PRD_001133
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O50 | S47 | doub | 1.42Å | 1.48Å | |
| C51 | C52 | sing | 1.53Å | 1.51Å | |
| C51 | C48 | sing | 1.53Å | 1.51Å | |
| C52 | C48 | sing | 1.53Å | 1.52Å | |
| O49 | S47 | doub | 1.42Å | 1.47Å | |
| S47 | C48 | sing | 1.81Å | 1.85Å | |
| S47 | N7 | sing | 1.66Å | 1.69Å | |
| O5 | C6 | doub | 1.21Å | 1.32Å | |
| N7 | C6 | sing | 1.35Å | 1.33Å | |
| C6 | C2 | sing | 1.50Å | 1.51Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | N4 | sing | 1.48Å | 1.44Å | |
| C8 | C29 | sing | 1.53Å | 1.35Å | |
| C8 | C3 | sing | 1.53Å | 1.50Å | |
| C29 | C28 | sing | 1.53Å | 1.54Å | |
| N4 | C14 | sing | 1.36Å | 1.38Å | |
| O15 | C14 | doub | 1.21Å | 1.23Å | |
| C14 | C11 | sing | 1.51Å | 1.54Å | |
| C28 | C27 | sing | 1.53Å | 1.54Å | |
| C27 | C26 | sing | 1.53Å | 1.55Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | N10 | sing | 1.47Å | 1.47Å | |
| C12 | C13 | sing | 1.54Å | 1.53Å | |
| C26 | C25 | sing | 1.53Å | 1.55Å | |
| O19 | C17 | doub | 1.21Å | 1.23Å | |
| N10 | C17 | sing | 1.35Å | 1.37Å | |
| N10 | C9 | sing | 1.46Å | 1.47Å | |
| C25 | C24 | sing | 1.53Å | 1.55Å | |
| C17 | C18 | sing | 1.51Å | 1.54Å | |
| C13 | C9 | sing | 1.53Å | 1.54Å | |
| C13 | O16 | sing | 1.45Å | 1.43Å | |
| O32 | C30 | doub | 1.22Å | 1.23Å | |
| C30 | O16 | sing | 1.35Å | 1.32Å | |
| C30 | N31 | sing | 1.35Å | 1.38Å | |
| C24 | C18 | sing | 1.53Å | 1.55Å | |
| N31 | C33 | sing | 1.47Å | 1.48Å | |
| N31 | C37 | sing | 1.47Å | 1.47Å | |
| C18 | N20 | sing | 1.46Å | 1.47Å | |
| C33 | C34 | sing | 1.51Å | 1.53Å | |
| C36 | C37 | sing | 1.53Å | 1.52Å | |
| C36 | C35 | sing | 1.51Å | 1.51Å | |
| C34 | C35 | doub | 1.38Å | 1.41Å | Aromatic |
| C34 | C38 | sing | 1.39Å | 1.41Å | Aromatic |
| N20 | C21 | sing | 1.35Å | 1.38Å | |
| C35 | C41 | sing | 1.39Å | 1.41Å | Aromatic |
| C38 | C39 | doub | 1.38Å | 1.41Å | Aromatic |
| C21 | O22 | doub | 1.21Å | 1.23Å | |
| C21 | O23 | sing | 1.35Å | 1.31Å | |
| C41 | C40 | doub | 1.38Å | 1.41Å | Aromatic |
| C39 | C40 | sing | 1.38Å | 1.41Å | Aromatic |
| O23 | C42 | sing | 1.45Å | 1.42Å | |
| C45 | C46 | sing | 1.55Å | 1.54Å | |
| C45 | C44 | sing | 1.54Å | 1.54Å | |
| C46 | C42 | sing | 1.55Å | 1.53Å | |
| C42 | C43 | sing | 1.54Å | 1.53Å | |
| C44 | C43 | sing | 1.54Å | 1.53Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| N4 | H4 | sing | 0.97Å | 1.00Å | |
| N7 | H5 | sing | 0.97Å | 1.00Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| N20 | H15 | sing | 0.97Å | 1.00Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.09Å | 1.10Å | |
| C26 | H21 | sing | 1.09Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C28 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C33 | H28 | sing | 1.09Å | 1.10Å | |
| C33 | H29 | sing | 1.09Å | 1.10Å | |
| C36 | H30 | sing | 1.09Å | 1.10Å | |
| C36 | H31 | sing | 1.09Å | 1.10Å | |
| C37 | H32 | sing | 1.09Å | 1.10Å | |
| C37 | H33 | sing | 1.09Å | 1.10Å | |
| C38 | H34 | sing | 1.08Å | 1.08Å | |
| C39 | H35 | sing | 1.08Å | 1.08Å | |
| C40 | H36 | sing | 1.08Å | 1.08Å | |
| C41 | H37 | sing | 1.08Å | 1.08Å | |
| C42 | H38 | sing | 1.09Å | 1.10Å | |
| C43 | H39 | sing | 1.09Å | 1.10Å | |
| C43 | H40 | sing | 1.09Å | 1.10Å | |
| C44 | H41 | sing | 1.09Å | 1.10Å | |
| C44 | H42 | sing | 1.09Å | 1.10Å | |
| C45 | H43 | sing | 1.09Å | 1.10Å | |
| C45 | H44 | sing | 1.09Å | 1.10Å | |
| C46 | H45 | sing | 1.09Å | 1.10Å | |
| C46 | H46 | sing | 1.09Å | 1.10Å | |
| C48 | H47 | sing | 1.09Å | 1.10Å | |
| C51 | H48 | sing | 1.09Å | 1.10Å | |
| C51 | H49 | sing | 1.09Å | 1.10Å | |
| C52 | H50 | sing | 1.09Å | 1.10Å | |
| C52 | H51 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O50 | S47 | O49 | 118.1° | 121.1° |
| O50 | S47 | C48 | 107.4° | 110.5° |
| O50 | S47 | N7 | 107.6° | 104.3° |
