ITL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | C8 | sing | 1.54Å | 1.53Å | |
| C14 | C8 | sing | 1.52Å | 1.53Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | C5 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C5 | C6 | sing | 1.56Å | 1.53Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| O6 | C34 | doub | 1.21Å | 1.25Å | |
| C27 | N1 | sing | 1.47Å | 1.47Å | |
| N1 | C26 | sing | 1.47Å | 1.47Å | |
| N1 | C33 | sing | 1.47Å | 1.47Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C37 | N3 | sing | 1.47Å | 1.47Å | |
| C30 | N3 | sing | 1.47Å | 1.47Å | |
| N3 | C31 | sing | 1.47Å | 1.47Å | |
| C3 | C4 | sing | 1.48Å | 1.53Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C24 | O1 | sing | 1.34Å | 1.25Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| O2 | C24 | doub | 1.21Å | 1.25Å | |
| C24 | C23 | sing | 1.51Å | 1.53Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C22 | C20 | sing | 1.53Å | 1.53Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | C17 | sing | 1.53Å | 1.53Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C21 | H21B | sing | 1.09Å | 1.10Å | |
| C17 | C13 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.55Å | 1.53Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | C15 | sing | 1.55Å | 1.53Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.55Å | 1.52Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | C13 | sing | 1.52Å | 1.53Å | |
| C18 | C13 | sing | 1.53Å | 1.53Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| C12 | C11 | sing | 1.54Å | 1.53Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C11 | C9 | sing | 1.53Å | 1.53Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C1 | C10 | sing | 1.53Å | 1.53Å | |
| C19 | C10 | sing | 1.53Å | 1.53Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C3 | N4 | sing | 1.46Å | 1.47Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C41 | N4 | sing | 1.35Å | 1.33Å | |
| N4 | HN4 | sing | 0.97Å | 1.00Å | |
| O | C41 | doub | 1.21Å | 1.23Å | |
| C41 | C40 | sing | 1.51Å | 1.53Å | |
| C40 | C39 | sing | 1.53Å | 1.53Å | |
| C40 | H40 | sing | 1.09Å | 1.10Å | |
| C40 | H40A | sing | 1.09Å | 1.10Å | |
| C39 | C35 | sing | 1.53Å | 1.53Å | |
| C39 | H39 | sing | 1.09Å | 1.10Å | |
| C39 | H39A | sing | 1.09Å | 1.10Å | |
| C35 | C36 | sing | 1.51Å | 1.53Å | |
| C35 | N2 | sing | 1.47Å | 1.47Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| O9 | C36 | doub | 1.21Å | 1.25Å | |
| C36 | O8 | sing | 1.34Å | 1.25Å | |
| O8 | HO8 | sing | 0.97Å | 0.95Å | |
| C29 | N2 | sing | 1.47Å | 1.47Å | |
| N2 | C28 | sing | 1.47Å | 1.47Å | |
| C29 | C30 | sing | 1.53Å | 1.53Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C38 | C37 | sing | 1.51Å | 1.53Å | |
| C37 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H37A | sing | 1.09Å | 1.10Å | |
| O11 | C38 | doub | 1.21Å | 1.25Å | |
| C38 | O10 | sing | 1.34Å | 1.25Å | |
| O10 | HO10 | sing | 0.97Å | 0.95Å | |
| C31 | C32 | sing | 1.51Å | 1.53Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| O4 | C32 | doub | 1.21Å | 1.25Å | |
| C32 | O13 | sing | 1.34Å | 1.25Å | |
| O13 | HO13 | sing | 0.97Å | 0.95Å | |
| C28 | C27 | sing | 1.53Å | 1.53Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C33 | C34 | sing | 1.51Å | 1.53Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C34 | O7 | sing | 1.34Å | 1.25Å | |
| O7 | HO7 | sing | 0.97Å | 0.95Å | |
| C26 | C25 | sing | 1.51Å | 1.53Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C25 | O3 | doub | 1.21Å | 1.25Å | |
| C25 | O12 | sing | 1.34Å | 1.25Å | |
| O12 | HO12 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C9 | C8 | C14 | 109.3° | 108.1° |
| C9 | C8 | C7 | 111.0° | 109.2° |
| C9 | C8 | H8 | 109.4° | 109.7° |
| C8 | C9 | C11 | 111.4° | 111.5° |
| C8 | C9 | C10 | 110.6° | 110.6° |
| C8 | C9 | H9 | 107.8° | 107.5° |
| C14 | C8 | C7 | 111.8° | 110.4° |
| C14 | C8 | H8 | 108.5° | 109.7° |
| C8 | C14 | C15 | 115.0° | 115.9° |
| C8 | C14 | C13 | 109.3° | 107.0° |
| C8 | C14 | H14 | 103.1° | 110.3° |
| C7 | C8 | H8 | 106.7° | 109.7° |
| C8 | C7 | C6 | 110.3° | 109.5° |
| C8 | C7 | H7 | 109.2° | 109.5° |
| C8 | C7 | H7A | 109.0° | 109.5° |
| C10 | C5 | C4 | 110.8° | 107.9° |
| C10 | C5 | C6 | 110.4° | 109.8° |
| C10 | C5 | H5 | 107.8° | 110.7° |
| C5 | C10 | C9 | 109.4° | 109.3° |
| C5 | C10 | C1 | 109.6° | 109.4° |
| C5 | C10 | C19 | 109.6° | 109.5° |
| C4 | C5 | C6 | 109.2° | 109.4° |
| C4 | C5 | H5 | 109.0° | 109.5° |
