BKR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C46 | C45 | sing | 1.52Å | 1.53Å | |
| C47 | C45 | sing | 1.53Å | 1.55Å | |
| O1 | C1 | sing | 1.40Å | 1.42Å | |
| C45 | C1 | sing | 1.47Å | 1.55Å | |
| C45 | C24 | sing | 1.51Å | 1.53Å | |
| C39 | C38 | doub | 1.38Å | 1.40Å | Aromatic |
| C39 | C40 | sing | 1.38Å | 1.40Å | Aromatic |
| C1 | C43 | sing | 1.59Å | 1.54Å | |
| C1 | C2 | sing | 1.60Å | 1.53Å | |
| C38 | C37 | sing | 1.38Å | 1.40Å | Aromatic |
| O9 | C21 | sing | 1.45Å | 1.44Å | |
| O12 | C27 | doub | 1.21Å | 1.21Å | |
| C40 | C41 | doub | 1.38Å | 1.40Å | Aromatic |
| C43 | C26 | sing | 1.48Å | 1.53Å | |
| C24 | C25 | doub | 1.35Å | 1.37Å | |
| C24 | C21 | sing | 1.57Å | 1.51Å | |
| C26 | C25 | sing | 1.54Å | 1.52Å | |
| C26 | O11 | sing | 1.49Å | 1.42Å | |
| O3 | C3 | doub | 1.22Å | 1.22Å | |
| C25 | C44 | sing | 1.52Å | 1.51Å | |
| C21 | C20 | sing | 1.49Å | 1.52Å | |
| O8 | C20 | doub | 1.30Å | 1.23Å | |
| C2 | O2 | sing | 1.42Å | 1.45Å | |
| C2 | C10 | sing | 1.59Å | 1.59Å | |
| C3 | O2 | sing | 1.35Å | 1.47Å | |
| C3 | C4 | sing | 1.48Å | 1.51Å | |
| C27 | O11 | sing | 1.34Å | 1.45Å | |
| C27 | C28 | sing | 1.51Å | 1.49Å | |
| C37 | C29 | sing | 1.51Å | 1.48Å | |
| C37 | C42 | doub | 1.38Å | 1.40Å | Aromatic |
| C9 | C4 | doub | 1.40Å | 1.40Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C18 | sing | 1.48Å | 1.53Å | |
| C41 | C42 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | C28 | sing | 1.53Å | 1.53Å | |
| C29 | N1 | sing | 1.46Å | 1.45Å | |
| C4 | C5 | sing | 1.40Å | 1.41Å | Aromatic |
| O14 | C30 | doub | 1.22Å | 1.23Å | |
| C8 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
| C28 | O13 | sing | 1.43Å | 1.43Å | |
| C10 | C18 | sing | 1.41Å | 1.58Å | |
| C10 | C11 | sing | 1.49Å | 1.57Å | |
| C19 | C18 | sing | 1.61Å | 1.55Å | |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| C30 | N1 | sing | 1.35Å | 1.34Å | |
| C30 | C31 | sing | 1.48Å | 1.50Å | |
| C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C14 | sing | 1.55Å | 1.53Å | |
| C11 | O4 | sing | 1.50Å | 1.43Å | |
| C11 | C15 | sing | 1.56Å | 1.53Å | |
| C17 | O7 | sing | 1.39Å | 1.43Å | |
| C17 | C16 | sing | 1.54Å | 1.51Å | |
| C14 | O6 | sing | 1.38Å | 1.42Å | |
| O4 | C12 | sing | 1.34Å | 1.44Å | |
| C31 | C36 | doub | 1.40Å | 1.39Å | Aromatic |
| C31 | C32 | sing | 1.40Å | 1.40Å | Aromatic |
| C12 | O5 | doub | 1.21Å | 1.21Å | |
| C12 | C13 | sing | 1.51Å | 1.49Å | |
| C36 | C35 | sing | 1.38Å | 1.40Å | Aromatic |
| O6 | C15 | sing | 1.44Å | 1.42Å | |
| C15 | C16 | sing | 1.50Å | 1.52Å | |
| C32 | C33 | doub | 1.38Å | 1.40Å | Aromatic |
| C35 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
| C33 | C34 | sing | 1.38Å | 1.40Å | Aromatic |
| C36 | H1 | sing | 1.08Å | 1.08Å | |
| C35 | H2 | sing | 1.08Å | 1.08Å | |
| C34 | H3 | sing | 1.08Å | 1.08Å | |
| C33 | H4 | sing | 1.08Å | 1.08Å | |
| C32 | H5 | sing | 1.08Å | 1.08Å | |
| N1 | H6 | sing | 0.97Å | 1.00Å | |
| C29 | H7 | sing | 1.09Å | 1.10Å | |
| C42 | H8 | sing | 1.08Å | 1.08Å | |
| C41 | H9 | sing | 1.08Å | 1.08Å | |
| C40 | H10 | sing | 1.08Å | 1.08Å | |
| C39 | H11 | sing | 1.08Å | 1.08Å | |
| C38 | H12 | sing | 1.08Å | 1.08Å | |
| C28 | H13 | sing | 1.09Å | 1.10Å | |
| O13 | H14 | sing | 0.97Å | 0.95Å | |
| C26 | H15 | sing | 1.04Å | 1.10Å | |
| C43 | H16 | sing | 1.07Å | 1.10Å | |
| C43 | H17 | sing | 1.05Å | 1.10Å | |
| C44 | H19 | sing | 1.09Å | 1.10Å | |
| C44 | H20 | sing | 1.09Å | 1.10Å | |
| C44 | H21 | sing | 1.09Å | 1.10Å | |
| C47 | H23 | sing | 1.09Å | 1.10Å | |
| C47 | H24 | sing | 1.09Å | 1.10Å | |
| C47 | H25 | sing | 1.09Å | 1.10Å | |
| C46 | H26 | sing | 1.09Å | 1.10Å | |
| C46 | H27 | sing | 1.09Å | 1.10Å | |
| C46 | H28 | sing | 1.09Å | 1.10Å | |
| O1 | H29 | sing | 0.97Å | 0.95Å | |
| C21 | H30 | sing | 1.08Å | 1.10Å | |
