 | O05 | C25 | C24 | 137.4° | 179.9° |
| O05 | C26 | H9 | H10 | 120.2° | 119.9° |
| C26 | O05 | C25 | H27 | 102.6° | 60.0° |
| C26 | O05 | C25 | H28 | 17.5° | 60.0° |
| O05 | C26 | C27 | H29 | 128.8° | 175.0° |
| O05 | C26 | C27 | H30 | 110.4° | 55.0° |
| O05 | C25 | C24 | H27 | 119.9° | 119.9° |
| O05 | C25 | C24 | H28 | 119.9° | 120.0° |
| O05 | C25 | C24 | O04 | 157.7° | 65.0° |
| O05 | C25 | C24 | H7 | 82.6° | 175.0° |
| O05 | C25 | C24 | H8 | 38.1° | 54.9° |
| C25 | O05 | C26 | H9 | 50.2° | 60.0° |
| C25 | O05 | C26 | H10 | 70.0° | 60.0° |
| O05 | C25 | H27 | H28 | 120.3° | 120.0° |
| C25 | C24 | O04 | H7 | 119.6° | 120.0° |
| C25 | C24 | O04 | H8 | 119.6° | 120.0° |
| C25 | C24 | O04 | C01 | 179.6° | 180.0° |
| C25 | C24 | H7 | H8 | 121.1° | 120.1° |
| C24 | C25 | H27 | H28 | 120.2° | 120.1° |
| O06 | C28 | C29 | O07 | 160.2° | 65.0° |
| O06 | C28 | C29 | H11 | 119.2° | 120.0° |
| O06 | C28 | C29 | H12 | 119.1° | 120.0° |
| O06 | C28 | H11 | H12 | 122.5° | 120.0° |
| C28 | O06 | C27 | H29 | 30.6° | 60.0° |
| C28 | O06 | C27 | H30 | 90.2° | 60.0° |
| O06 | C28 | C29 | H31 | 40.9° | 175.0° |
| O06 | C28 | C29 | H32 | 80.6° | 55.0° |
| O07 | C29 | C28 | H31 | 119.2° | 120.0° |
| O07 | C29 | C28 | H32 | 119.2° | 120.0° |
| C29 | O07 | C30 | C31 | 116.4° | 0.3° |
| C29 | O07 | C30 | C35 | 63.2° | 180.0° |
| O07 | C29 | C28 | H11 | 41.0° | 175.0° |
| O07 | C29 | C28 | H12 | 80.7° | 55.0° |
| O07 | C29 | H31 | H32 | 122.3° | 120.0° |
| C28 | C29 | O07 | C30 | 130.6° | 180.0° |
| C29 | C28 | H11 | H12 | 122.5° | 120.0° |
| C28 | C29 | H31 | H32 | 122.3° | 120.0° |
| C24 | O04 | C01 | C02 | 152.8° | 0.3° |
| C24 | O04 | C01 | C06 | 28.0° | 180.0° |
| O04 | C24 | H7 | H8 | 121.1° | 119.9° |
| O04 | C24 | C25 | H27 | 37.8° | 175.1° |
| O04 | C24 | C25 | H28 | 82.3° | 55.0° |
| O04 | C01 | C02 | C06 | 179.3° | 179.8° |
| O04 | C01 | C02 | C03 | 179.9° | 179.8° |
| O04 | C01 | C06 | C05 | 179.9° | 179.7° |
| C01 | O04 | C24 | H7 | 60.0° | 60.0° |
| C01 | O04 | C24 | H8 | 60.8° | 60.0° |
| O04 | C01 | C02 | H16 | 0.1° | 0.3° |
| O04 | C01 | C06 | H19 | 0.2° | 0.2° |
| O07 | C30 | C31 | C35 | 179.6° | 179.7° |
| O07 | C30 | C31 | C32 | 179.4° | 179.7° |
| O07 | C30 | C35 | C34 | 179.8° | 179.7° |
| C30 | O07 | C29 | H31 | 110.2° | 59.9° |
| C30 | O07 | C29 | H32 | 11.4° | 60.0° |
| O07 | C30 | C31 | H33 | 0.6° | 0.3° |
| O07 | C30 | C35 | H36 | 0.1° | 0.2° |