| C5 | C4 | C3 | 109.7° | 112.4° |
| C5 | C4 | H4 | 109.4° | 109.4° |
| C5 | C4 | H4A | 109.3° | 109.5° |
| C6 | C5 | H5 | 109.5° | 109.5° |
| C5 | C6 | C7 | 110.5° | 109.9° |
| C5 | C6 | H6 | 109.1° | 109.5° |
| C5 | C6 | H6A | 108.9° | 109.5° |
| C7 | C6 | H6 | 109.1° | 109.3° |
| C7 | C6 | H6A | 108.9° | 109.3° |
| C6 | C7 | H7 | 109.2° | 109.5° |
| C6 | C7 | H7A | 109.0° | 109.4° |
| H6 | C6 | H6A | 110.3° | 109.5° |
| O6 | C34 | C33 | 116.2° | 120.0° |
| O6 | C34 | O7 | 126.4° | 120.0° |
| C27 | N1 | C26 | 109.2° | 111.0° |
| C27 | N1 | C33 | 109.0° | 111.0° |
| N1 | C27 | C28 | 110.2° | 109.4° |
| N1 | C27 | H27 | 109.2° | 109.5° |
| N1 | C27 | H27A | 109.1° | 109.4° |
| C26 | N1 | C33 | 108.6° | 111.0° |
| N1 | C26 | C25 | 108.2° | 109.5° |
| N1 | C26 | H26 | 109.9° | 109.5° |
| N1 | C26 | H26A | 110.2° | 109.4° |
| N1 | C33 | C34 | 108.7° | 109.5° |
| N1 | C33 | H33 | 109.7° | 109.5° |
| N1 | C33 | H33A | 109.9° | 109.5° |
| C1 | C2 | C3 | 110.0° | 109.5° |
| C1 | C2 | H2 | 109.3° | 109.9° |
| C1 | C2 | H2A | 109.2° | 109.1° |
| C2 | C1 | C10 | 110.4° | 109.4° |
| C2 | C1 | H1 | 109.1° | 109.5° |
| C2 | C1 | H1A | 108.9° | 109.5° |
| C3 | C2 | H2 | 109.3° | 109.5° |
| C3 | C2 | H2A | 109.2° | 109.4° |
| C2 | C3 | C4 | 109.2° | 108.8° |
| C2 | C3 | N4 | 108.7° | 109.4° |
| C2 | C3 | H3 | 110.1° | 109.5° |
| H2 | C2 | H2A | 109.9° | 109.5° |
| C37 | N3 | C30 | 109.7° | 111.0° |
| C37 | N3 | C31 | 109.5° | 111.0° |
| N3 | C37 | C38 | 108.1° | 109.5° |
| N3 | C37 | H37 | 110.0° | 109.4° |
| N3 | C37 | H37A | 110.2° | 109.4° |
| C30 | N3 | C31 | 111.8° | 111.0° |
| N3 | C30 | C29 | 107.7° | 109.4° |
| N3 | C30 | H30 | 110.1° | 109.5° |
| N3 | C30 | H30A | 110.4° | 109.5° |
| N3 | C31 | C32 | 106.5° | 109.5° |
| N3 | C31 | H31 | 110.4° | 109.5° |
| N3 | C31 | H31A | 111.1° | 109.5° |
| C3 | C4 | H4 | 109.4° | 107.7° |
| C3 | C4 | H4A | 109.4° | 108.3° |
| C4 | C3 | N4 | 109.0° | 109.9° |
| C4 | C3 | H3 | 109.8° | 109.8° |
| H4 | C4 | H4A | 109.6° | 109.5° |
| C24 | O1 | HO1 | 109.5° | 117.0° |
| O1 | C24 | O2 | 126.2° | 120.0° |
| O1 | C24 | C23 | 116.8° | 120.0° |
| O2 | C24 | C23 | 117.0° | 120.0° |
| C24 | C23 | C22 | 110.6° | 109.5° |
| C24 | C23 | H23 | 109.1° | 109.4° |
| C24 | C23 | H23A | 108.8° | 109.5° |
| C22 | C23 | H23 | 109.1° | 109.5° |
| C22 | C23 | H23A | 108.8° | 109.5° |
| C23 | C22 | C20 | 110.9° | 109.5° |
| C23 | C22 | H22 | 109.0° | 109.5° |
| C23 | C22 | H22A | 108.7° | 109.5° |
| H23 | C23 | H23A | 110.4° | 109.5° |
| C20 | C22 | H22 | 109.0° | 109.4° |
| C20 | C22 | H22A | 108.7° | 109.4° |
| C22 | C20 | C21 | 110.3° | 109.5° |
| C22 | C20 | C17 | 110.6° | 109.5° |
| C22 | C20 | H20 | 108.5° | 109.5° |
| H22 | C22 | H22A | 110.6° | 109.4° |
| C21 | C20 | C17 | 110.5° | 109.4° |
| C21 | C20 | H20 | 108.6° | 109.4° |
| C20 | C21 | H21 | 109.5° | 109.5° |
| C20 | C21 | H21A | 109.5° | 109.5° |
| C20 | C21 | H21B | 109.5° | 109.5° |
| C17 | C20 | H20 | 108.3° | 109.4° |
| C20 | C17 | C13 | 113.7° | 110.3° |
| C20 | C17 | C16 | 114.2° | 110.2° |
| C20 | C17 | H17 | 101.4° | 110.2° |
| H21 | C21 | H21A | 109.4° | 109.4° |
| H21 | C21 | H21B | 109.5° | 109.5° |
| H21A | C21 | H21B | 109.5° | 109.5° |
| C13 | C17 | C16 | 103.3° | 105.3° |
| C13 | C17 | H17 | 112.6° | 110.3° |
| C17 | C13 | C14 | 99.3° | 103.3° |
| C17 | C13 | C12 | 115.0° | 116.6° |
| C17 | C13 | C18 | 110.4° | 109.7° |
| C16 | C17 | H17 | 112.1° | 110.4° |
| C17 | C16 | C15 | 105.3° | 106.4° |
| C17 | C16 | H16 | 110.9° | 110.0° |
| C17 | C16 | H16A | 111.8° | 110.1° |
| C15 | C16 | H16 | 110.9° | 110.1° |
| C15 | C16 | H16A | 111.8° | 110.1° |
| C16 | C15 | C14 | 102.4° | 102.9° |
| C16 | C15 | H15 | 111.9° | 110.7° |
| C16 | C15 | H15A | 113.4° | 110.7° |
| H16 | C16 | H16A | 106.3° | 110.1° |
| C14 | C15 | H15 | 111.9° | 110.7° |
| C14 | C15 | H15A | 113.3° | 110.9° |
| C15 | C14 | C13 | 98.9° | 101.7° |
| C15 | C14 | H14 | 112.9° | 110.4° |
| H15 | C15 | H15A | 104.2° | 110.6° |
| C13 | C14 | H14 | 118.2° | 111.2° |
| C14 | C13 | C12 | 109.6° | 107.5° |
| C14 | C13 | C18 | 112.1° | 109.7° |
| C12 | C13 | C18 | 110.1° | 109.7° |
| C13 | C12 | C11 | 107.9° | 107.3° |
| C13 | C12 | H12 | 110.0° | 109.9° |
| C13 | C12 | H12A | 110.4° | 109.9° |
| C13 | C18 | H18 | 109.5° | 109.5° |
| C13 | C18 | H18A | 109.5° | 109.4° |
| C13 | C18 | H18B | 109.4° | 109.5° |
| H18 | C18 | H18A | 109.5° | 109.4° |
| H18 | C18 | H18B | 109.5° | 109.5° |