| C52 | C51 | C48 | 60.1° | 60.0° |
| C51 | C52 | C48 | 60.0° | 60.0° |
| C52 | C51 | H48 | 120.0° | 117.5° |
| C52 | C51 | H49 | 120.0° | 117.5° |
| C51 | C52 | H50 | 120.0° | 117.6° |
| C51 | C52 | H51 | 120.0° | 117.5° |
| C51 | C48 | C52 | 59.9° | 60.0° |
| C51 | C48 | S47 | 112.4° | 117.5° |
| C51 | C48 | H47 | 122.3° | 117.5° |
| C48 | C51 | H48 | 120.0° | 117.5° |
| C48 | C51 | H49 | 120.0° | 117.5° |
| C52 | C48 | S47 | 112.2° | 117.5° |
| C52 | C48 | H47 | 122.3° | 117.5° |
| C48 | C52 | H50 | 120.0° | 117.5° |
| C48 | C52 | H51 | 120.0° | 117.5° |
| O49 | S47 | C48 | 109.5° | 110.5° |
| O49 | S47 | N7 | 109.3° | 104.3° |
| C48 | S47 | N7 | 104.0° | 104.4° |
| S47 | C48 | H47 | 116.0° | 115.6° |
| S47 | N7 | C6 | 118.7° | 120.0° |
| S47 | N7 | H5 | 120.6° | 120.0° |
| O5 | C6 | N7 | 122.2° | 120.0° |
| O5 | C6 | C2 | 119.4° | 120.0° |
| N7 | C6 | C2 | 117.8° | 120.0° |
| C6 | N7 | H5 | 120.6° | 120.0° |
| C6 | C2 | C1 | 119.9° | 117.9° |
| C6 | C2 | C3 | 122.5° | 117.9° |
| C6 | C2 | N4 | 112.0° | 116.2° |
| C2 | C1 | C3 | 59.9° | 60.0° |
| C1 | C2 | C3 | 60.1° | 60.0° |
| C1 | C2 | N4 | 118.5° | 116.8° |
| C2 | C1 | H1 | 120.0° | 117.5° |
| C2 | C1 | H2 | 120.0° | 117.6° |
| C1 | C3 | C2 | 60.0° | 60.0° |
| C1 | C3 | C8 | 123.3° | 117.4° |
| C3 | C1 | H1 | 120.0° | 117.5° |
| C3 | C1 | H2 | 120.0° | 117.6° |
| C1 | C3 | H3 | 113.1° | 117.3° |
| C3 | C2 | N4 | 114.8° | 116.4° |
| C2 | C3 | C8 | 123.8° | 116.7° |
| C2 | C3 | H3 | 113.1° | 117.7° |
| C2 | N4 | C14 | 127.3° | 115.9° |
| C2 | N4 | H4 | 116.3° | 122.0° |
| C29 | C8 | C3 | 129.3° | 109.4° |
| C8 | C29 | C28 | 128.8° | 109.4° |
| C29 | C8 | H6 | 104.3° | 109.5° |
| C29 | C8 | H7 | 104.3° | 109.5° |
| C8 | C29 | H26 | 104.4° | 109.5° |
| C8 | C29 | H27 | 104.4° | 109.5° |
| C8 | C3 | H3 | 113.4° | 116.1° |
| C3 | C8 | H6 | 104.3° | 109.5° |
| C3 | C8 | H7 | 104.3° | 109.5° |
| C29 | C28 | C27 | 114.9° | 109.5° |
| C29 | C28 | H24 | 108.1° | 109.5° |
| C29 | C28 | H25 | 108.1° | 109.4° |
| C28 | C29 | H26 | 104.5° | 109.5° |
| C28 | C29 | H27 | 104.5° | 109.5° |
| N4 | C14 | O15 | 122.8° | 120.5° |
| N4 | C14 | C11 | 121.1° | 119.0° |
| C14 | N4 | H4 | 116.4° | 122.1° |
| O15 | C14 | C11 | 115.8° | 120.5° |
| C14 | C11 | C12 | 112.8° | 110.2° |
| C14 | C11 | N10 | 111.9° | 109.5° |
| C14 | C11 | H10 | 108.5° | 109.4° |
| C28 | C27 | C26 | 108.6° | 109.4° |
| C28 | C27 | H22 | 109.7° | 109.4° |
| C28 | C27 | H23 | 109.7° | 109.5° |
| C27 | C28 | H24 | 108.1° | 109.5° |
| C27 | C28 | H25 | 108.1° | 109.4° |
| C27 | C26 | C25 | 110.4° | 109.4° |
| C27 | C26 | H20 | 109.3° | 109.5° |
| C27 | C26 | H21 | 109.3° | 109.5° |
| C26 | C27 | H22 | 109.7° | 109.5° |
| C26 | C27 | H23 | 109.7° | 109.5° |
| C12 | C11 | N10 | 105.9° | 108.2° |
| C11 | C12 | C13 | 102.5° | 106.2° |
| C12 | C11 | H10 | 108.4° | 109.9° |
| C11 | C12 | H11 | 111.2° | 110.2° |
| C11 | C12 | H12 | 111.2° | 110.1° |
| C11 | N10 | C17 | 123.3° | 124.8° |
| C11 | N10 | C9 | 110.7° | 109.5° |
| N10 | C11 | H10 | 109.2° | 109.6° |
| C12 | C13 | C9 | 104.4° | 104.8° |
| C12 | C13 | O16 | 110.7° | 110.4° |
| C13 | C12 | H11 | 111.2° | 110.1° |
| C13 | C12 | H12 | 111.2° | 110.1° |
| C12 | C13 | H13 | 110.3° | 110.4° |
| C26 | C25 | C24 | 110.1° | 109.5° |
| C26 | C25 | H18 | 109.3° | 109.5° |
| C26 | C25 | H19 | 109.3° | 109.5° |
| C25 | C26 | H20 | 109.2° | 109.5° |
| C25 | C26 | H21 | 109.2° | 109.5° |
| O19 | C17 | N10 | 122.2° | 120.1° |
| O19 | C17 | C18 | 116.9° | 120.1° |
| C17 | N10 | C9 | 124.6° | 125.7° |
| N10 | C17 | C18 | 120.8° | 119.8° |
| N10 | C9 | C13 | 104.4° | 108.0° |
| N10 | C9 | H8 | 110.7° | 109.8° |
| N10 | C9 | H9 | 110.7° | 109.8° |
| C25 | C24 | C18 | 108.5° | 109.5° |
| C25 | C24 | H16 | 109.7° | 109.4° |
| C25 | C24 | H17 | 109.7° | 109.5° |