| O9 | H31 | sing | 0.97Å | 0.95Å | |
| C19 | H32 | sing | 1.09Å | 1.10Å | |
| C19 | H33 | sing | 1.09Å | 1.10Å | |
| C19 | H34 | sing | 1.09Å | 1.10Å | |
| C17 | H35 | sing | 1.11Å | 1.10Å | |
| O7 | H36 | sing | 0.97Å | 0.95Å | |
| C16 | H37 | sing | 1.08Å | 1.10Å | |
| C16 | H38 | sing | 1.11Å | 1.10Å | |
| C15 | H39 | sing | 1.03Å | 1.10Å | |
| C14 | H40 | sing | 1.09Å | 1.10Å | |
| C14 | H41 | sing | 1.02Å | 1.10Å | |
| C13 | H42 | sing | 1.09Å | 1.10Å | |
| C13 | H43 | sing | 1.09Å | 1.10Å | |
| C13 | H44 | sing | 1.09Å | 1.10Å | |
| C10 | H45 | sing | 1.12Å | 1.10Å | |
| C2 | H46 | sing | 1.09Å | 1.10Å | |
| C9 | H47 | sing | 1.08Å | 1.08Å | |
| C8 | H48 | sing | 1.08Å | 1.08Å | |
| C7 | H49 | sing | 1.08Å | 1.08Å | |
| C6 | H50 | sing | 1.08Å | 1.08Å | |
| C5 | H51 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C46 | C45 | C47 | 99.7° | 107.0° |
| C46 | C45 | C1 | 115.3° | 111.0° |
| C46 | C45 | C24 | 108.3° | 107.4° |
| C45 | C46 | H26 | 109.5° | 109.5° |
| C45 | C46 | H27 | 109.4° | 109.5° |
| C45 | C46 | H28 | 109.5° | 109.5° |
| C47 | C45 | C1 | 112.6° | 108.9° |
| C47 | C45 | C24 | 117.7° | 114.1° |
| C45 | C47 | H23 | 109.5° | 109.5° |
| C45 | C47 | H24 | 109.5° | 109.5° |
| C45 | C47 | H25 | 109.5° | 109.5° |
| O1 | C1 | C45 | 105.2° | 106.4° |
| O1 | C1 | C43 | 105.5° | 106.4° |
| O1 | C1 | C2 | 105.3° | 107.7° |
| C1 | O1 | H29 | 109.5° | 114.0° |
| C1 | C45 | C24 | 103.6° | 108.4° |
| C45 | C1 | C43 | 113.1° | 111.4° |
| C45 | C1 | C2 | 116.7° | 115.0° |
| C45 | C24 | C25 | 119.4° | 117.8° |
| C45 | C24 | C21 | 121.5° | 126.9° |
| C38 | C39 | C40 | 119.6° | 120.0° |
| C39 | C38 | C37 | 120.4° | 120.0° |
| C38 | C39 | H11 | 120.2° | 120.0° |
| C39 | C38 | H12 | 119.8° | 120.0° |
| C39 | C40 | C41 | 120.0° | 120.0° |
| C39 | C40 | H10 | 120.0° | 120.0° |
| C40 | C39 | H11 | 120.2° | 120.1° |
| C43 | C1 | C2 | 110.0° | 109.5° |
| C1 | C43 | C26 | 116.8° | 112.8° |
| C1 | C43 | H16 | 107.6° | 103.4° |
| C1 | C43 | H17 | 107.6° | 108.3° |
| C1 | C2 | O2 | 96.8° | 106.1° |
| C1 | C2 | C10 | 120.3° | 111.4° |
| C1 | C2 | H46 | 108.7° | 109.3° |
| C38 | C37 | C29 | 119.6° | 120.0° |
| C38 | C37 | C42 | 119.9° | 120.0° |
| C37 | C38 | H12 | 119.8° | 120.0° |
| O9 | C21 | C24 | 107.6° | 112.0° |
| O9 | C21 | C20 | 113.8° | 109.9° |
| O9 | C21 | H30 | 107.9° | 111.0° |
| C21 | O9 | H31 | 109.5° | 114.0° |
| O12 | C27 | O11 | 122.5° | 120.0° |
| O12 | C27 | C28 | 118.7° | 120.0° |
| C40 | C41 | C42 | 120.2° | 120.0° |
| C40 | C41 | H9 | 119.9° | 120.0° |
| C41 | C40 | H10 | 120.0° | 120.0° |
| C43 | C26 | C25 | 114.4° | 110.9° |
| C43 | C26 | O11 | 107.4° | 105.8° |
| C43 | C26 | H15 | 107.9° | 120.0° |
| C26 | C43 | H16 | 107.6° | 108.8° |
| C26 | C43 | H17 | 107.6° | 117.4° |
| C25 | C24 | C21 | 119.0° | 114.7° |
| C24 | C25 | C26 | 119.6° | 115.0° |
| C24 | C25 | C44 | 123.1° | 122.3° |
| C24 | C21 | C20 | 113.2° | 106.4° |
| C24 | C21 | H30 | 107.1° | 105.6° |
| C25 | C26 | O11 | 109.8° | 105.0° |
| C26 | C25 | C44 | 117.2° | 122.2° |
| C25 | C26 | H15 | 108.0° | 110.3° |
| C26 | O11 | C27 | 117.0° | 117.0° |
| O11 | C26 | H15 | 109.3° | 103.3° |
| O3 | C3 | O2 | 119.9° | 120.0° |
| O3 | C3 | C4 | 120.1° | 120.0° |
| C25 | C44 | H19 | 109.5° | 109.5° |
| C25 | C44 | H20 | 109.4° | 109.5° |
| C25 | C44 | H21 | 109.5° | 109.5° |
| C21 | C20 | O8 | 118.7° | 115.8° |
| C21 | C20 | C18 | 123.8° | 123.7° |
| C20 | C21 | H30 | 106.9° | 111.8° |
| O8 | C20 | C18 | 117.4° | 120.2° |
| O2 | C2 | C10 | 112.6° | 109.7° |
| C2 | O2 | C3 | 123.9° | 116.9° |
| O2 | C2 | H46 | 109.9° | 105.3° |
| C2 | C10 | C18 | 120.1° | 118.7° |
| C2 | C10 | C11 | 112.0° | 109.5° |
| C2 | C10 | H45 | 104.3° | 102.6° |
| C10 | C2 | H46 | 108.0° | 114.6° |
| O2 | C3 | C4 | 120.0° | 120.0° |
| C3 | C4 | C9 | 119.6° | 120.2° |