| H18A | C18 | H18B | 109.5° | 109.5° |
| C11 | C12 | H12 | 110.0° | 109.9° |
| C11 | C12 | H12A | 110.4° | 109.9° |
| C12 | C11 | C9 | 111.8° | 112.2° |
| C12 | C11 | H11 | 108.7° | 109.1° |
| C12 | C11 | H11A | 108.2° | 109.1° |
| H12 | C12 | H12A | 108.2° | 109.9° |
| C9 | C11 | H11 | 108.7° | 108.3° |
| C9 | C11 | H11A | 108.2° | 109.2° |
| C11 | C9 | C10 | 110.7° | 110.0° |
| C11 | C9 | H9 | 107.6° | 108.9° |
| H11 | C11 | H11A | 111.3° | 109.0° |
| C10 | C9 | H9 | 108.5° | 108.2° |
| C9 | C10 | C1 | 109.2° | 109.4° |
| C9 | C10 | C19 | 109.8° | 109.5° |
| H7 | C7 | H7A | 110.2° | 109.5° |
| C1 | C10 | C19 | 109.4° | 109.7° |
| C10 | C1 | H1 | 109.1° | 109.5° |
| C10 | C1 | H1A | 108.9° | 109.4° |
| C10 | C19 | H19 | 109.5° | 109.5° |
| C10 | C19 | H19A | 109.5° | 109.5° |
| C10 | C19 | H19B | 109.4° | 109.5° |
| H19 | C19 | H19A | 109.4° | 109.5° |
| H19 | C19 | H19B | 109.5° | 109.4° |
| H19A | C19 | H19B | 109.5° | 109.5° |
| H1 | C1 | H1A | 110.2° | 109.5° |
| N4 | C3 | H3 | 110.2° | 109.5° |
| C3 | N4 | C41 | 122.6° | 120.0° |
| C3 | N4 | HN4 | 118.7° | 120.0° |
| C41 | N4 | HN4 | 118.7° | 120.0° |
| N4 | C41 | O | 123.9° | 120.0° |
| N4 | C41 | C40 | 114.6° | 120.0° |
| O | C41 | C40 | 121.5° | 120.0° |
| C41 | C40 | C39 | 111.0° | 109.5° |
| C41 | C40 | H40 | 109.0° | 109.5° |
| C41 | C40 | H40A | 108.6° | 109.5° |
| C39 | C40 | H40 | 108.9° | 109.5° |
| C39 | C40 | H40A | 108.6° | 109.4° |
| C40 | C39 | C35 | 111.3° | 109.5° |
| C40 | C39 | H39 | 108.9° | 109.5° |
| C40 | C39 | H39A | 108.5° | 109.5° |
| H40 | C40 | H40A | 110.7° | 109.5° |
| C35 | C39 | H39 | 108.9° | 109.5° |
| C35 | C39 | H39A | 108.4° | 109.5° |
| C39 | C35 | C36 | 110.6° | 109.4° |
| C39 | C35 | N2 | 111.2° | 109.5° |
| C39 | C35 | H35 | 107.3° | 109.5° |
| H39 | C39 | H39A | 110.9° | 109.5° |
| C36 | C35 | N2 | 109.1° | 109.5° |
| C36 | C35 | H35 | 109.5° | 109.5° |
| C35 | C36 | O9 | 117.4° | 120.0° |
| C35 | C36 | O8 | 116.5° | 120.0° |
| N2 | C35 | H35 | 108.9° | 109.5° |
| C35 | N2 | C29 | 109.3° | 111.0° |
| C35 | N2 | C28 | 110.3° | 111.1° |
| O9 | C36 | O8 | 126.1° | 120.0° |
| C36 | O8 | HO8 | 109.5° | 117.0° |
| C29 | N2 | C28 | 108.4° | 111.0° |
| N2 | C29 | C30 | 108.3° | 109.5° |
| N2 | C29 | H29 | 109.9° | 109.5° |
| N2 | C29 | H29A | 110.1° | 109.5° |
| N2 | C28 | C27 | 110.5° | 109.5° |
| N2 | C28 | H28 | 109.1° | 109.5° |
| N2 | C28 | H28A | 108.9° | 109.4° |
| C30 | C29 | H29 | 109.9° | 109.5° |
| C30 | C29 | H29A | 110.2° | 109.5° |
| C29 | C30 | H30 | 110.0° | 109.4° |
| C29 | C30 | H30A | 110.5° | 109.5° |
| H29 | C29 | H29A | 108.5° | 109.5° |
| H30 | C30 | H30A | 108.1° | 109.5° |
| C38 | C37 | H37 | 109.9° | 109.4° |
| C38 | C37 | H37A | 110.2° | 109.5° |
| C37 | C38 | O11 | 117.6° | 120.0° |
| C37 | C38 | O10 | 116.2° | 120.0° |
| H37 | C37 | H37A | 108.4° | 109.5° |
| O11 | C38 | O10 | 126.1° | 120.0° |
| C38 | O10 | HO10 | 109.5° | 117.0° |
| C32 | C31 | H31 | 110.4° | 109.5° |
| C32 | C31 | H31A | 111.1° | 109.4° |
| C31 | C32 | O4 | 116.1° | 120.0° |
| C31 | C32 | O13 | 117.8° | 120.0° |
| H31 | C31 | H31A | 107.3° | 109.5° |
| O4 | C32 | O13 | 126.1° | 120.0° |
| C32 | O13 | HO13 | 109.5° | 117.1° |
| C27 | C28 | H28 | 109.1° | 109.5° |
| C27 | C28 | H28A | 108.9° | 109.5° |
| C28 | C27 | H27 | 109.2° | 109.5° |
| C28 | C27 | H27A | 109.0° | 109.5° |
| H28 | C28 | H28A | 110.3° | 109.4° |
| H27 | C27 | H27A | 110.0° | 109.5° |
| C34 | C33 | H33 | 109.8° | 109.5° |
| C34 | C33 | H33A | 109.9° | 109.4° |
| C33 | C34 | O7 | 117.4° | 120.0° |
| H33 | C33 | H33A | 108.8° | 109.5° |
| C34 | O7 | HO7 | 109.5° | 117.0° |
| C25 | C26 | H26 | 109.9° | 109.5° |
| C25 | C26 | H26A | 110.2° | 109.5° |
| C26 | C25 | O3 | 116.5° | 120.0° |
| C26 | C25 | O12 | 117.6° | 120.0° |
| H26 | C26 | H26A | 108.5° | 109.5° |
| O3 | C25 | O12 | 125.9° | 119.9° |
| C25 | O12 | HO12 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C9 | C8 | C14 | C7 | 123.3° | 119.3° |
| C9 | C8 | C14 | H8 | 119.2° | 119.6° |
| C9 | C8 | C7 | H8 | 119.1° | 120.3° |
| C8 | C9 | C10 | C5 | 58.3° | 59.8° |
| C9 | C8 | C7 | C6 | 56.1° | 60.3° |
| C9 | C8 | C14 | C15 | 169.7° | 176.5° |
| C9 | C8 | C14 | C13 | 59.6° | 63.9° |
| C9 | C8 | C14 | H14 | 67.0° | 57.2° |
| C8 | C9 | C11 | C12 | 55.2° | 53.2° |
| C8 | C9 | C11 | C10 | 123.5° | 123.1° |
| C8 | C9 | C11 | H9 | 118.0° | 118.5° |
| C8 | C9 | C11 | H11 | 64.8° | 67.2° |