| C24 | C25 | H18 | 109.3° | 109.4° |
| C24 | C25 | H19 | 109.3° | 109.5° |
| C17 | C18 | C24 | 112.1° | 109.3° |
| C17 | C18 | N20 | 109.2° | 109.5° |
| C17 | C18 | H14 | 108.1° | 109.5° |
| C9 | C13 | O16 | 109.1° | 110.4° |
| C13 | C9 | H8 | 110.8° | 109.8° |
| C13 | C9 | H9 | 110.7° | 109.8° |
| C9 | C13 | H13 | 110.2° | 110.4° |
| C13 | O16 | C30 | 122.5° | 117.0° |
| O16 | C13 | H13 | 111.8° | 110.4° |
| O32 | C30 | O16 | 123.6° | 120.0° |
| O32 | C30 | N31 | 122.6° | 120.0° |
| O16 | C30 | N31 | 110.5° | 120.0° |
| C30 | N31 | C33 | 122.9° | 121.3° |
| C30 | N31 | C37 | 120.7° | 121.3° |
| C24 | C18 | N20 | 110.2° | 109.5° |
| C24 | C18 | H14 | 108.1° | 109.5° |
| C18 | C24 | H16 | 109.7° | 109.5° |
| C18 | C24 | H17 | 109.7° | 109.4° |
| C33 | N31 | C37 | 112.6° | 117.3° |
| N31 | C33 | C34 | 114.8° | 109.7° |
| N31 | C33 | H28 | 108.1° | 109.4° |
| N31 | C33 | H29 | 108.1° | 109.5° |
| N31 | C37 | C36 | 107.2° | 107.6° |
| N31 | C37 | H32 | 110.1° | 109.8° |
| N31 | C37 | H33 | 110.0° | 109.8° |
| C18 | N20 | C21 | 122.3° | 120.0° |
| N20 | C18 | H14 | 109.1° | 109.5° |
| C18 | N20 | H15 | 118.9° | 120.0° |
| C33 | C34 | C35 | 120.8° | 122.4° |
| C33 | C34 | C38 | 120.2° | 117.8° |
| C34 | C33 | H28 | 108.1° | 109.4° |
| C34 | C33 | H29 | 108.1° | 109.5° |
| C37 | C36 | C35 | 106.9° | 110.8° |
| C37 | C36 | H30 | 110.1° | 109.1° |
| C37 | C36 | H31 | 110.1° | 109.2° |
| C36 | C37 | H32 | 110.0° | 109.9° |
| C36 | C37 | H33 | 110.0° | 109.9° |
| C36 | C35 | C34 | 117.9° | 122.8° |
| C36 | C35 | C41 | 119.8° | 117.6° |
| C35 | C36 | H30 | 110.1° | 109.4° |
| C35 | C36 | H31 | 110.1° | 109.1° |
| C35 | C34 | C38 | 119.0° | 119.8° |
| C34 | C35 | C41 | 122.3° | 119.6° |
| C34 | C38 | C39 | 119.1° | 120.5° |
| C34 | C38 | H34 | 120.5° | 119.8° |
| N20 | C21 | O22 | 123.6° | 120.0° |
| N20 | C21 | O23 | 112.0° | 120.0° |
| C21 | N20 | H15 | 118.8° | 120.0° |
| C35 | C41 | C40 | 118.2° | 120.6° |
| C35 | C41 | H37 | 120.9° | 119.7° |
| C38 | C39 | C40 | 121.4° | 119.7° |
| C39 | C38 | H34 | 120.4° | 119.7° |
| C38 | C39 | H35 | 119.3° | 120.1° |
| O22 | C21 | O23 | 124.2° | 120.0° |
| C21 | O23 | C42 | 119.5° | 117.0° |
| C41 | C40 | C39 | 120.0° | 119.8° |
| C41 | C40 | H36 | 120.0° | 120.1° |
| C40 | C41 | H37 | 120.9° | 119.7° |
| C40 | C39 | H35 | 119.3° | 120.2° |
| C39 | C40 | H36 | 120.0° | 120.1° |
| O23 | C42 | C46 | 110.0° | 110.5° |
| O23 | C42 | C43 | 110.2° | 110.5° |
| O23 | C42 | H38 | 111.2° | 110.4° |
| C46 | C45 | C44 | 106.8° | 104.2° |
| C45 | C46 | C42 | 104.2° | 102.7° |
| C46 | C45 | H43 | 110.1° | 110.5° |
| C46 | C45 | H44 | 110.1° | 110.5° |
| C45 | C46 | H45 | 110.8° | 110.7° |
| C45 | C46 | H46 | 110.7° | 110.9° |
| C45 | C44 | C43 | 107.6° | 106.6° |
| C45 | C44 | H41 | 110.0° | 110.0° |
| C45 | C44 | H42 | 110.0° | 110.1° |
| C44 | C45 | H43 | 110.2° | 110.5° |
| C44 | C45 | H44 | 110.2° | 110.5° |
| C46 | C42 | C43 | 105.9° | 104.2° |
| C46 | C42 | H38 | 109.7° | 110.6° |
| C42 | C46 | H45 | 110.7° | 110.8° |
| C42 | C46 | H46 | 110.8° | 110.8° |
| C42 | C43 | C44 | 103.5° | 106.6° |
| C43 | C42 | H38 | 109.7° | 110.5° |
| C42 | C43 | H39 | 110.9° | 110.1° |
| C42 | C43 | H40 | 111.0° | 110.0° |
| C44 | C43 | H39 | 110.9° | 110.1° |
| C44 | C43 | H40 | 111.0° | 110.0° |
| C43 | C44 | H41 | 109.9° | 110.0° |
| C43 | C44 | H42 | 109.9° | 110.0° |
| H1 | C1 | H2 | 109.5° | 115.5° |
| H6 | C8 | H7 | 109.5° | 109.5° |
| H8 | C9 | H9 | 109.4° | 109.7° |
| H11 | C12 | H12 | 109.5° | 110.1° |
| H16 | C24 | H17 | 109.5° | 109.5° |
| H18 | C25 | H19 | 109.5° | 109.5° |
| H20 | C26 | H21 | 109.5° | 109.5° |
| H22 | C27 | H23 | 109.5° | 109.5° |
| H24 | C28 | H25 | 109.4° | 109.5° |
| H26 | C29 | H27 | 109.5° | 109.5° |
| H28 | C33 | H29 | 109.5° | 109.4° |