| C3 | C4 | C5 | 121.8° | 120.1° |
| O11 | C27 | C28 | 118.8° | 120.0° |
| C27 | C28 | C29 | 111.7° | 109.5° |
| C27 | C28 | O13 | 107.1° | 109.5° |
| C27 | C28 | H13 | 108.9° | 109.5° |
| C29 | C37 | C42 | 120.5° | 120.0° |
| C37 | C29 | C28 | 112.0° | 109.5° |
| C37 | C29 | N1 | 109.7° | 109.5° |
| C37 | C29 | H7 | 108.9° | 109.4° |
| C37 | C42 | C41 | 119.8° | 120.0° |
| C37 | C42 | H8 | 120.1° | 120.0° |
| C4 | C9 | C8 | 120.9° | 119.9° |
| C9 | C4 | C5 | 118.5° | 119.7° |
| C4 | C9 | H47 | 119.6° | 120.1° |
| C9 | C8 | C7 | 119.7° | 120.1° |
| C8 | C9 | H47 | 119.5° | 120.1° |
| C9 | C8 | H48 | 120.2° | 119.9° |
| C20 | C18 | C10 | 115.7° | 120.4° |
| C20 | C18 | C19 | 104.2° | 103.4° |
| C20 | C18 | C17 | 100.8° | 108.2° |
| C41 | C42 | H8 | 120.1° | 120.0° |
| C42 | C41 | H9 | 119.9° | 120.0° |
| C28 | C29 | N1 | 108.6° | 109.5° |
| C29 | C28 | O13 | 111.0° | 109.4° |
| C28 | C29 | H7 | 108.3° | 109.4° |
| C29 | C28 | H13 | 108.4° | 109.4° |
| C29 | N1 | C30 | 123.8° | 120.0° |
| C29 | N1 | H6 | 118.1° | 120.0° |
| N1 | C29 | H7 | 109.3° | 109.5° |
| C4 | C5 | C6 | 120.9° | 119.8° |
| C4 | C5 | H51 | 119.5° | 120.1° |
| O14 | C30 | N1 | 123.7° | 120.0° |
| O14 | C30 | C31 | 120.5° | 120.0° |
| C8 | C7 | C6 | 119.9° | 120.3° |
| C7 | C8 | H48 | 120.2° | 120.0° |
| C8 | C7 | H49 | 120.1° | 119.8° |
| O13 | C28 | H13 | 109.7° | 109.5° |
| C28 | O13 | H14 | 109.5° | 114.0° |
| C18 | C10 | C11 | 110.0° | 120.5° |
| C10 | C18 | C19 | 116.4° | 111.1° |
| C10 | C18 | C17 | 107.5° | 112.9° |
| C18 | C10 | H45 | 104.4° | 102.0° |
| C10 | C11 | C14 | 115.7° | 112.2° |
| C10 | C11 | O4 | 112.5° | 112.7° |
| C10 | C11 | C15 | 120.8° | 121.0° |
| C11 | C10 | H45 | 104.5° | 99.1° |
| C19 | C18 | C17 | 111.2° | 98.3° |
| C18 | C19 | H32 | 109.5° | 109.4° |
| C18 | C19 | H33 | 109.5° | 109.5° |
| C18 | C19 | H34 | 109.5° | 109.5° |
| C18 | C17 | O7 | 111.7° | 113.2° |
| C18 | C17 | C16 | 113.6° | 108.7° |
| C18 | C17 | H35 | 107.9° | 108.1° |
| N1 | C30 | C31 | 115.7° | 120.0° |
| C30 | N1 | H6 | 118.1° | 120.0° |
| C30 | C31 | C36 | 120.5° | 120.1° |
| C30 | C31 | C32 | 119.4° | 120.1° |
| C5 | C6 | C7 | 120.1° | 120.2° |
| C5 | C6 | H50 | 119.9° | 119.9° |
| C6 | C5 | H51 | 119.5° | 120.1° |
| C6 | C7 | H49 | 120.0° | 119.9° |
| C7 | C6 | H50 | 120.0° | 119.9° |
| C14 | C11 | O4 | 109.0° | 111.3° |
| C14 | C11 | C15 | 86.3° | 84.2° |
| C11 | C14 | O6 | 89.5° | 91.8° |
| C11 | C14 | H40 | 114.2° | 111.7° |
| C11 | C14 | H41 | 114.2° | 115.8° |
| O4 | C11 | C15 | 109.7° | 112.1° |
| C11 | O4 | C12 | 122.3° | 117.0° |
| C11 | C15 | O6 | 89.5° | 89.0° |
| C11 | C15 | C16 | 120.7° | 111.5° |
| C11 | C15 | H39 | 110.3° | 109.7° |
| O7 | C17 | C16 | 106.0° | 111.1° |
| O7 | C17 | H35 | 109.3° | 106.0° |
| C17 | O7 | H36 | 109.5° | 114.0° |
| C17 | C16 | C15 | 112.1° | 110.1° |
| C16 | C17 | H35 | 108.3° | 109.7° |
| C17 | C16 | H37 | 108.8° | 112.7° |
| C17 | C16 | H38 | 108.8° | 108.0° |
| C14 | O6 | C15 | 94.5° | 94.9° |
| O6 | C14 | H40 | 114.2° | 109.4° |
| O6 | C14 | H41 | 114.2° | 114.4° |
| O4 | C12 | O5 | 118.9° | 120.0° |
| O4 | C12 | C13 | 117.5° | 120.0° |
| C36 | C31 | C32 | 120.2° | 119.7° |
| C31 | C36 | C35 | 120.1° | 119.8° |
| C31 | C36 | H1 | 120.0° | 120.1° |
| C31 | C32 | C33 | 120.0° | 119.8° |
| C31 | C32 | H5 | 120.0° | 120.1° |
| O5 | C12 | C13 | 123.7° | 120.0° |
| C12 | C13 | H42 | 109.5° | 109.5° |
| C12 | C13 | H43 | 109.5° | 109.5° |
| C12 | C13 | H44 | 109.5° | 109.5° |
| C36 | C35 | C34 | 119.9° | 120.1° |
| C35 | C36 | H1 | 119.9° | 120.1° |
| C36 | C35 | H2 | 120.1° | 119.9° |
| O6 | C15 | C16 | 112.4° | 116.3° |
| O6 | C15 | H39 | 111.9° | 116.8° |
| C15 | C16 | H37 | 108.8° | 110.1° |
| C15 | C16 | H38 | 108.8° | 107.1° |
| C16 | C15 | H39 | 110.5° | 111.3° |
| C32 | C33 | C34 | 119.9° | 120.2° |