| C8 | C9 | C11 | H11A | 174.2° | 174.2° |
| C8 | C9 | C10 | H9 | 118.1° | 117.5° |
| C9 | C8 | C7 | H7 | 63.9° | 59.7° |
| C9 | C8 | C7 | H7A | 175.7° | 179.8° |
| C8 | C9 | C10 | C1 | 178.2° | 179.5° |
| C8 | C9 | C10 | C19 | 61.9° | 60.2° |
| C14 | C8 | C7 | H8 | 118.5° | 121.0° |
| C14 | C8 | C7 | C6 | 178.4° | 179.0° |
| C8 | C14 | C13 | C17 | 175.1° | 166.4° |
| C8 | C14 | C15 | C16 | 162.4° | 157.3° |
| C8 | C14 | C15 | C13 | 116.2° | 115.6° |
| C8 | C14 | C15 | H14 | 117.9° | 126.3° |
| C8 | C14 | C15 | H15 | 77.5° | 84.4° |
| C8 | C14 | C15 | H15A | 39.9° | 38.8° |
| C8 | C14 | C13 | H14 | 117.5° | 120.5° |
| C8 | C14 | C13 | C12 | 64.0° | 69.8° |
| C8 | C14 | C13 | C18 | 58.5° | 49.4° |
| C14 | C8 | C9 | C11 | 55.3° | 56.3° |
| C14 | C8 | C9 | C10 | 178.8° | 179.1° |
| C14 | C8 | C9 | H9 | 62.6° | 63.0° |
| C14 | C8 | C7 | H7 | 58.4° | 59.0° |
| C14 | C8 | C7 | H7A | 61.9° | 61.1° |
| C8 | C7 | C6 | C5 | 56.6° | 59.3° |
| C8 | C7 | C6 | H7 | 120.0° | 120.0° |
| C8 | C7 | C6 | H7A | 119.6° | 120.0° |
| C8 | C7 | C6 | H6 | 63.3° | 60.8° |
| C8 | C7 | C6 | H6A | 176.2° | 179.4° |
| C7 | C8 | C14 | C15 | 67.0° | 64.2° |
| C7 | C8 | C14 | C13 | 177.1° | 176.7° |
| C7 | C8 | C14 | H14 | 56.3° | 62.2° |
| C7 | C8 | C9 | C11 | 179.1° | 176.4° |
| C7 | C8 | C9 | C10 | 57.3° | 60.8° |
| C7 | C8 | C9 | H9 | 61.2° | 57.1° |
| C8 | C7 | H7 | H7A | 119.6° | 120.1° |
| H8 | C8 | C7 | C6 | 63.0° | 60.0° |
| H8 | C8 | C14 | C15 | 50.5° | 56.9° |
| H8 | C8 | C14 | C13 | 59.6° | 55.7° |
| H8 | C8 | C14 | H14 | 173.8° | 176.8° |
| H8 | C8 | C9 | C11 | 63.4° | 63.3° |
| H8 | C8 | C9 | C10 | 60.2° | 59.4° |
| H8 | C8 | C9 | H9 | 178.7° | 177.4° |
| H8 | C8 | C7 | H7 | 177.0° | 180.0° |
| H8 | C8 | C7 | H7A | 56.6° | 59.9° |
| C10 | C5 | C4 | C6 | 121.9° | 119.5° |
| C10 | C5 | C4 | H5 | 118.5° | 120.5° |
| C10 | C5 | C6 | H5 | 118.5° | 121.7° |
| C10 | C5 | C6 | C7 | 58.7° | 58.4° |
| C10 | C5 | C6 | H6 | 61.3° | 61.6° |
| C10 | C5 | C6 | H6A | 178.2° | 178.4° |
| C5 | C10 | C1 | C2 | 57.6° | 60.3° |
| C10 | C5 | C4 | C3 | 59.0° | 60.1° |
| C10 | C5 | C4 | H4 | 61.0° | 59.5° |
| C10 | C5 | C4 | H4A | 178.9° | 179.5° |
| C5 | C10 | C9 | C11 | 177.7° | 176.6° |
| C5 | C10 | C9 | C1 | 119.9° | 119.7° |
| C5 | C10 | C9 | C19 | 120.2° | 120.0° |
| C5 | C10 | C9 | H9 | 59.7° | 57.7° |
| C5 | C10 | C1 | C19 | 120.1° | 120.1° |
| C5 | C10 | C19 | H19 | 173.4° | 179.8° |
| C5 | C10 | C19 | H19A | 66.6° | 60.1° |
| C5 | C10 | C19 | H19B | 53.4° | 59.9° |
| C5 | C10 | C1 | H1 | 177.6° | 179.7° |
| C5 | C10 | C1 | H1A | 62.0° | 59.7° |
| C4 | C5 | C6 | H5 | 119.3° | 120.0° |
| C4 | C5 | C6 | C7 | 63.5° | 59.9° |
| C4 | C5 | C6 | H6 | 176.6° | 179.9° |
| C4 | C5 | C6 | H6A | 56.1° | 60.1° |
| C5 | C4 | C3 | C2 | 59.6° | 60.4° |
| C5 | C4 | C3 | H4 | 120.0° | 120.6° |
| C5 | C4 | C3 | H4A | 119.9° | 121.1° |
| C5 | C4 | H4 | H4A | 119.9° | 120.0° |
| C4 | C5 | C10 | C9 | 62.1° | 61.2° |
| C4 | C5 | C10 | C1 | 57.6° | 58.5° |
| C4 | C5 | C10 | C19 | 177.6° | 178.8° |
| C5 | C4 | C3 | N4 | 59.0° | 59.4° |
| C5 | C4 | C3 | H3 | 179.7° | 179.9° |
| C5 | C6 | C7 | H6 | 120.0° | 120.1° |
| C5 | C6 | C7 | H6A | 119.6° | 120.1° |
| C5 | C6 | H6 | H6A | 119.6° | 120.0° |
| C6 | C5 | C4 | C3 | 179.1° | 179.6° |
| C6 | C5 | C4 | H4 | 60.9° | 59.9° |
| C6 | C5 | C4 | H4A | 59.2° | 60.1° |
| C6 | C5 | C10 | C9 | 59.1° | 58.0° |
| C5 | C6 | C7 | H7 | 63.3° | 60.7° |
| C5 | C6 | C7 | H7A | 176.3° | 179.4° |
| C6 | C5 | C10 | C1 | 178.8° | 177.7° |
| C6 | C5 | C10 | C19 | 61.2° | 62.0° |
| H5 | C5 | C6 | C7 | 177.2° | 179.9° |
| H5 | C5 | C6 | H6 | 57.2° | 60.1° |
| H5 | C5 | C6 | H6A | 63.3° | 59.9° |
| H5 | C5 | C4 | C3 | 59.5° | 60.4° |
| H5 | C5 | C4 | H4 | 179.5° | 180.0° |
| H5 | C5 | C4 | H4A | 60.4° | 59.9° |
| H5 | C5 | C10 | C9 | 178.7° | 179.0° |
| H5 | C5 | C10 | C1 | 61.7° | 61.3° |
| H5 | C5 | C10 | C19 | 58.3° | 59.0° |
| C7 | C6 | H6 | H6A | 119.5° | 119.6° |
| C6 | C7 | H7 | H7A | 119.7° | 119.9° |
| H6 | C6 | C7 | H7 | 176.7° | 179.2° |
| H6 | C6 | C7 | H7A | 56.3° | 59.2° |
| H6A | C6 | C7 | H7 | 56.2° | 59.4° |
| H6A | C6 | C7 | H7A | 64.2° | 60.5° |
| O6 | C34 | C33 | N1 | 31.7° | 0.1° |
| O6 | C34 | C33 | O7 | 179.3° | 179.9° |
| O6 | C34 | C33 | H33 | 88.3° | 120.0° |
| O6 | C34 | C33 | H33A | 152.1° | 120.0° |
| O6 | C34 | O7 | HO7 | 0.0° | 0.0° |
| C27 | N1 | C26 | C33 | 118.7° | 124.0° |
| N1 | C27 | C28 | N2 | 61.0° | 175.2° |
| N1 | C27 | C28 | H27 | 120.0° | 120.0° |