| C30 | C31 | C32 | H33 | 180.0° | 180.0° |
| C30 | C31 | C32 | C33 | 1.3° | 0.0° |
| C31 | C30 | C35 | C34 | 0.3° | 0.0° |
| C30 | C31 | C32 | H34 | 178.7° | 180.0° |
| C31 | C30 | C35 | H36 | 179.7° | 179.9° |
| C32 | C31 | C30 | C35 | 1.0° | 0.0° |
| C31 | C32 | C33 | H34 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.8° | 0.0° |
| C31 | C32 | C33 | C36 | 179.8° | 180.0° |
| C01 | C02 | C03 | H16 | 180.0° | 179.9° |
| C01 | C02 | C03 | C04 | 0.1° | 0.1° |
| C02 | C01 | C06 | C05 | 0.6° | 0.0° |
| C01 | C02 | C03 | H17 | 179.9° | 180.0° |
| C02 | C01 | C06 | H19 | 179.4° | 180.0° |
| C03 | C02 | C01 | C06 | 0.6° | 0.0° |
| C02 | C03 | C04 | H17 | 180.0° | 179.9° |
| C02 | C03 | C04 | C05 | 0.5° | 0.1° |
| C02 | C03 | C04 | C07 | 179.8° | 180.0° |
| C01 | C06 | C05 | H19 | 180.0° | 179.9° |
| C01 | C06 | C05 | C04 | 0.1° | 0.0° |
| C06 | C01 | C02 | H16 | 179.4° | 179.9° |
| C01 | C06 | C05 | H18 | 180.0° | 180.0° |
| C30 | C35 | C34 | H36 | 180.0° | 179.9° |
| C30 | C35 | C34 | C33 | 0.2° | 0.0° |
| C35 | C30 | C31 | H33 | 178.9° | 180.0° |
| C30 | C35 | C34 | H35 | 179.8° | 180.0° |
| C32 | C33 | C34 | C35 | 0.1° | 0.0° |
| C32 | C33 | C34 | C36 | 179.3° | 180.0° |
| C32 | C33 | C36 | C37 | 29.5° | 179.9° |
| C32 | C33 | C36 | C40 | 148.0° | 0.1° |
| C33 | C32 | C31 | H33 | 178.7° | 180.0° |
| C32 | C33 | C34 | H35 | 179.9° | 180.0° |
| C03 | C04 | C05 | C06 | 0.5° | 0.0° |
| C03 | C04 | C05 | C07 | 179.3° | 179.9° |
| C03 | C04 | C07 | C08 | 30.0° | 179.6° |
| C03 | C04 | C07 | C11 | 150.8° | 0.0° |
| C04 | C03 | C02 | H16 | 179.9° | 180.0° |
| C03 | C04 | C05 | H18 | 179.5° | 180.0° |
| O08 | C43 | C44 | C49 | 66.1° | 94.5° |
| O08 | C43 | C44 | C41 | 175.3° | 180.0° |
| O08 | C43 | C44 | C45 | 115.5° | 85.2° |
| O08 | C43 | C41 | C38 | 15.5° | 5.1° |
| O08 | C43 | C41 | C42 | 163.2° | 175.0° |
| F03 | C49 | C48 | N | 0.1° | 0.0° |
| F03 | C49 | C48 | C44 | 179.6° | 179.7° |
| F03 | C49 | C44 | C43 | 1.1° | 0.0° |
| F03 | C49 | C48 | C47 | 179.9° | 179.7° |
| F03 | C49 | C44 | C45 | 179.5° | 179.7° |
| O | S | O09 | N | 113.3° | 116.7° |
| O | S | O09 | C50 | 119.3° | 131.5° |
| O | S | N | C48 | 62.2° | 56.7° |
| O | S | N | C50 | 119.2° | 116.1° |
| O | S | C50 | C51 | 163.1° | 68.3° |
| O | S | N | H15 | 59.5° | 123.4° |
| O | S | C50 | H42 | 76.1° | 171.7° |
| O | S | C50 | H43 | 42.4° | 51.7° |
| O09 | S | N | C48 | 172.8° | 175.5° |
| O09 | S | N | C50 | 130.2° | 116.1° |