| C32 | C33 | H4 | 120.1° | 119.9° |
| C33 | C32 | H5 | 120.0° | 120.1° |
| C35 | C34 | C33 | 120.0° | 120.3° |
| C34 | C35 | H2 | 120.0° | 120.0° |
| C35 | C34 | H3 | 120.0° | 119.8° |
| C33 | C34 | H3 | 120.0° | 119.8° |
| C34 | C33 | H4 | 120.1° | 120.0° |
| H16 | C43 | H17 | 109.4° | 104.9° |
| H19 | C44 | H20 | 109.5° | 109.4° |
| H19 | C44 | H21 | 109.5° | 109.4° |
| H20 | C44 | H21 | 109.5° | 109.5° |
| H23 | C47 | H24 | 109.4° | 109.5° |
| H23 | C47 | H25 | 109.4° | 109.5° |
| H24 | C47 | H25 | 109.5° | 109.5° |
| H26 | C46 | H27 | 109.5° | 109.4° |
| H26 | C46 | H28 | 109.4° | 109.5° |
| H27 | C46 | H28 | 109.5° | 109.5° |
| H32 | C19 | H33 | 109.5° | 109.5° |
| H32 | C19 | H34 | 109.5° | 109.5° |
| H33 | C19 | H34 | 109.5° | 109.5° |
| H37 | C16 | H38 | 109.5° | 108.7° |
| H40 | C14 | H41 | 109.5° | 112.1° |
| H42 | C13 | H43 | 109.4° | 109.4° |
| H42 | C13 | H44 | 109.5° | 109.4° |
| H43 | C13 | H44 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C46 | C45 | C47 | C1 | 122.8° | 120.1° |
| C46 | C45 | C47 | C24 | 116.7° | 118.7° |
| C46 | C45 | C1 | O1 | 53.8° | 54.1° |
| C46 | C45 | C1 | C24 | 118.2° | 117.8° |
| C46 | C45 | C1 | C43 | 60.8° | 61.4° |
| C46 | C45 | C1 | C2 | 170.1° | 173.2° |
| C46 | C45 | C24 | C25 | 66.0° | 70.0° |
| C46 | C45 | C24 | C21 | 118.0° | 118.6° |
| C46 | C45 | C47 | H23 | 180.0° | 166.5° |
| C46 | C45 | C47 | H24 | 60.0° | 73.5° |
| C46 | C45 | C47 | H25 | 60.0° | 46.5° |
| C45 | C46 | H26 | H27 | 120.0° | 120.0° |
| C45 | C46 | H26 | H28 | 120.0° | 120.0° |
| C45 | C46 | H27 | H28 | 120.0° | 120.0° |
| C47 | C45 | C1 | O1 | 59.7° | 63.4° |
| C47 | C45 | C1 | C24 | 128.3° | 124.7° |
| C47 | C45 | C1 | C43 | 174.3° | 179.0° |
| C47 | C45 | C1 | C2 | 56.6° | 55.7° |
| C47 | C45 | C24 | C25 | 177.9° | 171.6° |
| C47 | C45 | C24 | C21 | 6.0° | 0.2° |
| C45 | C47 | H23 | H24 | 120.0° | 120.0° |
| C45 | C47 | H23 | H25 | 120.0° | 120.0° |
| C45 | C47 | H24 | H25 | 120.0° | 120.0° |
| C47 | C45 | C46 | H26 | 180.0° | 51.0° |
| C47 | C45 | C46 | H27 | 60.0° | 68.9° |
| C47 | C45 | C46 | H28 | 60.0° | 171.0° |
| O1 | C1 | C45 | C43 | 114.6° | 115.6° |
| O1 | C1 | C45 | C2 | 116.3° | 119.1° |
| O1 | C1 | C45 | C24 | 172.0° | 172.0° |
| O1 | C1 | C43 | C2 | 113.1° | 116.1° |
| O1 | C1 | C43 | C26 | 137.6° | 127.3° |
| O1 | C1 | C2 | O2 | 66.1° | 56.6° |
| O1 | C1 | C2 | C10 | 172.7° | 175.9° |
| O1 | C1 | C43 | H16 | 101.4° | 9.9° |
| O1 | C1 | C43 | H17 | 16.5° | 101.0° |
| O1 | C1 | C2 | H46 | 47.5° | 56.4° |
| C45 | C1 | C43 | C2 | 132.5° | 128.3° |
| C45 | C1 | C43 | C26 | 23.1° | 11.8° |
| C1 | C45 | C24 | C25 | 57.0° | 50.1° |
| C1 | C45 | C24 | C21 | 119.1° | 121.4° |
| C45 | C1 | C2 | O2 | 177.6° | 175.0° |
| C45 | C1 | C2 | C10 | 56.5° | 65.7° |
| C45 | C1 | C43 | H16 | 144.2° | 105.6° |
| C45 | C1 | C43 | H17 | 98.0° | 143.4° |
| C1 | C45 | C47 | H23 | 57.2° | 46.4° |
| C1 | C45 | C47 | H24 | 177.2° | 166.4° |
| C1 | C45 | C47 | H25 | 62.8° | 73.6° |
| C1 | C45 | C46 | H26 | 59.2° | 67.7° |
| C1 | C45 | C46 | H27 | 60.8° | 172.4° |
| C1 | C45 | C46 | H28 | 179.2° | 52.3° |
| C45 | C1 | O1 | H29 | 180.0° | 180.0° |
| C45 | C1 | C2 | H46 | 68.7° | 62.0° |
| C24 | C45 | C1 | C43 | 57.4° | 56.4° |
| C24 | C45 | C1 | C2 | 71.7° | 69.0° |
| C45 | C24 | C21 | O9 | 80.3° | 19.2° |
| C45 | C24 | C25 | C21 | 176.1° | 172.5° |
| C45 | C24 | C25 | C26 | 17.0° | 4.4° |
| C45 | C24 | C25 | C44 | 163.2° | 177.1° |
| C45 | C24 | C21 | C20 | 46.4° | 100.9° |
| C24 | C45 | C47 | H23 | 63.2° | 74.8° |
| C24 | C45 | C47 | H24 | 56.7° | 45.1° |
| C24 | C45 | C47 | H25 | 176.8° | 165.1° |
| C24 | C45 | C46 | H26 | 56.4° | 173.9° |
| C24 | C45 | C46 | H27 | 176.4° | 53.9° |
| C24 | C45 | C46 | H28 | 63.7° | 66.1° |
| C45 | C24 | C21 | H30 | 163.9° | 140.2° |
| C38 | C39 | C40 | H11 | 180.0° | 179.4° |