| N1 | C27 | C28 | H27A | 119.7° | 119.9° |
| N1 | C27 | C28 | H28 | 179.1° | 55.2° |
| N1 | C27 | C28 | H28A | 58.6° | 64.8° |
| N1 | C27 | H27 | H27A | 119.7° | 120.0° |
| C27 | N1 | C33 | C34 | 74.3° | 170.0° |
| C27 | N1 | C33 | H33 | 165.7° | 50.0° |
| C27 | N1 | C33 | H33A | 46.0° | 70.0° |
| C27 | N1 | C26 | C25 | 159.3° | 73.5° |
| C27 | N1 | C26 | H26 | 39.4° | 166.5° |
| C27 | N1 | C26 | H26A | 80.1° | 46.5° |
| C26 | N1 | C27 | C28 | 162.3° | 163.9° |
| C26 | N1 | C27 | H27 | 77.7° | 43.9° |
| C26 | N1 | C27 | H27A | 42.6° | 76.2° |
| C26 | N1 | C33 | C34 | 166.9° | 66.0° |
| C26 | N1 | C33 | H33 | 46.8° | 174.0° |
| C26 | N1 | C33 | H33A | 72.8° | 54.0° |
| N1 | C26 | C25 | H26 | 120.0° | 120.0° |
| N1 | C26 | C25 | H26A | 120.5° | 119.9° |
| N1 | C26 | H26 | H26A | 120.5° | 119.9° |
| N1 | C26 | C25 | O3 | 15.8° | 6.0° |
| N1 | C26 | C25 | O12 | 164.5° | 174.0° |
| C33 | N1 | C27 | C28 | 79.2° | 72.2° |
| C33 | N1 | C27 | H27 | 40.8° | 167.8° |
| C33 | N1 | C27 | H27A | 161.1° | 47.8° |
| N1 | C33 | C34 | H33 | 120.0° | 120.0° |
| N1 | C33 | C34 | H33A | 120.3° | 120.0° |
| N1 | C33 | H33 | H33A | 120.3° | 120.0° |
| N1 | C33 | C34 | O7 | 148.9° | 180.0° |
| C33 | N1 | C26 | C25 | 81.9° | 162.6° |
| C33 | N1 | C26 | H26 | 158.1° | 42.5° |
| C33 | N1 | C26 | H26A | 38.6° | 77.5° |
| C1 | C2 | C3 | H2 | 120.0° | 120.5° |
| C1 | C2 | C3 | H2A | 119.8° | 119.5° |
| C1 | C2 | H2 | H2A | 119.8° | 119.8° |
| C1 | C2 | C3 | C4 | 59.9° | 59.4° |
| C2 | C1 | C10 | C9 | 62.2° | 59.4° |
| C2 | C1 | C10 | H1 | 120.0° | 120.0° |
| C2 | C1 | C10 | H1A | 119.6° | 120.0° |
| C2 | C1 | C10 | C19 | 177.7° | 179.6° |
| C2 | C1 | H1 | H1A | 119.6° | 120.1° |
| C1 | C2 | C3 | N4 | 58.8° | 60.6° |
| C1 | C2 | C3 | H3 | 179.6° | 179.4° |
| C3 | C2 | H2 | H2A | 119.8° | 120.0° |
| C2 | C3 | C4 | N4 | 118.5° | 119.8° |
| C2 | C3 | C4 | H3 | 120.7° | 119.8° |
| C2 | C3 | C4 | H4 | 60.5° | 60.3° |
| C2 | C3 | C4 | H4A | 179.5° | 178.6° |
| C3 | C2 | C1 | C10 | 59.3° | 60.1° |
| C3 | C2 | C1 | H1 | 179.3° | 179.9° |
| C3 | C2 | C1 | H1A | 60.3° | 59.9° |
| C2 | C3 | N4 | H3 | 120.7° | 120.0° |
| C2 | C3 | N4 | C41 | 63.2° | 85.0° |
| C2 | C3 | N4 | HN4 | 116.8° | 95.1° |
| H2 | C2 | C3 | C4 | 179.9° | 179.9° |
| H2 | C2 | C1 | C10 | 179.3° | 179.7° |
| H2 | C2 | C1 | H1 | 60.7° | 59.7° |
| H2 | C2 | C1 | H1A | 59.7° | 60.3° |
| H2 | C2 | C3 | N4 | 61.2° | 59.9° |
| H2 | C2 | C3 | H3 | 59.6° | 60.1° |
| H2A | C2 | C3 | C4 | 59.9° | 60.1° |
| H2A | C2 | C1 | C10 | 60.5° | 59.6° |
| H2A | C2 | C1 | H1 | 59.5° | 60.3° |
| H2A | C2 | C1 | H1A | 179.9° | 179.6° |
| H2A | C2 | C3 | N4 | 178.6° | 179.9° |
| H2A | C2 | C3 | H3 | 60.6° | 59.9° |
| C37 | N3 | C30 | C31 | 121.6° | 123.9° |
| C37 | N3 | C30 | C29 | 64.8° | 72.4° |
| C37 | N3 | C30 | H30 | 55.2° | 167.7° |
| C37 | N3 | C30 | H30A | 174.5° | 47.6° |
| N3 | C37 | C38 | H37 | 120.0° | 120.0° |
| N3 | C37 | C38 | H37A | 120.5° | 120.0° |
| N3 | C37 | H37 | H37A | 120.5° | 120.0° |
| N3 | C37 | C38 | O11 | 142.7° | 0.0° |
| N3 | C37 | C38 | O10 | 36.8° | 180.0° |
| C37 | N3 | C31 | C32 | 69.4° | 170.0° |
| C37 | N3 | C31 | H31 | 170.6° | 50.0° |
| C37 | N3 | C31 | H31A | 51.7° | 70.0° |
| N3 | C30 | C29 | N2 | 58.1° | 176.1° |
| N3 | C30 | C29 | H30 | 120.0° | 120.0° |
| N3 | C30 | C29 | H30A | 120.7° | 120.0° |
| N3 | C30 | C29 | H29 | 178.1° | 56.1° |
| N3 | C30 | C29 | H29A | 62.4° | 63.9° |
| N3 | C30 | H30 | H30A | 120.7° | 120.1° |
| C30 | N3 | C37 | C38 | 87.5° | 159.3° |
| C30 | N3 | C37 | H37 | 152.4° | 39.3° |
| C30 | N3 | C37 | H37A | 33.0° | 80.7° |
| C30 | N3 | C31 | C32 | 168.8° | 66.0° |
| C30 | N3 | C31 | H31 | 48.8° | 173.9° |
| C30 | N3 | C31 | H31A | 70.0° | 53.9° |
| C31 | N3 | C30 | C29 | 173.6° | 163.7° |
| C31 | N3 | C30 | H30 | 66.4° | 43.8° |
| C31 | N3 | C30 | H30A | 52.9° | 76.3° |
| C31 | N3 | C37 | C38 | 149.5° | 76.8° |
| C31 | N3 | C37 | H37 | 29.5° | 163.2° |
| C31 | N3 | C37 | H37A | 90.0° | 43.2° |
| N3 | C31 | C32 | H31 | 120.0° | 120.0° |
| N3 | C31 | C32 | H31A | 121.1° | 120.0° |
| N3 | C31 | H31 | H31A | 121.2° | 120.0° |
| N3 | C31 | C32 | O4 | 20.3° | 0.0° |
| N3 | C31 | C32 | O13 | 159.3° | 180.0° |
| C3 | C4 | H4 | H4A | 119.9° | 117.5° |
| C4 | C3 | N4 | H3 | 120.5° | 120.7° |
| C4 | C3 | N4 | C41 | 178.0° | 155.6° |
| C4 | C3 | N4 | HN4 | 2.1° | 24.3° |
| H4 | C4 | C3 | N4 | 179.0° | 180.0° |
| H4 | C4 | C3 | H3 | 60.2° | 59.5° |