| O09 | S | C50 | C51 | 45.9° | 68.3° |
| O09 | S | N | H15 | 51.2° | 4.4° |
| O09 | S | C50 | H42 | 166.6° | 51.6° |
| O09 | S | C50 | H43 | 74.8° | 171.6° |
| C06 | C05 | C04 | H18 | 180.0° | 180.0° |
| C06 | C05 | C04 | C07 | 179.8° | 179.9° |
| C35 | C34 | C33 | H35 | 180.0° | 180.0° |
| C35 | C34 | C33 | C36 | 179.4° | 180.0° |
| O01 | C14 | C15 | C12 | 178.7° | 180.0° |
| O01 | C14 | C15 | C20 | 71.7° | 84.9° |
| O01 | C14 | C15 | C16 | 108.8° | 94.8° |
| O01 | C14 | C12 | C09 | 11.1° | 5.2° |
| O01 | C14 | C12 | C13 | 169.2° | 174.9° |
| C48 | N | S | H15 | 121.6° | 179.9° |
| N | C48 | C49 | C47 | 179.9° | 179.7° |
| N | C48 | C49 | C44 | 179.5° | 179.7° |
| C48 | N | S | C50 | 57.0° | 59.4° |
| N | C48 | C47 | C46 | 179.4° | 180.0° |
| N | C48 | C47 | H41 | 0.6° | 0.0° |
| S | N | C48 | C49 | 172.1° | 144.1° |
| S | N | C48 | C47 | 7.9° | 35.6° |
| N | S | C50 | C51 | 77.8° | 180.0° |
| N | S | C50 | H42 | 42.9° | 60.0° |
| N | S | C50 | H43 | 161.4° | 60.0° |
| C48 | C49 | C44 | C43 | 178.6° | 179.7° |
| C48 | C49 | C44 | C45 | 0.2° | 0.5° |
| C49 | C48 | C47 | C46 | 0.5° | 0.3° |
| C49 | C48 | N | H15 | 66.3° | 35.8° |
| C49 | C48 | C47 | H41 | 179.5° | 179.7° |
| C49 | C44 | C43 | C45 | 178.4° | 179.8° |
| C49 | C44 | C43 | C41 | 109.1° | 85.5° |
| C44 | C49 | C48 | C47 | 0.4° | 0.6° |
| C49 | C44 | C45 | C46 | 0.7° | 0.2° |
| C49 | C44 | C45 | F | 180.0° | 179.7° |
| C34 | C33 | C36 | C37 | 151.1° | 0.1° |
| C34 | C33 | C36 | C40 | 31.4° | 180.0° |
| C34 | C33 | C32 | H34 | 179.2° | 180.0° |
| C33 | C34 | C35 | H36 | 179.8° | 180.0° |
| C33 | C36 | C37 | C40 | 177.5° | 179.9° |
| C33 | C36 | C37 | C38 | 179.5° | 180.0° |
| C33 | C36 | C40 | N04 | 179.0° | 180.0° |
| C36 | C33 | C32 | H34 | 0.2° | 0.0° |
| C36 | C33 | C34 | H35 | 0.6° | 0.0° |
| C33 | C36 | C37 | H37 | 0.4° | 0.1° |
| C33 | C36 | C40 | H38 | 1.0° | 0.1° |
| C43 | C44 | C45 | C46 | 179.0° | 180.0° |
| C43 | C44 | C45 | F | 1.7° | 0.0° |
| C44 | C43 | C41 | C38 | 169.4° | 174.9° |
| C44 | C43 | C41 | C42 | 11.9° | 5.0° |
| C41 | C43 | C44 | C45 | 69.2° | 94.8° |
| C43 | C41 | C38 | C37 | 1.0° | 0.1° |
| C43 | C41 | C38 | C42 | 178.9° | 180.0° |
| C43 | C41 | C38 | C39 | 179.2° | 179.9° |
| C43 | C41 | C42 | N05 | 179.2° | 180.0° |
| C43 | C41 | C42 | H39 | 0.8° | 0.1° |
| F01 | C20 | C19 | N03 | 0.3° | 0.0° |
| F01 | C20 | C15 | C14 | 0.2° | 0.3° |
| F01 | C20 | C19 | C15 | 179.4° | 180.0° |