| C39 | C38 | C37 | H12 | 180.0° | 179.4° |
| C38 | C39 | C40 | C41 | 0.4° | 0.3° |
| C39 | C38 | C37 | C29 | 179.6° | 179.7° |
| C39 | C38 | C37 | C42 | 0.1° | 0.6° |
| C38 | C39 | C40 | H10 | 179.6° | 179.7° |
| C40 | C39 | C38 | C37 | 0.3° | 0.6° |
| C39 | C40 | C41 | H10 | 180.0° | 180.0° |
| C39 | C40 | C41 | C42 | 0.3° | 0.0° |
| C39 | C40 | C41 | H9 | 179.6° | 179.9° |
| C40 | C39 | C38 | H12 | 179.7° | 180.0° |
| C1 | C43 | C26 | H16 | 121.1° | 114.1° |
| C1 | C43 | C26 | H17 | 121.1° | 127.0° |
| C1 | C43 | C26 | C25 | 18.7° | 40.5° |
| C1 | C43 | C26 | O11 | 140.8° | 153.8° |
| C43 | C1 | C2 | O2 | 47.0° | 58.7° |
| C43 | C1 | C2 | C10 | 74.1° | 60.6° |
| C1 | C43 | C26 | H15 | 101.5° | 90.1° |
| C1 | C43 | H16 | H17 | 116.7° | 113.4° |
| C43 | C1 | O1 | H29 | 60.1° | 61.1° |
| C43 | C1 | C2 | H46 | 160.7° | 171.7° |
| C2 | C1 | C43 | C26 | 109.4° | 116.6° |
| C1 | C2 | O2 | C10 | 126.9° | 120.4° |
| C1 | C2 | O2 | H46 | 112.7° | 115.8° |
| C1 | C2 | C10 | H46 | 125.5° | 124.7° |
| C1 | C2 | O2 | C3 | 116.0° | 90.0° |
| C1 | C2 | C10 | C18 | 91.2° | 98.5° |
| C1 | C2 | C10 | C11 | 137.4° | 117.6° |
| C2 | C1 | C43 | H16 | 11.7° | 126.0° |
| C2 | C1 | C43 | H17 | 129.5° | 15.1° |
| C2 | C1 | O1 | H29 | 56.2° | 56.2° |
| C1 | C2 | C10 | H45 | 25.1° | 13.0° |
| C38 | C37 | C29 | C42 | 179.6° | 179.7° |
| C38 | C37 | C42 | C41 | 0.0° | 0.3° |
| C38 | C37 | C29 | C28 | 98.5° | 80.3° |
| C38 | C37 | C29 | N1 | 140.9° | 39.7° |
| C38 | C37 | C29 | H7 | 21.3° | 159.8° |
| C38 | C37 | C42 | H8 | 180.0° | 179.7° |
| C37 | C38 | C39 | H11 | 179.7° | 180.0° |
| O9 | C21 | C24 | C25 | 103.6° | 169.2° |
| O9 | C21 | C24 | C20 | 126.7° | 120.1° |
| O9 | C21 | C24 | H30 | 115.8° | 121.0° |
| O9 | C21 | C20 | H30 | 119.0° | 123.7° |
| O9 | C21 | C20 | O8 | 1.2° | 108.8° |
| O9 | C21 | C20 | C18 | 176.3° | 77.2° |
| O12 | C27 | O11 | C26 | 7.3° | 0.0° |
| O12 | C27 | O11 | C28 | 180.0° | 180.0° |
| O12 | C27 | C28 | C29 | 63.3° | 115.0° |
| O12 | C27 | C28 | O13 | 58.4° | 5.0° |
| O12 | C27 | C28 | H13 | 177.0° | 125.1° |
| C40 | C41 | C42 | C37 | 0.1° | 0.0° |
| C40 | C41 | C42 | H9 | 180.0° | 179.9° |
| C40 | C41 | C42 | H8 | 179.9° | 179.9° |
| C41 | C40 | C39 | H11 | 179.6° | 179.7° |
| C43 | C26 | C25 | C24 | 23.3° | 51.0° |
| C43 | C26 | C25 | O11 | 120.8° | 113.8° |
| C43 | C26 | C25 | H15 | 120.2° | 135.5° |
| C43 | C26 | O11 | H15 | 116.8° | 127.0° |
| C43 | C26 | C25 | C44 | 156.6° | 136.3° |
| C43 | C26 | O11 | C27 | 117.2° | 152.6° |
| C26 | C43 | H16 | H17 | 116.7° | 126.4° |
| C24 | C25 | C26 | C44 | 179.8° | 172.7° |
| C24 | C25 | C26 | O11 | 144.0° | 164.8° |
| C25 | C24 | C21 | C20 | 129.7° | 70.8° |
| C24 | C25 | C26 | H15 | 96.9° | 84.5° |
| C24 | C25 | C44 | H19 | 180.0° | 172.2° |
| C24 | C25 | C44 | H20 | 60.0° | 52.2° |
| C24 | C25 | C44 | H21 | 60.0° | 67.8° |
| C25 | C24 | C21 | H30 | 12.2° | 48.2° |
| C21 | C24 | C25 | C26 | 159.2° | 176.9° |
| C21 | C24 | C25 | C44 | 20.6° | 10.5° |
| C24 | C21 | C20 | H30 | 117.7° | 114.8° |
| C24 | C21 | C20 | O8 | 122.2° | 129.7° |
| C24 | C21 | C20 | C18 | 60.3° | 44.3° |
| C24 | C21 | O9 | H31 | 125.8° | 180.0° |
| C25 | C26 | O11 | H15 | 118.3° | 115.7° |
| C25 | C26 | O11 | C27 | 117.9° | 90.0° |
| C25 | C26 | C43 | H16 | 102.3° | 154.6° |
| C25 | C26 | C43 | H17 | 139.8° | 86.5° |
| C26 | C25 | C44 | H19 | 0.2° | 0.0° |
| C26 | C25 | C44 | H20 | 120.2° | 120.0° |
| C26 | C25 | C44 | H21 | 119.8° | 120.0° |
| O11 | C26 | C25 | C44 | 35.8° | 22.5° |
| C26 | O11 | C27 | C28 | 172.7° | 180.0° |
| O11 | C26 | C43 | H16 | 19.7° | 92.1° |
| O11 | C26 | C43 | H17 | 98.2° | 26.8° |
| O3 | C3 | O2 | C2 | 18.7° | 0.0° |
| O3 | C3 | O2 | C4 | 179.5° | 180.0° |
| O3 | C3 | C4 | C9 | 27.6° | 179.7° |
| O3 | C3 | C4 | C5 | 152.6° | 0.1° |
| C44 | C25 | C26 | H15 | 83.3° | 88.2° |