| H4A | C4 | C3 | N4 | 60.9° | 61.6° |
| H4A | C4 | C3 | H3 | 59.8° | 58.8° |
| O1 | C24 | O2 | C23 | 179.9° | 179.9° |
| O1 | C24 | C23 | C22 | 46.9° | 180.0° |
| O1 | C24 | C23 | H23 | 73.1° | 60.0° |
| O1 | C24 | C23 | H23A | 166.4° | 60.0° |
| HO1 | O1 | C24 | O2 | 0.0° | 0.1° |
| HO1 | O1 | C24 | C23 | 180.0° | 180.0° |
| O2 | C24 | C23 | C22 | 133.1° | 0.0° |
| O2 | C24 | C23 | H23 | 106.9° | 120.0° |
| O2 | C24 | C23 | H23A | 13.6° | 120.0° |
| C24 | C23 | C22 | H23 | 120.0° | 120.0° |
| C24 | C23 | C22 | H23A | 119.5° | 120.0° |
| C24 | C23 | H23 | H23A | 119.5° | 120.0° |
| C24 | C23 | C22 | C20 | 177.3° | 180.0° |
| C24 | C23 | C22 | H22 | 62.7° | 60.0° |
| C24 | C23 | C22 | H22A | 57.9° | 60.0° |
| C22 | C23 | H23 | H23A | 119.5° | 120.0° |
| C23 | C22 | C20 | H22 | 120.0° | 120.1° |
| C23 | C22 | C20 | H22A | 119.4° | 120.0° |
| C23 | C22 | H22 | H22A | 119.4° | 120.0° |
| C23 | C22 | C20 | C21 | 56.6° | 65.0° |
| C23 | C22 | C20 | C17 | 179.1° | 175.0° |
| C23 | C22 | C20 | H20 | 62.3° | 55.0° |
| H23 | C23 | C22 | C20 | 57.3° | 60.0° |
| H23 | C23 | C22 | H22 | 177.3° | 180.0° |
| H23 | C23 | C22 | H22A | 62.1° | 60.0° |
| H23A | C23 | C22 | C20 | 63.2° | 60.0° |
| H23A | C23 | C22 | H22 | 56.8° | 60.0° |
| H23A | C23 | C22 | H22A | 177.4° | 180.0° |
| C20 | C22 | H22 | H22A | 119.4° | 119.9° |
| C22 | C20 | C21 | C17 | 122.6° | 120.0° |
| C22 | C20 | C21 | H20 | 118.8° | 120.0° |
| C22 | C20 | C17 | H20 | 118.7° | 120.1° |
| C22 | C20 | C21 | H21 | 116.8° | 56.2° |
| C22 | C20 | C21 | H21A | 123.2° | 63.7° |
| C22 | C20 | C21 | H21B | 3.2° | 176.3° |
| C22 | C20 | C17 | C13 | 175.9° | 174.8° |
| C22 | C20 | C17 | C16 | 57.6° | 58.9° |
| C22 | C20 | C17 | H17 | 63.0° | 63.2° |
| H22 | C22 | C20 | C21 | 63.4° | 55.1° |
| H22 | C22 | C20 | C17 | 59.1° | 64.9° |
| H22 | C22 | C20 | H20 | 177.7° | 175.1° |
| H22A | C22 | C20 | C21 | 176.0° | 175.0° |
| H22A | C22 | C20 | C17 | 61.5° | 55.0° |
| H22A | C22 | C20 | H20 | 57.1° | 65.0° |
| C21 | C20 | C17 | H20 | 118.8° | 119.9° |
| C20 | C21 | H21 | H21A | 120.0° | 119.9° |
| C20 | C21 | H21 | H21B | 120.0° | 120.1° |
| C20 | C21 | H21A | H21B | 120.0° | 120.1° |
| C21 | C20 | C17 | C13 | 61.7° | 65.2° |
| C21 | C20 | C17 | C16 | 179.9° | 178.9° |
| C21 | C20 | C17 | H17 | 59.4° | 56.8° |
| C17 | C20 | C21 | H21 | 5.8° | 176.3° |
| C17 | C20 | C21 | H21A | 114.2° | 56.3° |
| C17 | C20 | C21 | H21B | 125.8° | 63.7° |
| C20 | C17 | C13 | C16 | 124.3° | 118.9° |
| C20 | C17 | C13 | H17 | 114.6° | 122.0° |
| C20 | C17 | C16 | H17 | 114.5° | 122.0° |
| C20 | C17 | C16 | C15 | 137.6° | 122.4° |
| C20 | C17 | C16 | H16 | 102.4° | 118.4° |
| C20 | C17 | C16 | H16A | 16.1° | 3.1° |
| C20 | C17 | C13 | C14 | 166.4° | 148.2° |
| C20 | C17 | C13 | C12 | 76.6° | 94.3° |
| C20 | C17 | C13 | C18 | 48.6° | 31.2° |
| H20 | C20 | C21 | H21 | 124.5° | 63.8° |
| H20 | C20 | C21 | H21A | 4.5° | 176.3° |
| H20 | C20 | C21 | H21B | 115.5° | 56.2° |
| H20 | C20 | C17 | C13 | 57.2° | 54.7° |
| H20 | C20 | C17 | C16 | 61.1° | 61.1° |
| H20 | C20 | C17 | H17 | 178.2° | 176.7° |
| H21 | C21 | H21A | H21B | 120.0° | 120.0° |
| C13 | C17 | C16 | H17 | 121.5° | 119.0° |
| C13 | C17 | C16 | C15 | 13.6° | 3.5° |
| C13 | C17 | C16 | H16 | 133.6° | 122.7° |
| C13 | C17 | C16 | H16A | 107.9° | 115.8° |
| C17 | C13 | C14 | C15 | 54.6° | 44.4° |
| C17 | C13 | C14 | C12 | 120.9° | 123.8° |
| C17 | C13 | C14 | C18 | 116.6° | 117.0° |
| C17 | C13 | C14 | H14 | 67.4° | 73.1° |
| C17 | C13 | C12 | C18 | 125.4° | 125.5° |
| C17 | C13 | C18 | H18 | 62.7° | 66.0° |
| C17 | C13 | C18 | H18A | 177.3° | 174.0° |
| C17 | C13 | C18 | H18B | 57.3° | 54.0° |
| C17 | C13 | C12 | C11 | 172.4° | 179.6° |
| C17 | C13 | C12 | H12 | 67.5° | 60.9° |
| C17 | C13 | C12 | H12A | 51.8° | 60.2° |
| C17 | C16 | C15 | H16 | 120.0° | 119.2° |
| C17 | C16 | C15 | H16A | 121.6° | 119.3° |
| C17 | C16 | H16 | H16A | 121.7° | 121.5° |
| C17 | C16 | C15 | C14 | 20.2° | 23.9° |
| C17 | C16 | C15 | H15 | 140.2° | 142.3° |
| C17 | C16 | C15 | H15A | 102.3° | 94.6° |
| C16 | C17 | C13 | C14 | 42.1° | 29.3° |
| C16 | C17 | C13 | C12 | 159.0° | 146.8° |
| C16 | C17 | C13 | C18 | 75.7° | 87.7° |
| H17 | C17 | C16 | C15 | 107.9° | 115.5° |
| H17 | C17 | C16 | H16 | 12.1° | 3.7° |
| H17 | C17 | C16 | H16A | 130.6° | 125.2° |
| H17 | C17 | C13 | C14 | 79.0° | 89.8° |
| H17 | C17 | C13 | C12 | 37.9° | 27.7° |
| H17 | C17 | C13 | C18 | 163.2° | 153.2° |