| H30 | C36 | H31 | 109.5° | 109.2° |
| H32 | C37 | H33 | 109.5° | 109.9° |
| H39 | C43 | H40 | 109.5° | 110.0° |
| H41 | C44 | H42 | 109.5° | 110.1° |
| H43 | C45 | H44 | 109.5° | 110.5° |
| H45 | C46 | H46 | 109.5° | 110.7° |
| H48 | C51 | H49 | 109.5° | 115.6° |
| H50 | C52 | H51 | 109.5° | 115.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O50 | S47 | C48 | C51 | 55.9° | 137.1° |
| O50 | S47 | C48 | C52 | 9.4° | 68.5° |
| O50 | S47 | O49 | C48 | 123.2° | 131.5° |
| O50 | S47 | O49 | N7 | 123.4° | 116.8° |
| O50 | S47 | C48 | N7 | 113.9° | 111.6° |
| O50 | S47 | N7 | C6 | 72.6° | 51.0° |
| O50 | S47 | N7 | H5 | 107.5° | 128.9° |
| O50 | S47 | C48 | H47 | 156.6° | 77.1° |
| C52 | C51 | C48 | H48 | 109.5° | 107.5° |
| C52 | C51 | C48 | H49 | 109.5° | 107.5° |
| C51 | C52 | C48 | H50 | 109.5° | 107.5° |
| C51 | C52 | C48 | H51 | 109.5° | 107.5° |
| C51 | C52 | C48 | S47 | 103.8° | 107.5° |
| C52 | C51 | C48 | H47 | 111.3° | 107.5° |
| C52 | C51 | H48 | H49 | 144.7° | 145.7° |
| C51 | C52 | H50 | H51 | 144.8° | 145.7° |
| C51 | C48 | S47 | O49 | 73.4° | 0.4° |
| C51 | C48 | S47 | H47 | 147.5° | 145.7° |
| C51 | C48 | S47 | N7 | 169.8° | 111.3° |
| C48 | C51 | H48 | H49 | 144.7° | 145.7° |
| C52 | C48 | S47 | O49 | 138.8° | 68.3° |
| C52 | C48 | S47 | H47 | 147.2° | 145.6° |
| C52 | C48 | S47 | N7 | 104.5° | 179.9° |
| C48 | C52 | H50 | H51 | 144.7° | 145.7° |
| O49 | S47 | C48 | N7 | 116.8° | 111.6° |
| O49 | S47 | N7 | C6 | 56.8° | 178.9° |
| O49 | S47 | N7 | H5 | 123.1° | 1.0° |
| O49 | S47 | C48 | H47 | 74.1° | 146.1° |
| C48 | S47 | N7 | C6 | 173.7° | 65.0° |
| C48 | S47 | N7 | H5 | 6.2° | 115.0° |
| S47 | C48 | C51 | H48 | 6.0° | 145.0° |
| S47 | C48 | C51 | H49 | 147.0° | 0.0° |
| S47 | C48 | C52 | H50 | 146.7° | 0.0° |
| S47 | C48 | C52 | H51 | 5.6° | 145.0° |
| S47 | N7 | C6 | O5 | 1.1° | 32.0° |
| S47 | N7 | C6 | H5 | 180.0° | 179.9° |
| S47 | N7 | C6 | C2 | 172.5° | 148.0° |
| N7 | S47 | C48 | H47 | 42.7° | 34.5° |
| O5 | C6 | N7 | C2 | 171.4° | 180.0° |
| O5 | C6 | C2 | C1 | 35.3° | 104.6° |
| O5 | C6 | C2 | C3 | 36.3° | 35.7° |
| O5 | C6 | C2 | N4 | 178.9° | 109.4° |
| O5 | C6 | N7 | H5 | 178.9° | 147.9° |
| N7 | C6 | C2 | C1 | 136.3° | 75.4° |
| N7 | C6 | C2 | C3 | 152.1° | 144.3° |
| N7 | C6 | C2 | N4 | 9.5° | 70.6° |
| C6 | C2 | C1 | C3 | 112.5° | 107.8° |
| C6 | C2 | C1 | N4 | 143.7° | 145.8° |
| C6 | C2 | C3 | N4 | 141.6° | 145.0° |
| C6 | C2 | C3 | C8 | 3.7° | 0.1° |
| C6 | C2 | N4 | C14 | 72.1° | 40.2° |
| C6 | C2 | C1 | H1 | 138.0° | 144.7° |
| C6 | C2 | C1 | H2 | 3.1° | 0.2° |
| C6 | C2 | C3 | H3 | 147.4° | 145.1° |
| C6 | C2 | N4 | H4 | 107.9° | 139.8° |
| C2 | C6 | N7 | H5 | 7.5° | 32.1° |
| C2 | C1 | C3 | H1 | 109.4° | 107.5° |
| C2 | C1 | C3 | H2 | 109.4° | 107.5° |
| C1 | C2 | C3 | N4 | 110.0° | 107.2° |
| C1 | C2 | C3 | C8 | 112.1° | 107.7° |
| C1 | C2 | N4 | C14 | 141.6° | 173.5° |
| C2 | C1 | H1 | H2 | 144.8° | 145.7° |
| C2 | C1 | C3 | H3 | 104.3° | 107.8° |
| C1 | C2 | N4 | H4 | 38.4° | 6.5° |
| C1 | C3 | C8 | C29 | 168.8° | 167.7° |
| C1 | C3 | C8 | H3 | 142.6° | 146.0° |
| C3 | C1 | H1 | H2 | 144.8° | 145.7° |
| C1 | C3 | C8 | H6 | 46.2° | 47.8° |
| C1 | C3 | C8 | H7 | 68.6° | 72.3° |
| C2 | C3 | C8 | C29 | 95.0° | 124.0° |
| C2 | C3 | C8 | H3 | 143.6° | 145.8° |
| C3 | C2 | N4 | C14 | 73.5° | 105.5° |
| C3 | C2 | N4 | H4 | 106.5° | 74.5° |
| C2 | C3 | C8 | H6 | 27.5° | 116.0° |
| C2 | C3 | C8 | H7 | 142.4° | 4.0° |
| N4 | C2 | C3 | C8 | 137.9° | 145.2° |
| C2 | N4 | C14 | H4 | 180.0° | 180.0° |
| C2 | N4 | C14 | O15 | 17.6° | 3.3° |
| C2 | N4 | C14 | C11 | 155.9° | 176.7° |
| N4 | C2 | C1 | H1 | 5.7° | 1.0° |
| N4 | C2 | C1 | H2 | 146.8° | 146.0° |
| N4 | C2 | C3 | H3 | 5.8° | 0.1° |
| C29 | C8 | C3 | H6 | 122.6° | 120.0° |
| C29 | C8 | C3 | H7 | 122.6° | 120.0° |