| F01 | C20 | C19 | C18 | 179.7° | 180.0° |
| F01 | C20 | C15 | C16 | 179.7° | 180.0° |
| C48 | C47 | C46 | H41 | 180.0° | 179.9° |
| C48 | C47 | C46 | C45 | 0.1° | 0.0° |
| C47 | C48 | N | H15 | 113.8° | 144.5° |
| C48 | C47 | C46 | H40 | 180.0° | 180.0° |
| S | C50 | C51 | H42 | 120.7° | 120.0° |
| S | C50 | C51 | H43 | 120.7° | 120.0° |
| S | C50 | C51 | C | 168.2° | 180.0° |
| C50 | S | N | H15 | 178.6° | 120.5° |
| S | C50 | H42 | H43 | 117.7° | 120.0° |
| S | C50 | C51 | H44 | 48.3° | 59.9° |
| S | C50 | C51 | H45 | 71.9° | 60.0° |
| C05 | C04 | C07 | C08 | 150.7° | 0.5° |
| C05 | C04 | C07 | C11 | 28.5° | 180.0° |
| C05 | C04 | C03 | H17 | 179.5° | 180.0° |
| C04 | C05 | C06 | H19 | 180.0° | 180.0° |
| C04 | C07 | C08 | C11 | 179.2° | 179.6° |
| C04 | C07 | C08 | C09 | 179.9° | 179.8° |
| C04 | C07 | C11 | N01 | 179.9° | 180.0° |
| C07 | C04 | C03 | H17 | 0.2° | 0.1° |
| C07 | C04 | C05 | H18 | 0.2° | 0.0° |
| C04 | C07 | C08 | H20 | 0.1° | 0.0° |
| C04 | C07 | C11 | H21 | 0.1° | 0.5° |
| C44 | C45 | C46 | C47 | 0.5° | 0.0° |
| C44 | C45 | C46 | F | 179.3° | 180.0° |
| C44 | C45 | C46 | H40 | 179.5° | 179.9° |
| C36 | C37 | C38 | H37 | 180.0° | 179.9° |
| C36 | C37 | C38 | C41 | 178.5° | 180.0° |
| C36 | C37 | C38 | C39 | 1.4° | 0.0° |
| C37 | C36 | C40 | N04 | 1.5° | 0.1° |
| C37 | C36 | C40 | H38 | 178.5° | 180.0° |
| C38 | C37 | C36 | C40 | 2.1° | 0.1° |
| C37 | C38 | C41 | C39 | 179.9° | 180.0° |
| C37 | C38 | C41 | C42 | 179.9° | 180.0° |
| C37 | C38 | C39 | N04 | 0.1° | 0.0° |
| C37 | C38 | C39 | N05 | 179.9° | 180.0° |
| O03 | S01 | N03 | C19 | 176.3° | 175.9° |
| O03 | S01 | N03 | O02 | 114.9° | 127.8° |
| O03 | S01 | N03 | C21 | 127.7° | 116.1° |
| O03 | S01 | O02 | C21 | 121.9° | 131.5° |
| O03 | S01 | C21 | C22 | 50.8° | 68.4° |
| O03 | S01 | C21 | H3 | 171.1° | 51.6° |
| O03 | S01 | C21 | H4 | 69.6° | 171.6° |
| O03 | S01 | N03 | H13 | 54.7° | 4.1° |
| C47 | C46 | C45 | H40 | 180.0° | 180.0° |
| C47 | C46 | C45 | F | 179.9° | 180.0° |
| C07 | C08 | C09 | H20 | 180.0° | 179.8° |
| C07 | C08 | C09 | C12 | 179.7° | 179.6° |
| C07 | C08 | C09 | C10 | 0.2° | 0.4° |
| C08 | C07 | C11 | N01 | 1.0° | 0.4° |
| C08 | C07 | C11 | H21 | 179.0° | 180.0° |
| C08 | C09 | C12 | C14 | 0.2° | 0.0° |
| C09 | C08 | C07 | C11 | 0.7° | 0.6° |
| C08 | C09 | C12 | C10 | 179.6° | 180.0° |
| C08 | C09 | C12 | C13 | 180.0° | 179.9° |
| C08 | C09 | C10 | N01 | 0.8° | 0.0° |