| C15 | C16 | H16 | H16A | 121.7° | 121.5° |
| C16 | C15 | C14 | H15 | 120.0° | 118.4° |
| C16 | C15 | C14 | H15A | 122.5° | 118.4° |
| C16 | C15 | H15 | H15A | 122.9° | 123.1° |
| C16 | C15 | C14 | C13 | 46.2° | 41.6° |
| C16 | C15 | C14 | H14 | 79.6° | 76.5° |
| H16 | C16 | C15 | C14 | 99.8° | 95.3° |
| H16 | C16 | C15 | H15 | 20.2° | 23.1° |
| H16 | C16 | C15 | H15A | 137.6° | 146.2° |
| H16A | C16 | C15 | C14 | 141.7° | 143.2° |
| H16A | C16 | C15 | H15 | 98.3° | 98.4° |
| H16A | C16 | C15 | H15A | 19.2° | 24.7° |
| C14 | C15 | H15 | H15A | 122.8° | 123.4° |
| C15 | C14 | C13 | H14 | 122.0° | 117.5° |
| C15 | C14 | C13 | C12 | 175.5° | 168.2° |
| C15 | C14 | C13 | C18 | 62.0° | 72.6° |
| H15 | C15 | C14 | C13 | 166.2° | 160.0° |
| H15 | C15 | C14 | H14 | 40.4° | 41.9° |
| H15A | C15 | C14 | C13 | 76.3° | 76.8° |
| H15A | C15 | C14 | H14 | 157.9° | 165.1° |
| C14 | C13 | C12 | C18 | 123.7° | 119.3° |
| C14 | C13 | C18 | H18 | 172.4° | 178.9° |
| C14 | C13 | C18 | H18A | 67.6° | 61.2° |
| C14 | C13 | C18 | H18B | 52.4° | 58.9° |
| C14 | C13 | C12 | C11 | 61.6° | 64.4° |
| C14 | C13 | C12 | H12 | 178.4° | 176.2° |
| C14 | C13 | C12 | H12A | 59.1° | 55.1° |
| H14 | C14 | C13 | C12 | 53.5° | 50.7° |
| H14 | C14 | C13 | C18 | 176.0° | 169.9° |
| C12 | C13 | C18 | H18 | 65.3° | 63.3° |
| C12 | C13 | C18 | H18A | 54.7° | 56.7° |
| C12 | C13 | C18 | H18B | 174.7° | 176.7° |
| C13 | C12 | C11 | H12 | 120.0° | 119.5° |
| C13 | C12 | C11 | H12A | 120.6° | 119.4° |
| C13 | C12 | H12 | H12A | 120.7° | 121.0° |
| C13 | C12 | C11 | C9 | 57.2° | 56.8° |
| C13 | C12 | C11 | H11 | 62.8° | 63.1° |
| C13 | C12 | C11 | H11A | 176.2° | 177.9° |
| C13 | C18 | H18 | H18A | 120.0° | 119.9° |
| C13 | C18 | H18 | H18B | 120.0° | 120.1° |
| C13 | C18 | H18A | H18B | 120.0° | 120.1° |
| C18 | C13 | C12 | C11 | 62.1° | 54.9° |
| C18 | C13 | C12 | H12 | 57.9° | 64.6° |
| C18 | C13 | C12 | H12A | 177.2° | 174.4° |
| H18 | C18 | H18A | H18B | 120.0° | 120.0° |
| C11 | C12 | H12 | H12A | 120.6° | 121.1° |
| C12 | C11 | C9 | H11 | 120.0° | 120.4° |
| C12 | C11 | C9 | H11A | 119.0° | 121.0° |
| C12 | C11 | H11 | H11A | 119.0° | 119.0° |
| C12 | C11 | C9 | C10 | 178.7° | 176.3° |
| C12 | C11 | C9 | H9 | 62.8° | 65.3° |
| H12 | C12 | C11 | C9 | 177.2° | 176.3° |
| H12 | C12 | C11 | H11 | 57.2° | 56.4° |
| H12 | C12 | C11 | H11A | 63.8° | 62.6° |
| H12A | C12 | C11 | C9 | 63.4° | 62.6° |
| H12A | C12 | C11 | H11 | 176.5° | 177.4° |
| H12A | C12 | C11 | H11A | 55.6° | 58.5° |
| C9 | C11 | H11 | H11A | 119.1° | 118.7° |
| C11 | C9 | C10 | H9 | 117.9° | 118.8° |
| C11 | C9 | C10 | C1 | 57.8° | 56.8° |
| C11 | C9 | C10 | C19 | 62.1° | 63.5° |
| H11 | C11 | C9 | C10 | 58.7° | 55.9° |
| H11 | C11 | C9 | H9 | 177.1° | 174.3° |
| H11A | C11 | C9 | C10 | 62.3° | 62.7° |
| H11A | C11 | C9 | H9 | 56.2° | 55.7° |
| C9 | C10 | C1 | C19 | 120.1° | 120.2° |
| C9 | C10 | C19 | H19 | 53.3° | 60.0° |
| C9 | C10 | C19 | H19A | 173.3° | 180.0° |
| C9 | C10 | C19 | H19B | 66.7° | 60.0° |
| C9 | C10 | C1 | H1 | 57.8° | 60.6° |
| C9 | C10 | C1 | H1A | 178.2° | 179.4° |
| H9 | C9 | C10 | C1 | 60.1° | 62.0° |
| H9 | C9 | C10 | C19 | 180.0° | 177.7° |
| C1 | C10 | C19 | H19 | 66.5° | 60.1° |
| C1 | C10 | C19 | H19A | 53.5° | 59.9° |
| C1 | C10 | C19 | H19B | 173.5° | 179.9° |
| C10 | C1 | H1 | H1A | 119.6° | 120.0° |
| C10 | C19 | H19 | H19A | 120.0° | 120.0° |
| C10 | C19 | H19 | H19B | 120.0° | 120.0° |
| C10 | C19 | H19A | H19B | 120.0° | 120.0° |
| C19 | C10 | C1 | H1 | 62.4° | 59.6° |
| C19 | C10 | C1 | H1A | 58.1° | 60.4° |
| H19 | C19 | H19A | H19B | 120.0° | 119.9° |
| C3 | N4 | C41 | HN4 | 180.0° | 179.9° |
| C3 | N4 | C41 | O | 1.3° | 0.1° |
| C3 | N4 | C41 | C40 | 179.7° | 180.0° |
| H3 | C3 | N4 | C41 | 57.5° | 34.9° |
| H3 | C3 | N4 | HN4 | 122.5° | 145.0° |
| N4 | C41 | O | C40 | 178.9° | 179.9° |
| N4 | C41 | C40 | C39 | 119.5° | 179.9° |
| N4 | C41 | C40 | H40 | 0.5° | 60.1° |
| N4 | C41 | C40 | H40A | 121.1° | 60.0° |
| HN4 | N4 | C41 | O | 178.7° | 180.0° |
| HN4 | N4 | C41 | C40 | 0.2° | 0.1° |
| O | C41 | C40 | C39 | 59.5° | 0.0° |
| O | C41 | C40 | H40 | 179.4° | 120.0° |
| O | C41 | C40 | H40A | 59.9° | 120.0° |
| C41 | C40 | C39 | H40 | 120.0° | 120.0° |
| C41 | C40 | C39 | H40A | 119.4° | 120.0° |
| C41 | C40 | H40 | H40A | 119.4° | 120.1° |
| C41 | C40 | C39 | C35 | 168.4° | 175.2° |
| C41 | C40 | C39 | H39 | 71.6° | 55.2° |