| C8 | C29 | C28 | H26 | 122.5° | 120.0° |
| C8 | C29 | C28 | H27 | 122.5° | 120.0° |
| C8 | C29 | C28 | C27 | 125.3° | 175.7° |
| C29 | C8 | C3 | H3 | 48.6° | 21.8° |
| C29 | C8 | H6 | H7 | 111.2° | 120.0° |
| C8 | C29 | C28 | H24 | 4.5° | 55.7° |
| C8 | C29 | C28 | H25 | 113.9° | 64.3° |
| C8 | C29 | H26 | H27 | 111.3° | 120.0° |
| C3 | C8 | C29 | C28 | 35.7° | 71.6° |
| C8 | C3 | C1 | H1 | 137.6° | 146.0° |
| C8 | C3 | C1 | H2 | 3.5° | 1.0° |
| C3 | C8 | H6 | H7 | 111.2° | 120.1° |
| C3 | C8 | C29 | H26 | 158.2° | 168.4° |
| C3 | C8 | C29 | H27 | 86.9° | 48.4° |
| C29 | C28 | C27 | H24 | 120.8° | 120.0° |
| C29 | C28 | C27 | H25 | 120.8° | 120.0° |
| C29 | C28 | C27 | C26 | 175.7° | 176.7° |
| C28 | C29 | C8 | H6 | 158.3° | 168.4° |
| C28 | C29 | C8 | H7 | 86.9° | 48.4° |
| C29 | C28 | C27 | H22 | 64.5° | 56.7° |
| C29 | C28 | C27 | H23 | 55.8° | 63.3° |
| C29 | C28 | H24 | H25 | 117.5° | 120.0° |
| C28 | C29 | H26 | H27 | 111.4° | 120.1° |
| N4 | C14 | O15 | C11 | 173.9° | 180.0° |
| N4 | C14 | C11 | C12 | 118.4° | 64.1° |
| N4 | C14 | C11 | N10 | 122.3° | 177.0° |
| N4 | C14 | C11 | H10 | 1.7° | 56.9° |
| O15 | C14 | C11 | C12 | 67.6° | 115.9° |
| O15 | C14 | C11 | N10 | 51.7° | 3.0° |
| O15 | C14 | N4 | H4 | 162.4° | 176.7° |
| O15 | C14 | C11 | H10 | 172.3° | 123.1° |
| C14 | C11 | C12 | N10 | 122.8° | 119.7° |
| C14 | C11 | C12 | H10 | 120.1° | 120.6° |
| C14 | C11 | N10 | H10 | 120.1° | 120.0° |
| C14 | C11 | C12 | C13 | 149.4° | 126.5° |
| C14 | C11 | N10 | C17 | 61.7° | 65.0° |
| C14 | C11 | N10 | C9 | 131.5° | 115.0° |
| C11 | C14 | N4 | H4 | 24.1° | 3.3° |
| C14 | C11 | C12 | H11 | 30.5° | 7.3° |
| C14 | C11 | C12 | H12 | 91.8° | 114.3° |
| C28 | C27 | C26 | H22 | 119.9° | 119.9° |
| C28 | C27 | C26 | H23 | 119.9° | 120.0° |
| C28 | C27 | C26 | C25 | 85.7° | 94.3° |
| C28 | C27 | C26 | H20 | 34.4° | 25.6° |
| C28 | C27 | C26 | H21 | 154.1° | 145.7° |
| C28 | C27 | H22 | H23 | 120.4° | 120.0° |
| C27 | C28 | H24 | H25 | 117.5° | 120.0° |
| C27 | C28 | C29 | H26 | 112.2° | 64.3° |
| C27 | C28 | C29 | H27 | 2.8° | 55.8° |
| C27 | C26 | C25 | H20 | 120.1° | 120.0° |
| C27 | C26 | C25 | H21 | 120.2° | 120.0° |
| C27 | C26 | C25 | C24 | 110.7° | 127.4° |
| C27 | C26 | C25 | H18 | 129.2° | 112.7° |
| C27 | C26 | C25 | H19 | 9.4° | 7.3° |
| C27 | C26 | H20 | H21 | 119.6° | 120.0° |
| C26 | C27 | H22 | H23 | 120.4° | 120.1° |
| C26 | C27 | C28 | H24 | 54.9° | 63.3° |
| C26 | C27 | C28 | H25 | 63.5° | 56.7° |
| C12 | C11 | N10 | H10 | 116.5° | 119.9° |
| C11 | C12 | C13 | H11 | 118.9° | 119.3° |
| C11 | C12 | C13 | H12 | 118.9° | 119.2° |
| C12 | C11 | N10 | C17 | 175.0° | 174.9° |
| C12 | C11 | N10 | C9 | 8.2° | 5.1° |
| C11 | C12 | C13 | C9 | 34.8° | 15.4° |
| C11 | C12 | C13 | O16 | 82.5° | 103.5° |
| C11 | C12 | H11 | H12 | 123.2° | 121.6° |
| C11 | C12 | C13 | H13 | 153.2° | 134.2° |
| N10 | C11 | C12 | C13 | 26.6° | 6.9° |
| C11 | N10 | C17 | O19 | 1.6° | 179.9° |
| C11 | N10 | C17 | C9 | 164.9° | 180.0° |
| C11 | N10 | C17 | C18 | 177.5° | 0.3° |
| C11 | N10 | C9 | C13 | 13.7° | 15.1° |
| C11 | N10 | C9 | H8 | 133.0° | 134.7° |
| C11 | N10 | C9 | H9 | 105.4° | 104.6° |
| N10 | C11 | C12 | H11 | 92.3° | 112.4° |
| N10 | C11 | C12 | H12 | 145.5° | 126.0° |
| C12 | C13 | C9 | N10 | 30.3° | 18.8° |
| C12 | C13 | C9 | O16 | 118.4° | 118.9° |
| C12 | C13 | C9 | H13 | 118.4° | 118.8° |
| C12 | C13 | O16 | H13 | 123.4° | 122.3° |
| C12 | C13 | O16 | C30 | 64.3° | 150.0° |
| C12 | C13 | C9 | H8 | 149.5° | 138.4° |
| C12 | C13 | C9 | H9 | 88.9° | 100.9° |
| C13 | C12 | C11 | H10 | 90.5° | 112.8° |
| C13 | C12 | H11 | H12 | 123.2° | 121.5° |
| C26 | C25 | C24 | H18 | 120.1° | 120.0° |
| C26 | C25 | C24 | H19 | 120.1° | 120.1° |
| C26 | C25 | C24 | C18 | 166.6° | 107.2° |