| C08 | C09 | C10 | N02 | 179.4° | 179.8° |
| C45 | C46 | C47 | H41 | 179.9° | 179.9° |
| F | C45 | C46 | H40 | 0.1° | 0.0° |
| C19 | N03 | S01 | H13 | 121.6° | 179.9° |
| N03 | C19 | C20 | C18 | 179.4° | 180.0° |
| N03 | C19 | C20 | C15 | 179.7° | 179.9° |
| C19 | N03 | S01 | O02 | 61.4° | 56.3° |
| C19 | N03 | S01 | C21 | 56.0° | 59.8° |
| N03 | C19 | C18 | C17 | 179.7° | 180.0° |
| N03 | C19 | C18 | H23 | 0.3° | 0.1° |
| S01 | N03 | C19 | C20 | 171.9° | 149.5° |
| N03 | S01 | O02 | C21 | 125.9° | 111.8° |
| S01 | N03 | C19 | C18 | 8.8° | 30.5° |
| N03 | S01 | C21 | C22 | 72.3° | 180.0° |
| N03 | S01 | C21 | H3 | 48.1° | 60.0° |
| N03 | S01 | C21 | H4 | 167.4° | 60.0° |
| C14 | C15 | C20 | C19 | 179.2° | 179.7° |
| C14 | C15 | C20 | C16 | 179.5° | 179.7° |
| C15 | C14 | C12 | C09 | 170.2° | 174.8° |
| C15 | C14 | C12 | C13 | 9.5° | 5.1° |
| C14 | C15 | C16 | F02 | 1.3° | 0.3° |
| C14 | C15 | C16 | C17 | 179.8° | 179.7° |
| C12 | C14 | C15 | C20 | 107.0° | 95.2° |
| C12 | C14 | C15 | C16 | 72.5° | 85.2° |
| C14 | C12 | C09 | C13 | 179.8° | 179.9° |
| C14 | C12 | C09 | C10 | 179.8° | 180.0° |
| C14 | C12 | C13 | N02 | 179.6° | 179.9° |
| C14 | C12 | C13 | H1 | 0.4° | 0.0° |
| C19 | C20 | C15 | C16 | 0.3° | 0.1° |
| C20 | C19 | C18 | C17 | 0.9° | 0.0° |
| C20 | C19 | N03 | H13 | 66.5° | 30.4° |
| C20 | C19 | C18 | H23 | 179.1° | 180.0° |
| C15 | C20 | C19 | C18 | 1.0° | 0.0° |
| C20 | C15 | C16 | F02 | 179.2° | 180.0° |
| C20 | C15 | C16 | C17 | 0.3° | 0.0° |
| C36 | C40 | N04 | H38 | 180.0° | 179.9° |
| C36 | C40 | N04 | C39 | 0.1° | 0.0° |
| C40 | C36 | C37 | H37 | 177.9° | 180.0° |
| O02 | S01 | C21 | C22 | 169.0° | 68.4° |
| O02 | S01 | C21 | H3 | 70.7° | 171.6° |
| O02 | S01 | C21 | H4 | 48.6° | 51.6° |
| O02 | S01 | N03 | H13 | 60.2° | 123.8° |
| C07 | C11 | N01 | H21 | 180.0° | 179.5° |
| C07 | C11 | N01 | C10 | 0.3° | 0.0° |
| C11 | C07 | C08 | H20 | 179.3° | 179.6° |
| C38 | C41 | C42 | N05 | 0.2° | 0.0° |
| C41 | C38 | C39 | N04 | 179.8° | 180.0° |
| C41 | C38 | C39 | N05 | 0.2° | 0.0° |
| C41 | C38 | C37 | H37 | 1.5° | 0.0° |
| C38 | C41 | C42 | H39 | 179.8° | 180.0° |
| C42 | C41 | C38 | C39 | 0.3° | 0.0° |
| C41 | C42 | N05 | H39 | 180.0° | 180.0° |
| C41 | C42 | N05 | C39 | 0.1° | 0.0° |
| C41 | C42 | N05 | H14 | 179.9° | 179.9° |
| C19 | C18 | C17 | H23 | 180.0° | 179.9° |
| C19 | C18 | C17 | C16 | 0.3° | 0.0° |