| C41 | C40 | C39 | H39A | 49.2° | 64.8° |
| C39 | C40 | H40 | H40A | 119.4° | 119.9° |
| C40 | C39 | C35 | H39 | 120.0° | 120.0° |
| C40 | C39 | C35 | H39A | 119.2° | 120.0° |
| C40 | C39 | H39 | H39A | 119.3° | 120.0° |
| C40 | C39 | C35 | C36 | 167.0° | 175.8° |
| C40 | C39 | C35 | N2 | 71.6° | 64.3° |
| C40 | C39 | C35 | H35 | 47.5° | 55.8° |
| H40 | C40 | C39 | C35 | 48.4° | 64.8° |
| H40 | C40 | C39 | H39 | 168.4° | 175.2° |
| H40 | C40 | C39 | H39A | 70.8° | 55.2° |
| H40A | C40 | C39 | C35 | 72.3° | 55.1° |
| H40A | C40 | C39 | H39 | 47.8° | 64.9° |
| H40A | C40 | C39 | H39A | 168.5° | 175.1° |
| C35 | C39 | H39 | H39A | 119.2° | 120.0° |
| C39 | C35 | C36 | N2 | 122.7° | 120.0° |
| C39 | C35 | C36 | H35 | 118.1° | 120.0° |
| C39 | C35 | N2 | H35 | 118.1° | 120.1° |
| C39 | C35 | C36 | O9 | 28.2° | 115.7° |
| C39 | C35 | C36 | O8 | 151.7° | 64.3° |
| C39 | C35 | N2 | C29 | 80.3° | 174.0° |
| C39 | C35 | N2 | C28 | 38.8° | 62.1° |
| H39 | C39 | C35 | C36 | 47.0° | 55.8° |
| H39 | C39 | C35 | N2 | 168.4° | 175.7° |
| H39 | C39 | C35 | H35 | 72.5° | 64.2° |
| H39A | C39 | C35 | C36 | 73.8° | 64.2° |
| H39A | C39 | C35 | N2 | 47.7° | 55.7° |
| H39A | C39 | C35 | H35 | 166.8° | 175.8° |
| C36 | C35 | N2 | H35 | 119.5° | 120.0° |
| C35 | C36 | O9 | O8 | 179.9° | 180.0° |
| C35 | C36 | O8 | HO8 | 179.9° | 180.0° |
| C36 | C35 | N2 | C29 | 157.4° | 66.0° |
| C36 | C35 | N2 | C28 | 83.5° | 57.9° |
| N2 | C35 | C36 | O9 | 150.8° | 4.3° |
| N2 | C35 | C36 | O8 | 29.1° | 175.7° |
| C35 | N2 | C29 | C28 | 120.2° | 124.0° |
| C35 | N2 | C29 | C30 | 158.0° | 71.2° |
| C35 | N2 | C29 | H29 | 81.9° | 48.8° |
| C35 | N2 | C29 | H29A | 37.5° | 168.9° |
| C35 | N2 | C28 | C27 | 54.2° | 163.8° |
| C35 | N2 | C28 | H28 | 65.8° | 76.2° |
| C35 | N2 | C28 | H28A | 173.7° | 43.8° |
| H35 | C35 | C36 | O9 | 90.0° | 124.3° |
| H35 | C35 | C36 | O8 | 90.1° | 55.8° |
| H35 | C35 | N2 | C29 | 37.8° | 53.9° |
| H35 | C35 | N2 | C28 | 157.0° | 177.9° |
| O9 | C36 | O8 | HO8 | 0.0° | 0.0° |
| N2 | C29 | C30 | H29 | 120.0° | 120.0° |
| N2 | C29 | C30 | H29A | 120.5° | 120.0° |
| N2 | C29 | H29 | H29A | 120.5° | 120.0° |
| N2 | C29 | C30 | H30 | 178.1° | 56.2° |
| N2 | C29 | C30 | H30A | 62.6° | 63.9° |
| C29 | N2 | C28 | C27 | 173.8° | 72.3° |
| C29 | N2 | C28 | H28 | 53.8° | 47.8° |
| C29 | N2 | C28 | H28A | 66.6° | 167.7° |
| C28 | N2 | C29 | C30 | 81.7° | 164.9° |
| C28 | N2 | C29 | H29 | 38.3° | 75.1° |
| C28 | N2 | C29 | H29A | 157.8° | 44.9° |
| N2 | C28 | C27 | H28 | 120.0° | 120.0° |
| N2 | C28 | C27 | H28A | 119.6° | 120.0° |
| N2 | C28 | H28 | H28A | 119.6° | 119.9° |
| N2 | C28 | C27 | H27 | 179.0° | 55.2° |
| N2 | C28 | C27 | H27A | 58.7° | 64.9° |
| C30 | C29 | H29 | H29A | 120.5° | 120.0° |
| C29 | C30 | H30 | H30A | 120.7° | 120.0° |
| H29 | C29 | C30 | H30 | 61.8° | 63.9° |
| H29 | C29 | C30 | H30A | 57.5° | 176.1° |
| H29A | C29 | C30 | H30 | 57.7° | 176.1° |
| H29A | C29 | C30 | H30A | 177.0° | 56.1° |
| C38 | C37 | H37 | H37A | 120.6° | 120.0° |
| C37 | C38 | O11 | O10 | 179.4° | 179.9° |
| C37 | C38 | O10 | HO10 | 179.4° | 179.9° |
| H37 | C37 | C38 | O11 | 97.3° | 119.9° |
| H37 | C37 | C38 | O10 | 83.3° | 60.0° |
| H37A | C37 | C38 | O11 | 22.2° | 120.0° |
| H37A | C37 | C38 | O10 | 157.3° | 60.1° |
| O11 | C38 | O10 | HO10 | 0.0° | 0.1° |
| C32 | C31 | H31 | H31A | 121.2° | 120.0° |
| C31 | C32 | O4 | O13 | 179.6° | 179.9° |
| C31 | C32 | O13 | HO13 | 179.6° | 180.0° |
| H31 | C31 | C32 | O4 | 99.7° | 120.0° |
| H31 | C31 | C32 | O13 | 80.7° | 59.9° |
| H31A | C31 | C32 | O4 | 141.4° | 120.0° |
| H31A | C31 | C32 | O13 | 38.2° | 60.0° |
| O4 | C32 | O13 | HO13 | 0.0° | 0.1° |
| C27 | C28 | H28 | H28A | 119.6° | 120.0° |
| C28 | C27 | H27 | H27A | 119.7° | 120.1° |
| H28 | C28 | C27 | H27 | 59.1° | 64.8° |
| H28 | C28 | C27 | H27A | 61.3° | 175.1° |
| H28A | C28 | C27 | H27 | 61.4° | 175.2° |
| H28A | C28 | C27 | H27A | 178.3° | 55.1° |
| C34 | C33 | H33 | H33A | 120.3° | 120.0° |
| C33 | C34 | O7 | HO7 | 179.3° | 180.0° |
| H33 | C33 | C34 | O7 | 91.1° | 60.0° |
| H33A | C33 | C34 | O7 | 28.6° | 60.0° |
| C25 | C26 | H26 | H26A | 120.5° | 120.0° |
| C26 | C25 | O3 | O12 | 179.6° | 179.9° |
| C26 | C25 | O12 | HO12 | 179.6° | 179.9° |
| H26 | C26 | C25 | O3 | 104.2° | 114.0° |
| H26 | C26 | C25 | O12 | 75.5° | 66.0° |
| H26A | C26 | C25 | O3 | 136.4° | 126.0° |
| H26A | C26 | C25 | O12 | 44.0° | 54.1° |
| O3 | C25 | O12 | HO12 | 0.0° | 0.0° |