| C25 | C44 | H19 | H20 | 120.0° | 120.0° |
| C25 | C44 | H19 | H21 | 120.0° | 120.0° |
| C25 | C44 | H20 | H21 | 120.0° | 120.1° |
| C21 | C20 | O8 | C18 | 177.7° | 174.3° |
| C21 | C20 | C18 | C10 | 38.3° | 62.4° |
| C21 | C20 | C18 | C19 | 167.4° | 62.3° |
| C21 | C20 | C18 | C17 | 77.2° | 165.8° |
| C20 | C21 | O9 | H31 | 0.5° | 61.9° |
| O8 | C20 | C18 | C10 | 144.2° | 111.4° |
| O8 | C20 | C18 | C19 | 15.0° | 123.9° |
| O8 | C20 | C18 | C17 | 100.3° | 20.4° |
| O8 | C20 | C21 | H30 | 120.2° | 14.9° |
| O2 | C2 | C10 | H46 | 121.5° | 118.1° |
| C2 | O2 | C3 | C4 | 161.7° | 180.0° |
| O2 | C2 | C10 | C18 | 155.7° | 144.4° |
| O2 | C2 | C10 | C11 | 24.4° | 0.4° |
| O2 | C2 | C10 | H45 | 88.0° | 104.2° |
| C10 | C2 | O2 | C3 | 117.2° | 149.5° |
| C2 | C10 | C18 | C20 | 64.3° | 105.3° |
| C2 | C10 | C18 | C11 | 132.2° | 139.9° |
| C2 | C10 | C18 | H45 | 116.2° | 111.8° |
| C2 | C10 | C11 | H45 | 112.2° | 107.0° |
| C2 | C10 | C18 | C19 | 58.6° | 15.7° |
| C2 | C10 | C18 | C17 | 176.0° | 124.9° |
| C2 | C10 | C11 | C14 | 54.2° | 58.0° |
| C2 | C10 | C11 | O4 | 72.0° | 68.6° |
| C2 | C10 | C11 | C15 | 155.9° | 154.7° |
| O2 | C3 | C4 | C9 | 151.9° | 0.3° |
| O2 | C3 | C4 | C5 | 27.9° | 180.0° |
| C3 | O2 | C2 | H46 | 3.3° | 25.8° |
| C3 | C4 | C9 | C5 | 179.8° | 179.7° |
| C3 | C4 | C9 | C8 | 179.4° | 180.0° |
| C3 | C4 | C5 | C6 | 179.6° | 179.7° |
| C3 | C4 | C9 | H47 | 0.6° | 0.1° |
| C3 | C4 | C5 | H51 | 0.5° | 0.1° |
| O11 | C27 | C28 | C29 | 116.7° | 65.0° |
| O11 | C27 | C28 | O13 | 121.6° | 175.0° |
| O11 | C27 | C28 | H13 | 3.0° | 55.0° |
| C27 | O11 | C26 | H15 | 0.4° | 25.6° |
| C27 | C28 | C29 | C37 | 47.1° | 179.9° |
| C27 | C28 | C29 | O13 | 119.5° | 120.0° |
| C27 | C28 | C29 | H13 | 120.0° | 120.0° |
| C27 | C28 | C29 | N1 | 168.4° | 60.0° |
| C27 | C28 | O13 | H13 | 118.0° | 120.0° |
| C27 | C28 | C29 | H7 | 73.1° | 60.0° |
| C27 | C28 | O13 | H14 | 22.9° | 60.0° |
| C29 | C37 | C42 | C41 | 179.7° | 180.0° |
| C37 | C29 | C28 | N1 | 121.3° | 120.0° |
| C37 | C29 | C28 | H7 | 120.1° | 119.9° |
| C37 | C29 | N1 | H7 | 119.3° | 120.0° |
| C37 | C29 | C28 | O13 | 166.5° | 60.0° |
| C37 | C29 | N1 | C30 | 78.3° | 85.0° |
| C37 | C29 | N1 | H6 | 101.6° | 95.0° |
| C29 | C37 | C42 | H8 | 0.4° | 0.1° |
| C29 | C37 | C38 | H12 | 0.4° | 0.3° |
| C37 | C29 | C28 | H13 | 72.9° | 60.0° |
| C37 | C42 | C41 | H8 | 180.0° | 179.9° |
| C42 | C37 | C29 | C28 | 81.1° | 100.0° |
| C42 | C37 | C29 | N1 | 39.5° | 140.0° |
| C42 | C37 | C29 | H7 | 159.1° | 19.9° |
| C37 | C42 | C41 | H9 | 179.9° | 179.9° |
| C42 | C37 | C38 | H12 | 179.9° | 179.9° |
| C4 | C9 | C8 | H47 | 180.0° | 179.9° |
| C4 | C9 | C8 | C7 | 0.1° | 0.0° |
| C9 | C4 | C5 | C6 | 0.2° | 0.5° |
| C4 | C9 | C8 | H48 | 179.8° | 180.0° |
| C9 | C4 | C5 | H51 | 179.7° | 179.7° |
| C8 | C9 | C4 | C5 | 0.3° | 0.3° |
| C9 | C8 | C7 | H48 | 180.0° | 180.0° |
| C9 | C8 | C7 | C6 | 0.2° | 0.0° |
| C9 | C8 | C7 | H49 | 179.8° | 180.0° |
| C20 | C18 | C10 | C19 | 122.9° | 121.0° |
| C20 | C18 | C10 | C17 | 111.7° | 129.8° |
| C20 | C18 | C10 | C11 | 163.5° | 114.8° |
| C20 | C18 | C19 | C17 | 107.8° | 111.0° |
| C20 | C18 | C17 | O7 | 48.3° | 154.5° |
| C20 | C18 | C17 | C16 | 168.1° | 81.6° |
| C18 | C20 | C21 | H30 | 57.3° | 159.1° |
| C20 | C18 | C19 | H32 | 180.0° | 40.4° |
| C20 | C18 | C19 | H33 | 60.0° | 160.3° |
| C20 | C18 | C19 | H34 | 60.0° | 79.6° |
| C20 | C18 | C17 | H35 | 71.9° | 37.4° |
| C20 | C18 | C10 | H45 | 52.0° | 6.5° |
| C42 | C41 | C40 | H10 | 179.7° | 180.0° |
| C28 | C29 | N1 | H7 | 117.9° | 120.0° |
| C29 | C28 | O13 | H13 | 119.8° | 120.0° |
| C28 | C29 | N1 | C30 | 158.9° | 155.0° |
| C28 | C29 | N1 | H6 | 21.1° | 25.0° |
| C29 | C28 | O13 | H14 | 99.3° | 60.0° |
| C29 | N1 | C30 | O14 | 1.5° | 0.0° |
| N1 | C29 | C28 | O13 | 72.2° | 60.0° |