| C26 | C25 | C24 | H16 | 46.7° | 12.8° |
| C26 | C25 | C24 | H17 | 73.6° | 132.8° |
| C26 | C25 | H18 | H19 | 119.7° | 120.0° |
| C25 | C26 | H20 | H21 | 119.6° | 120.1° |
| C25 | C26 | C27 | H22 | 154.4° | 145.7° |
| C25 | C26 | C27 | H23 | 34.1° | 25.6° |
| O19 | C17 | N10 | C18 | 175.9° | 179.7° |
| O19 | C17 | N10 | C9 | 166.6° | 0.1° |
| O19 | C17 | C18 | C24 | 64.4° | 12.0° |
| O19 | C17 | C18 | N20 | 58.0° | 132.0° |
| O19 | C17 | C18 | H14 | 176.6° | 107.9° |
| C17 | N10 | C9 | C13 | 152.8° | 164.9° |
| N10 | C17 | C18 | C24 | 111.7° | 167.6° |
| N10 | C17 | C18 | N20 | 125.9° | 47.7° |
| C17 | N10 | C9 | H8 | 33.6° | 45.2° |
| C17 | N10 | C9 | H9 | 88.0° | 75.5° |
| C17 | N10 | C11 | H10 | 58.5° | 55.0° |
| N10 | C17 | C18 | H14 | 7.3° | 72.4° |
| C9 | N10 | C17 | C18 | 17.5° | 179.8° |
| N10 | C9 | C13 | H8 | 119.2° | 119.7° |
| N10 | C9 | C13 | H9 | 119.2° | 119.7° |
| N10 | C9 | C13 | O16 | 88.1° | 100.1° |
| N10 | C9 | H8 | H9 | 122.4° | 120.7° |
| C9 | N10 | C11 | H10 | 108.3° | 124.9° |
| N10 | C9 | C13 | H13 | 148.7° | 137.6° |
| C25 | C24 | C18 | C17 | 61.5° | 177.9° |
| C25 | C24 | C18 | H16 | 119.8° | 120.0° |
| C25 | C24 | C18 | H17 | 119.8° | 120.0° |
| C25 | C24 | C18 | N20 | 176.6° | 58.0° |
| C25 | C24 | C18 | H14 | 57.5° | 62.1° |
| C25 | C24 | H16 | H17 | 120.4° | 120.0° |
| C24 | C25 | H18 | H19 | 119.7° | 120.0° |
| C24 | C25 | C26 | H20 | 9.4° | 7.4° |
| C24 | C25 | C26 | H21 | 129.1° | 112.6° |
| C17 | C18 | C24 | N20 | 121.8° | 120.0° |
| C17 | C18 | C24 | H14 | 119.1° | 120.0° |
| C17 | C18 | N20 | H14 | 118.0° | 120.1° |
| C17 | C18 | N20 | C21 | 78.1° | 109.9° |
| C17 | C18 | N20 | H15 | 101.9° | 70.0° |
| C17 | C18 | C24 | H16 | 58.3° | 57.9° |
| C17 | C18 | C24 | H17 | 178.6° | 62.0° |
| C9 | C13 | O16 | H13 | 122.2° | 122.3° |
| C9 | C13 | O16 | C30 | 178.7° | 94.6° |
| C13 | C9 | H8 | H9 | 122.3° | 120.7° |
| C9 | C13 | C12 | H11 | 84.1° | 103.9° |
| C9 | C13 | C12 | H12 | 153.7° | 134.5° |
| C13 | O16 | C30 | O32 | 27.9° | 0.0° |
| C13 | O16 | C30 | N31 | 172.3° | 179.9° |
| O16 | C13 | C9 | H8 | 31.1° | 19.6° |
| O16 | C13 | C9 | H9 | 152.7° | 140.2° |
| O16 | C13 | C12 | H11 | 158.6° | 137.2° |
| O16 | C13 | C12 | H12 | 36.4° | 15.7° |
| O32 | C30 | O16 | N31 | 159.9° | 180.0° |
| O32 | C30 | N31 | C33 | 5.3° | 180.0° |
| O32 | C30 | N31 | C37 | 151.0° | 0.2° |
| O16 | C30 | N31 | C33 | 165.4° | 0.0° |
| O16 | C30 | N31 | C37 | 9.1° | 179.7° |
| C30 | O16 | C13 | H13 | 59.1° | 27.7° |
| C30 | N31 | C33 | C37 | 158.0° | 179.7° |
| C30 | N31 | C33 | C34 | 176.7° | 135.6° |
| C30 | N31 | C37 | C36 | 137.1° | 115.8° |
| C30 | N31 | C33 | H28 | 62.5° | 15.6° |
| C30 | N31 | C33 | H29 | 55.9° | 104.3° |
| C30 | N31 | C37 | H32 | 17.5° | 124.7° |
| C30 | N31 | C37 | H33 | 103.2° | 3.8° |
| C24 | C18 | N20 | H14 | 118.5° | 120.1° |
| C24 | C18 | N20 | C21 | 158.4° | 130.2° |
| C24 | C18 | N20 | H15 | 21.6° | 49.8° |
| C18 | C24 | H16 | H17 | 120.5° | 120.0° |
| C18 | C24 | C25 | H18 | 73.3° | 132.8° |
| C18 | C24 | C25 | H19 | 46.5° | 12.9° |
| N31 | C33 | C34 | H28 | 120.8° | 120.0° |
| N31 | C33 | C34 | H29 | 120.8° | 120.1° |
| C33 | N31 | C37 | C36 | 64.4° | 64.5° |
| N31 | C33 | C34 | C35 | 7.8° | 11.5° |
| N31 | C33 | C34 | C38 | 172.9° | 168.6° |
| N31 | C33 | H28 | H29 | 117.5° | 119.9° |
| C33 | N31 | C37 | H32 | 176.0° | 55.1° |
| C33 | N31 | C37 | H33 | 55.3° | 175.9° |
| C37 | N31 | C33 | C34 | 25.3° | 44.7° |
| N31 | C37 | C36 | H32 | 119.7° | 119.5° |
| N31 | C37 | C36 | H33 | 119.6° | 119.5° |
| N31 | C37 | C36 | C35 | 69.1° | 47.7° |
| C37 | N31 | C33 | H28 | 95.5° | 164.7° |
| C37 | N31 | C33 | H29 | 146.1° | 75.4° |
| N31 | C37 | C36 | H30 | 50.5° | 72.9° |
| N31 | C37 | C36 | H31 | 171.3° | 167.9° |
| N31 | C37 | H32 | H33 | 121.0° | 120.8° |