| C19 | C18 | C17 | H2 | 179.7° | 180.0° |
| C18 | C19 | N03 | H13 | 112.8° | 149.5° |
| C15 | C16 | C17 | C18 | 0.3° | 0.0° |
| C15 | C16 | F02 | C17 | 178.8° | 180.0° |
| C15 | C16 | C17 | H2 | 179.7° | 179.9° |
| C38 | C39 | N04 | C40 | 0.6° | 0.0° |
| C38 | C39 | N05 | C42 | 0.0° | 0.0° |
| C38 | C39 | N04 | N05 | 180.0° | 179.9° |
| C38 | C39 | N05 | H14 | 179.9° | 179.9° |
| C39 | C38 | C37 | H37 | 178.6° | 180.0° |
| S01 | C21 | C22 | H3 | 120.4° | 120.0° |
| S01 | C21 | C22 | H4 | 120.4° | 120.0° |
| S01 | C21 | C22 | C23 | 174.9° | 180.0° |
| S01 | C21 | H3 | H4 | 118.9° | 120.0° |
| S01 | C21 | C22 | H5 | 65.2° | 60.0° |
| S01 | C21 | C22 | H6 | 54.9° | 60.0° |
| C21 | S01 | N03 | H13 | 177.6° | 120.1° |
| C12 | C09 | C10 | N01 | 179.5° | 180.0° |
| C12 | C09 | C10 | N02 | 0.9° | 0.2° |
| C09 | C12 | C13 | N02 | 0.1° | 0.0° |
| C09 | C12 | C13 | H1 | 179.9° | 179.9° |
| C12 | C09 | C08 | H20 | 0.3° | 0.3° |
| C10 | C09 | C12 | C13 | 0.5° | 0.1° |
| C09 | C10 | N01 | C11 | 0.6° | 0.3° |
| C09 | C10 | N01 | N02 | 178.4° | 179.7° |
| C09 | C10 | N02 | C13 | 1.1° | 0.2° |
| C10 | C09 | C08 | H20 | 179.8° | 179.8° |
| C09 | C10 | N02 | H49 | 179.0° | 179.8° |
| C50 | C51 | C | H44 | 119.9° | 120.0° |
| C50 | C51 | C | H45 | 119.9° | 120.0° |
| C51 | C50 | H42 | H43 | 117.7° | 120.0° |
| C50 | C51 | H44 | H45 | 120.3° | 119.9° |
| C50 | C51 | C | H46 | 180.0° | 60.0° |
| C50 | C51 | C | H47 | 60.0° | 60.0° |
| C50 | C51 | C | H48 | 60.0° | 180.0° |
| C12 | C13 | N02 | C10 | 0.7° | 0.2° |
| C12 | C13 | N02 | H1 | 180.0° | 179.9° |
| C12 | C13 | N02 | H49 | 179.3° | 179.8° |
| C18 | C17 | C16 | F02 | 179.1° | 180.0° |
| C18 | C17 | C16 | H2 | 180.0° | 179.9° |
| F02 | C16 | C17 | H2 | 0.9° | 0.0° |
| C16 | C17 | C18 | H23 | 179.7° | 180.0° |
| C40 | N04 | C39 | N05 | 179.4° | 179.9° |
| C11 | N01 | C10 | N02 | 178.9° | 180.0° |
| C42 | N05 | C39 | N04 | 179.9° | 180.0° |
| C42 | N05 | C39 | H14 | 180.0° | 179.9° |
| N04 | C39 | N05 | H14 | 0.1° | 0.0° |
| C39 | N04 | C40 | H38 | 179.9° | 179.9° |
| C39 | N05 | C42 | H39 | 179.9° | 180.0° |
| C | C51 | C50 | H42 | 71.1° | 60.0° |
| C | C51 | C50 | H43 | 47.5° | 60.0° |
| C | C51 | H44 | H45 | 120.3° | 120.1° |
| C51 | C | H46 | H47 | 120.0° | 120.1° |
| C51 | C | H46 | H48 | 120.0° | 120.0° |
| C51 | C | H47 | H48 | 120.0° | 120.0° |
| N01 | C10 | N02 | C13 | 179.6° | 180.0° |
| C10 | N01 | C11 | H21 | 179.7° | 179.5° |