| C29 | N1 | C30 | H6 | 180.0° | 180.0° |
| C29 | N1 | C30 | C31 | 177.8° | 179.7° |
| N1 | C29 | C28 | H13 | 48.4° | 180.0° |
| C4 | C5 | C6 | H51 | 180.0° | 179.8° |
| C4 | C5 | C6 | C7 | 0.1° | 0.5° |
| C5 | C4 | C9 | H47 | 179.7° | 179.8° |
| C4 | C5 | C6 | H50 | 179.9° | 179.8° |
| O14 | C30 | N1 | C31 | 179.4° | 179.7° |
| O14 | C30 | C31 | C36 | 56.2° | 0.0° |
| O14 | C30 | C31 | C32 | 124.1° | 179.7° |
| O14 | C30 | N1 | H6 | 178.4° | 180.0° |
| C8 | C7 | C6 | C5 | 0.3° | 0.3° |
| C8 | C7 | C6 | H49 | 180.0° | 180.0° |
| C7 | C8 | C9 | H47 | 179.9° | 179.9° |
| C8 | C7 | C6 | H50 | 179.7° | 180.0° |
| O13 | C28 | C29 | H7 | 46.4° | 180.0° |
| C18 | C10 | C11 | H45 | 111.5° | 109.8° |
| C10 | C18 | C19 | C17 | 123.5° | 118.5° |
| C18 | C10 | C11 | C14 | 82.1° | 85.2° |
| C18 | C10 | C11 | O4 | 151.8° | 148.2° |
| C18 | C10 | C11 | C15 | 19.6° | 11.5° |
| C10 | C18 | C17 | O7 | 169.8° | 69.8° |
| C10 | C18 | C17 | C16 | 70.3° | 54.1° |
| C10 | C18 | C19 | H32 | 51.3° | 90.1° |
| C10 | C18 | C19 | H33 | 171.3° | 29.8° |
| C10 | C18 | C19 | H34 | 68.7° | 149.9° |
| C10 | C18 | C17 | H35 | 49.7° | 173.1° |
| C18 | C10 | C2 | H46 | 34.3° | 26.3° |
| C11 | C10 | C18 | C19 | 73.6° | 124.3° |
| C11 | C10 | C18 | C17 | 51.8° | 15.0° |
| C10 | C11 | C14 | O4 | 127.9° | 127.3° |
| C10 | C11 | C14 | C15 | 122.5° | 121.1° |
| C10 | C11 | O4 | C15 | 137.4° | 140.6° |
| C10 | C11 | C14 | O6 | 119.8° | 123.9° |
| C10 | C11 | O4 | C12 | 68.0° | 177.3° |
| C10 | C11 | C15 | O6 | 115.1° | 115.0° |
| C10 | C11 | C15 | C16 | 0.9° | 3.0° |
| C10 | C11 | C15 | H39 | 131.7° | 126.7° |
| C10 | C11 | C14 | H40 | 3.3° | 124.3° |
| C10 | C11 | C14 | H41 | 123.8° | 5.6° |
| C11 | C10 | C2 | H46 | 97.1° | 117.7° |
| C19 | C18 | C17 | O7 | 61.7° | 47.3° |
| C19 | C18 | C17 | C16 | 58.2° | 171.2° |
| C18 | C19 | H32 | H33 | 120.0° | 120.0° |
| C18 | C19 | H32 | H34 | 120.0° | 120.0° |
| C18 | C19 | H33 | H34 | 120.0° | 120.0° |
| C19 | C18 | C17 | H35 | 178.2° | 69.8° |
| C19 | C18 | C10 | H45 | 174.8° | 127.5° |
| C18 | C17 | O7 | C16 | 124.2° | 122.6° |
| C18 | C17 | O7 | H35 | 119.3° | 118.3° |
| C18 | C17 | C16 | H35 | 119.8° | 118.0° |
| C18 | C17 | C16 | C15 | 48.5° | 69.1° |
| C17 | C18 | C19 | H32 | 72.2° | 151.4° |
| C17 | C18 | C19 | H33 | 47.8° | 88.6° |
| C17 | C18 | C19 | H34 | 167.8° | 31.4° |
| C18 | C17 | O7 | H36 | 16.0° | 180.0° |
| C18 | C17 | C16 | H37 | 168.8° | 54.2° |
| C18 | C17 | C16 | H38 | 71.9° | 174.3° |
| C17 | C18 | C10 | H45 | 59.7° | 123.3° |
| N1 | C30 | C31 | C36 | 124.4° | 179.8° |
| N1 | C30 | C31 | C32 | 55.3° | 0.0° |
| C30 | N1 | C29 | H7 | 41.0° | 35.0° |
| C30 | C31 | C36 | C32 | 179.7° | 179.8° |
| C30 | C31 | C36 | C35 | 179.8° | 180.0° |
| C30 | C31 | C32 | C33 | 179.9° | 179.7° |
| C30 | C31 | C36 | H1 | 0.2° | 0.1° |
| C30 | C31 | C32 | H5 | 0.1° | 0.0° |
| C31 | C30 | N1 | H6 | 2.2° | 0.3° |
| C5 | C6 | C7 | H50 | 180.0° | 179.7° |
| C5 | C6 | C7 | H49 | 179.7° | 179.7° |
| C6 | C7 | C8 | H48 | 179.8° | 180.0° |
| C7 | C6 | C5 | H51 | 179.9° | 179.7° |
| C14 | C11 | O4 | C15 | 93.0° | 92.4° |
| C11 | C14 | O6 | H40 | 116.5° | 113.8° |
| C11 | C14 | O6 | H41 | 116.5° | 119.5° |
| C14 | C11 | O4 | C12 | 162.4° | 50.3° |
| C14 | C11 | C15 | O6 | 2.8° | 2.6° |
| C14 | C11 | C15 | C16 | 118.8° | 115.4° |
| C14 | C11 | C15 | H39 | 110.4° | 120.8° |
| C11 | C14 | H40 | H41 | 129.4° | 131.9° |
| C14 | C11 | C10 | H45 | 166.4° | 164.9° |
| O4 | C11 | C14 | O6 | 112.4° | 108.8° |
| C11 | O4 | C12 | O5 | 2.6° | 0.0° |
| C11 | O4 | C12 | C13 | 176.8° | 180.0° |
| O4 | C11 | C15 | O6 | 111.6° | 108.0° |
| O4 | C11 | C15 | C16 | 132.4° | 134.0° |
| O4 | C11 | C15 | H39 | 1.6° | 10.2° |
| O4 | C11 | C14 | H40 | 131.1° | 3.0° |
| O4 | C11 | C14 | H41 | 4.1° | 132.9° |
| O4 | C11 | C10 | H45 | 40.3° | 38.4° |