| C18 | N20 | C21 | H15 | 180.0° | 179.9° |
| C18 | N20 | C21 | O22 | 17.1° | 64.6° |
| C18 | N20 | C21 | O23 | 168.0° | 115.6° |
| N20 | C18 | C24 | H16 | 63.5° | 62.0° |
| N20 | C18 | C24 | H17 | 56.8° | 178.0° |
| C33 | C34 | C35 | C36 | 0.6° | 1.4° |
| C33 | C34 | C35 | C38 | 179.3° | 179.9° |
| C33 | C34 | C35 | C41 | 179.6° | 179.2° |
| C33 | C34 | C38 | C39 | 179.9° | 179.6° |
| C34 | C33 | H28 | H29 | 117.6° | 119.9° |
| C33 | C34 | C38 | H34 | 0.1° | 0.5° |
| C37 | C36 | C35 | H30 | 119.6° | 120.4° |
| C37 | C36 | C35 | H31 | 119.6° | 120.2° |
| C37 | C36 | C35 | C34 | 36.6° | 20.3° |
| C37 | C36 | C35 | C41 | 142.3° | 160.4° |
| C37 | C36 | H30 | H31 | 121.2° | 119.3° |
| C36 | C37 | H32 | H33 | 121.1° | 121.0° |
| C36 | C35 | C34 | C41 | 178.9° | 179.3° |
| C36 | C35 | C34 | C38 | 180.0° | 178.7° |
| C36 | C35 | C41 | C40 | 179.7° | 178.9° |
| C35 | C36 | H30 | H31 | 121.2° | 119.3° |
| C35 | C36 | C37 | H32 | 171.2° | 71.8° |
| C35 | C36 | C37 | H33 | 50.5° | 167.2° |
| C36 | C35 | C41 | H37 | 0.3° | 1.2° |
| C35 | C34 | C38 | C39 | 0.7° | 0.3° |
| C34 | C35 | C41 | C40 | 0.8° | 0.5° |
| C35 | C34 | C33 | H28 | 128.6° | 131.6° |
| C35 | C34 | C33 | H29 | 113.0° | 108.6° |
| C34 | C35 | C36 | H30 | 83.0° | 100.1° |
| C34 | C35 | C36 | H31 | 156.2° | 140.5° |
| C35 | C34 | C38 | H34 | 179.3° | 179.6° |
| C34 | C35 | C41 | H37 | 179.2° | 179.5° |
| C38 | C34 | C35 | C41 | 1.1° | 0.6° |
| C34 | C38 | C39 | H34 | 180.0° | 179.9° |
| C34 | C38 | C39 | C40 | 0.1° | 0.1° |
| C38 | C34 | C33 | H28 | 52.1° | 48.6° |
| C38 | C34 | C33 | H29 | 66.4° | 71.3° |
| C34 | C38 | C39 | H35 | 179.9° | 179.9° |
| N20 | C21 | O22 | O23 | 174.3° | 179.8° |
| N20 | C21 | O23 | C42 | 171.6° | 111.4° |
| C21 | N20 | C18 | H14 | 39.9° | 10.2° |
| C35 | C41 | C40 | H37 | 180.0° | 180.0° |
| C35 | C41 | C40 | C39 | 0.1° | 0.0° |
| C41 | C35 | C36 | H30 | 98.1° | 79.2° |
| C41 | C35 | C36 | H31 | 22.7° | 40.1° |
| C35 | C41 | C40 | H36 | 179.9° | 179.9° |
| C38 | C39 | C40 | C41 | 0.2° | 0.3° |
| C38 | C39 | C40 | H35 | 180.0° | 180.0° |
| C38 | C39 | C40 | H36 | 179.8° | 179.7° |
| O22 | C21 | O23 | C42 | 3.2° | 68.8° |
| O22 | C21 | N20 | H15 | 162.9° | 115.3° |
| C21 | O23 | C42 | C46 | 83.4° | 26.7° |
| C21 | O23 | C42 | C43 | 160.2° | 88.0° |
| O23 | C21 | N20 | H15 | 12.0° | 64.4° |
| C21 | O23 | C42 | H38 | 38.3° | 149.4° |
| C41 | C40 | C39 | H36 | 180.0° | 180.0° |
| C41 | C40 | C39 | H35 | 179.8° | 179.7° |
| C40 | C39 | C38 | H34 | 179.9° | 179.9° |
| C39 | C40 | C41 | H37 | 179.9° | 179.9° |
| O23 | C42 | C46 | C45 | 85.9° | 156.7° |
| O23 | C42 | C46 | C43 | 119.1° | 118.7° |
| O23 | C42 | C46 | H38 | 122.7° | 122.5° |
| O23 | C42 | C43 | H38 | 122.8° | 122.5° |
| O23 | C42 | C43 | C44 | 84.8° | 142.3° |
| O23 | C42 | C43 | H39 | 34.3° | 22.9° |
| O23 | C42 | C43 | H40 | 156.2° | 98.5° |
| O23 | C42 | C46 | H45 | 33.2° | 85.1° |
| O23 | C42 | C46 | H46 | 154.9° | 38.2° |
| C46 | C45 | C44 | H43 | 119.6° | 118.7° |
| C46 | C45 | C44 | H44 | 119.6° | 118.7° |
| C45 | C46 | C42 | H45 | 119.2° | 118.3° |
| C45 | C46 | C42 | H46 | 119.1° | 118.5° |
| C45 | C46 | C42 | C43 | 33.2° | 38.0° |
| C46 | C45 | C44 | C43 | 2.1° | 23.6° |
| C45 | C46 | C42 | H38 | 151.4° | 80.8° |
| C46 | C45 | C44 | H41 | 121.7° | 142.9° |
| C46 | C45 | C44 | H42 | 117.6° | 95.6° |
| C46 | C45 | H43 | H44 | 121.2° | 122.6° |
| C45 | C46 | H45 | H46 | 122.4° | 123.5° |
| C44 | C45 | C46 | C42 | 18.9° | 38.0° |
| C45 | C44 | C43 | C42 | 22.1° | 0.0° |
| C45 | C44 | C43 | H41 | 119.7° | 119.3° |
| C45 | C44 | C43 | H42 | 119.7° | 119.3° |
| C45 | C44 | C43 | H39 | 141.2° | 119.3° |
| C45 | C44 | C43 | H40 | 96.9° | 119.3° |
| C45 | C44 | H41 | H42 | 120.9° | 121.5° |
| C44 | C45 | H43 | H44 | 121.3° | 122.6° |