| N01 | C10 | N02 | H49 | 0.5° | 0.0° |
| C10 | N02 | C13 | H49 | 180.0° | 180.0° |
| C10 | N02 | C13 | H1 | 179.3° | 180.0° |
| C21 | C22 | C23 | H5 | 120.0° | 120.1° |
| C21 | C22 | C23 | H6 | 119.9° | 120.0° |
| C22 | C21 | H3 | H4 | 118.8° | 119.9° |
| C21 | C22 | H5 | H6 | 120.1° | 120.0° |
| C21 | C22 | C23 | H24 | 180.0° | 60.0° |
| C21 | C22 | C23 | H25 | 60.0° | 60.0° |
| C21 | C22 | C23 | H26 | 60.0° | 180.0° |
| C23 | C22 | C21 | H3 | 54.5° | 60.0° |
| C23 | C22 | C21 | H4 | 64.7° | 59.9° |
| C23 | C22 | H5 | H6 | 120.1° | 120.0° |
| C22 | C23 | H24 | H25 | 120.0° | 119.9° |
| C22 | C23 | H24 | H26 | 120.0° | 120.0° |
| C22 | C23 | H25 | H26 | 120.0° | 120.0° |
| H1 | C13 | N02 | H49 | 0.7° | 0.0° |
| H2 | C17 | C18 | H23 | 0.3° | 0.1° |
| H3 | C21 | C22 | H5 | 174.5° | 60.1° |
| H3 | C21 | C22 | H6 | 65.5° | 180.0° |
| H4 | C21 | C22 | H5 | 55.2° | 180.0° |
| H4 | C21 | C22 | H6 | 175.3° | 60.1° |
| H5 | C22 | C23 | H24 | 60.1° | 180.0° |
| H5 | C22 | C23 | H25 | 180.0° | 60.0° |
| H5 | C22 | C23 | H26 | 60.0° | 60.0° |
| H6 | C22 | C23 | H24 | 60.0° | 60.0° |
| H6 | C22 | C23 | H25 | 59.9° | 180.0° |
| H6 | C22 | C23 | H26 | 179.9° | 60.0° |
| H7 | C24 | C25 | H27 | 157.5° | 55.1° |
| H7 | C24 | C25 | H28 | 37.3° | 65.0° |
| H8 | C24 | C25 | H27 | 81.8° | 65.0° |
| H8 | C24 | C25 | H28 | 158.0° | 174.9° |
| H9 | C26 | C27 | H29 | 111.3° | 55.0° |
| H9 | C26 | C27 | H30 | 9.5° | 65.0° |
| H10 | C26 | C27 | H29 | 8.9° | 65.0° |
| H10 | C26 | C27 | H30 | 129.7° | 175.0° |
| H11 | C28 | C29 | H31 | 78.2° | 55.0° |
| H11 | C28 | C29 | H32 | 160.2° | 65.0° |
| H12 | C28 | C29 | H31 | 160.1° | 65.0° |
| H12 | C28 | C29 | H32 | 38.5° | 175.0° |
| H14 | N05 | C42 | H39 | 0.1° | 0.0° |
| H16 | C02 | C03 | H17 | 0.1° | 0.1° |
| H18 | C05 | C06 | H19 | 0.0° | 0.0° |
| H24 | C23 | H25 | H26 | 120.0° | 120.1° |
| H33 | C31 | C32 | H34 | 1.3° | 0.0° |
| H35 | C34 | C35 | H36 | 0.2° | 0.0° |
| H40 | C46 | C47 | H41 | 0.0° | 0.1° |
| H42 | C50 | C51 | H44 | 169.0° | 60.1° |
| H42 | C50 | C51 | H45 | 48.8° | 180.0° |
| H43 | C50 | C51 | H44 | 72.4° | 179.9° |
| H43 | C50 | C51 | H45 | 167.4° | 60.0° |
| H44 | C51 | C | H46 | 60.1° | 179.9° |
| H44 | C51 | C | H47 | 179.9° | 60.0° |
| H44 | C51 | C | H48 | 59.9° | 60.0° |
| H45 | C51 | C | H46 | 60.1° | 59.9° |
| H45 | C51 | C | H47 | 59.9° | 180.0° |
| H45 | C51 | C | H48 | 179.9° | 60.0° |
| H46 | C | H47 | H48 | 120.0° | 119.9° |