| C11 | C15 | C16 | C17 | 12.2° | 41.6° |
| C15 | C11 | O4 | C12 | 69.4° | 42.1° |
| C11 | C15 | O6 | C16 | 123.2° | 113.6° |
| C11 | C15 | O6 | H39 | 111.8° | 111.7° |
| C11 | C15 | C16 | H39 | 130.7° | 122.9° |
| C11 | C15 | C16 | H37 | 132.6° | 83.2° |
| C11 | C15 | C16 | H38 | 108.2° | 158.7° |
| C15 | C11 | C14 | H40 | 119.3° | 114.5° |
| C15 | C11 | C14 | H41 | 113.7° | 115.5° |
| C15 | C11 | C10 | H45 | 91.8° | 98.3° |
| O7 | C17 | C16 | H35 | 117.2° | 116.8° |
| O7 | C17 | C16 | C15 | 171.5° | 56.1° |
| O7 | C17 | C16 | H37 | 68.2° | 179.4° |
| O7 | C17 | C16 | H38 | 51.1° | 60.5° |
| C17 | C16 | C15 | O6 | 115.7° | 58.4° |
| C17 | C16 | C15 | H37 | 120.4° | 124.8° |
| C17 | C16 | C15 | H38 | 120.4° | 117.1° |
| C16 | C17 | O7 | H36 | 140.2° | 57.4° |
| C17 | C16 | H37 | H38 | 118.8° | 119.7° |
| C17 | C16 | C15 | H39 | 118.5° | 164.5° |
| C14 | O6 | C15 | C16 | 126.2° | 110.6° |
| C14 | O6 | C15 | H39 | 108.8° | 114.6° |
| O6 | C14 | H40 | H41 | 129.5° | 127.9° |
| O4 | C12 | O5 | C13 | 179.4° | 180.0° |
| O4 | C12 | C13 | H42 | 179.4° | 90.0° |
| O4 | C12 | C13 | H43 | 60.6° | 150.0° |
| O4 | C12 | C13 | H44 | 59.4° | 29.9° |
| C31 | C36 | C35 | H1 | 180.0° | 179.9° |
| C36 | C31 | C32 | C33 | 0.2° | 0.6° |
| C31 | C36 | C35 | C34 | 0.0° | 0.1° |
| C31 | C36 | C35 | H2 | 180.0° | 180.0° |
| C36 | C31 | C32 | H5 | 179.8° | 179.8° |
| C32 | C31 | C36 | C35 | 0.2° | 0.2° |
| C31 | C32 | C33 | H5 | 180.0° | 179.6° |
| C31 | C32 | C33 | C34 | 0.1° | 0.7° |
| C32 | C31 | C36 | H1 | 179.8° | 179.7° |
| C31 | C32 | C33 | H4 | 179.9° | 179.6° |
| O5 | C12 | C13 | H42 | 0.0° | 90.0° |
| O5 | C12 | C13 | H43 | 120.0° | 30.0° |
| O5 | C12 | C13 | H44 | 120.0° | 150.1° |
| C12 | C13 | H42 | H43 | 120.0° | 120.0° |
| C12 | C13 | H42 | H44 | 120.0° | 120.0° |
| C12 | C13 | H43 | H44 | 120.0° | 120.1° |
| C36 | C35 | C34 | H2 | 180.0° | 180.0° |
| C36 | C35 | C34 | C33 | 0.1° | 0.0° |
| C36 | C35 | C34 | H3 | 179.8° | 179.9° |
| O6 | C15 | C16 | H39 | 125.7° | 137.1° |
| O6 | C15 | C16 | H37 | 123.9° | 176.8° |
| O6 | C15 | C16 | H38 | 4.7° | 58.8° |
| C15 | O6 | C14 | H40 | 119.4° | 116.8° |
| C15 | O6 | C14 | H41 | 113.5° | 116.6° |
| C15 | C16 | C17 | H35 | 71.3° | 172.9° |
| C15 | C16 | H37 | H38 | 118.8° | 117.1° |
| C32 | C33 | C34 | C35 | 0.1° | 0.4° |
| C32 | C33 | C34 | H4 | 180.0° | 179.7° |
| C32 | C33 | C34 | H3 | 179.9° | 179.7° |
| C35 | C34 | C33 | H3 | 180.0° | 180.0° |
| C34 | C35 | C36 | H1 | 180.0° | 180.0° |
| C35 | C34 | C33 | H4 | 179.9° | 179.9° |
| C33 | C34 | C35 | H2 | 179.9° | 180.0° |
| C34 | C33 | C32 | H5 | 179.9° | 179.7° |
| H1 | C36 | C35 | H2 | 0.0° | 0.1° |
| H2 | C35 | C34 | H3 | 0.2° | 0.0° |
| H3 | C34 | C33 | H4 | 0.1° | 0.0° |
| H4 | C33 | C32 | H5 | 0.1° | 0.0° |
| H6 | N1 | C29 | H7 | 139.1° | 145.0° |
| H7 | C29 | C28 | H13 | 166.9° | 60.0° |
| H8 | C42 | C41 | H9 | 0.2° | 0.0° |
| H9 | C41 | C40 | H10 | 0.3° | 0.1° |
| H10 | C40 | C39 | H11 | 0.4° | 0.3° |
| H11 | C39 | C38 | H12 | 0.3° | 0.6° |
| H13 | C28 | O13 | H14 | 140.9° | 180.0° |
| H15 | C26 | C43 | H16 | 137.4° | 24.1° |
| H15 | C26 | C43 | H17 | 19.6° | 142.9° |
| H19 | C44 | H20 | H21 | 120.0° | 119.9° |
| H23 | C47 | H24 | H25 | 120.0° | 120.0° |
| H26 | C46 | H27 | H28 | 120.0° | 120.0° |
| H30 | C21 | O9 | H31 | 118.9° | 62.2° |
| H32 | C19 | H33 | H34 | 120.0° | 120.0° |
| H35 | C17 | O7 | H36 | 103.3° | 61.6° |
| H35 | C17 | C16 | H37 | 49.0° | 63.8° |
| H35 | C17 | C16 | H38 | 168.3° | 56.3° |
| H37 | C16 | C15 | H39 | 1.9° | 39.7° |
| H38 | C16 | C15 | H39 | 121.0° | 78.4° |
| H42 | C13 | H43 | H44 | 120.0° | 119.9° |
| H45 | C10 | C2 | H46 | 150.6° | 137.7° |
| H47 | C9 | C8 | H48 | 0.2° | 0.1° |
| H48 | C8 | C7 | H49 | 0.1° | 0.0° |
| H49 | C7 | C6 | H50 | 0.3° | 0.0° |
| H50 | C6 | C5 | H51 | 0.0° | 0.0° |