| C44 | C45 | C46 | H45 | 138.0° | 156.3° |
| C44 | C45 | C46 | H46 | 100.3° | 80.4° |
| C46 | C42 | C43 | H38 | 118.2° | 118.8° |
| C46 | C42 | C43 | C44 | 34.2° | 23.6° |
| C46 | C42 | C43 | H39 | 153.3° | 95.7° |
| C46 | C42 | C43 | H40 | 84.8° | 142.9° |
| C42 | C46 | C45 | H43 | 138.5° | 80.8° |
| C42 | C46 | C45 | H44 | 100.7° | 156.6° |
| C42 | C46 | H45 | H46 | 122.4° | 123.3° |
| C42 | C43 | C44 | H39 | 119.0° | 119.4° |
| C42 | C43 | C44 | H40 | 119.0° | 119.3° |
| C42 | C43 | H39 | H40 | 122.8° | 121.4° |
| C42 | C43 | C44 | H41 | 141.8° | 119.3° |
| C42 | C43 | C44 | H42 | 97.6° | 119.3° |
| C43 | C42 | C46 | H45 | 152.3° | 156.2° |
| C43 | C42 | C46 | H46 | 86.0° | 80.5° |
| C44 | C43 | C42 | H38 | 152.4° | 95.2° |
| C44 | C43 | H39 | H40 | 122.8° | 121.4° |
| C43 | C44 | H41 | H42 | 120.8° | 121.4° |
| C43 | C44 | C45 | H43 | 117.5° | 95.1° |
| C43 | C44 | C45 | H44 | 121.6° | 142.3° |
| H1 | C1 | C3 | H3 | 5.1° | 0.4° |
| H2 | C1 | C3 | H3 | 146.2° | 144.6° |
| H3 | C3 | C8 | H6 | 171.2° | 98.2° |
| H3 | C3 | C8 | H7 | 74.0° | 141.8° |
| H6 | C8 | C29 | H26 | 79.2° | 48.4° |
| H6 | C8 | C29 | H27 | 35.7° | 71.6° |
| H7 | C8 | C29 | H26 | 35.6° | 71.6° |
| H7 | C8 | C29 | H27 | 150.5° | 168.4° |
| H8 | C9 | C13 | H13 | 92.0° | 102.8° |
| H9 | C9 | C13 | H13 | 29.5° | 17.9° |
| H10 | C11 | C12 | H11 | 150.6° | 127.9° |
| H10 | C11 | C12 | H12 | 28.4° | 6.3° |
| H11 | C12 | C13 | H13 | 34.3° | 14.9° |
| H12 | C12 | C13 | H13 | 88.0° | 106.6° |
| H14 | C18 | N20 | H15 | 140.1° | 169.9° |
| H14 | C18 | C24 | H16 | 177.4° | 177.9° |
| H14 | C18 | C24 | H17 | 62.3° | 57.9° |
| H16 | C24 | C25 | H18 | 166.8° | 107.2° |
| H16 | C24 | C25 | H19 | 73.4° | 132.9° |
| H17 | C24 | C25 | H18 | 46.5° | 12.8° |
| H17 | C24 | C25 | H19 | 166.3° | 107.1° |
| H18 | C25 | C26 | H20 | 110.7° | 127.4° |
| H18 | C25 | C26 | H21 | 9.0° | 7.3° |
| H19 | C25 | C26 | H20 | 129.5° | 112.6° |
| H19 | C25 | C26 | H21 | 110.8° | 127.3° |
| H20 | C26 | C27 | H22 | 85.5° | 94.3° |
| H20 | C26 | C27 | H23 | 154.3° | 145.6° |
| H21 | C26 | C27 | H22 | 34.3° | 25.7° |
| H21 | C26 | C27 | H23 | 86.0° | 94.4° |
| H22 | C27 | C28 | H24 | 174.7° | 176.7° |
| H22 | C27 | C28 | H25 | 56.3° | 63.3° |
| H23 | C27 | C28 | H24 | 65.0° | 56.7° |
| H23 | C27 | C28 | H25 | 176.6° | 176.7° |
| H24 | C28 | C29 | H26 | 127.0° | 175.7° |
| H24 | C28 | C29 | H27 | 118.0° | 64.3° |
| H25 | C28 | C29 | H26 | 8.6° | 55.7° |
| H25 | C28 | C29 | H27 | 123.6° | 175.7° |
| H30 | C36 | C37 | H32 | 69.2° | 167.6° |
| H30 | C36 | C37 | H33 | 170.1° | 46.6° |
| H31 | C36 | C37 | H32 | 51.7° | 48.4° |
| H31 | C36 | C37 | H33 | 69.0° | 72.6° |
| H34 | C38 | C39 | H35 | 0.1° | 0.1° |
| H35 | C39 | C40 | H36 | 0.2° | 0.2° |
| H36 | C40 | C41 | H37 | 0.1° | 0.1° |
| H38 | C42 | C43 | H39 | 88.5° | 145.5° |
| H38 | C42 | C43 | H40 | 33.4° | 24.1° |
| H38 | C42 | C46 | H45 | 89.4° | 37.5° |
| H38 | C42 | C46 | H46 | 32.3° | 160.7° |
| H39 | C43 | C44 | H41 | 99.1° | 121.4° |
| H39 | C43 | C44 | H42 | 21.4° | 0.1° |
| H40 | C43 | C44 | H41 | 22.8° | 0.0° |
| H40 | C43 | C44 | H42 | 143.4° | 121.5° |
| H41 | C44 | C45 | H43 | 2.2° | 24.2° |
| H41 | C44 | C45 | H44 | 118.7° | 98.4° |
| H42 | C44 | C45 | H43 | 122.8° | 145.7° |
| H42 | C44 | C45 | H44 | 1.9° | 23.1° |
| H43 | C45 | C46 | H45 | 102.4° | 37.5° |
| H43 | C45 | C46 | H46 | 19.3° | 160.9° |
| H44 | C45 | C46 | H45 | 18.4° | 85.1° |
| H44 | C45 | C46 | H46 | 140.1° | 38.3° |
| H47 | C48 | C51 | H48 | 139.1° | 0.0° |
| H47 | C48 | C51 | H49 | 1.8° | 145.1° |
| H47 | C48 | C52 | H50 | 1.9° | 144.9° |
| H47 | C48 | C52 | H51 | 139.2° | 0.1° |
| H48 | C51 | C52 | H50 | 141.1° | 145.0° |
| H48 | C51 | C52 | H51 | 0.0° | 0.0° |
| H49 | C51 | C52 | H50 | 0.1° | 0.0° |
| H49 | C51 | C52 | H51 | 141.0° | 145.0° |
