RCG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | O5 | sing | 1.43Å | 1.43Å | |
| O5 | C10 | sing | 1.36Å | 1.36Å | |
| C10 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
| O6 | C7 | sing | 1.43Å | 1.41Å | |
| C9 | C7 | sing | 1.52Å | 1.51Å | |
| C9 | C14 | doub | 1.39Å | 1.38Å | Aromatic |
| O4 | C12 | sing | 1.36Å | 1.37Å | |
| O4 | C15 | sing | 1.43Å | 1.42Å | |
| O2 | C8 | sing | 1.43Å | 1.42Å | |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C7 | sing | 1.54Å | 1.55Å | |
| C8 | C4 | sing | 1.54Å | 1.55Å | |
| C7 | C6 | sing | 1.55Å | 1.57Å | |
| C2 | N1 | sing | 1.46Å | 1.46Å | |
| C14 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | O3 | sing | 1.36Å | 1.37Å | |
| C18 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| N1 | C1 | sing | 1.47Å | 1.47Å | |
| N1 | C3 | sing | 1.35Å | 1.35Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| C4 | C5 | sing | 1.55Å | 1.54Å | |
| C19 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C17 | sing | 1.51Å | 1.52Å | |
| C6 | O3 | sing | 1.44Å | 1.48Å | |
| C6 | C5 | sing | 1.53Å | 1.56Å | |
| C3 | O1 | doub | 1.21Å | 1.23Å | |
| C17 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | O7 | sing | 1.43Å | 1.42Å | |
| C20 | O7 | sing | 1.36Å | 1.37Å | |
| C20 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C24 | sing | 1.51Å | 1.51Å | |
| C22 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.37Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.08Å | 1.08Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.08Å | 1.08Å | |
| C19 | H13 | sing | 1.08Å | 1.08Å | |
| C2 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| C2 | H16 | sing | 1.09Å | 1.10Å | |
| C21 | H17 | sing | 1.08Å | 1.08Å | |
| C22 | H18 | sing | 1.08Å | 1.08Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.08Å | 1.08Å | |
| C26 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H24 | sing | 1.08Å | 1.08Å | |
| C28 | H25 | sing | 1.08Å | 1.08Å | |
| C29 | H26 | sing | 1.08Å | 1.08Å | |
| C4 | H27 | sing | 1.09Å | 1.10Å | |
| C5 | H28 | sing | 1.09Å | 1.10Å | |
| C8 | H29 | sing | 1.09Å | 1.10Å | |
| O2 | H30 | sing | 0.97Å | 0.95Å | |
| O6 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | O5 | C10 | 116.9° | 117.0° |
| O5 | C16 | H9 | 109.5° | 109.5° |
| O5 | C16 | H10 | 109.5° | 109.5° |
| O5 | C16 | H11 | 109.5° | 109.5° |
| O5 | C10 | C11 | 124.0° | 120.1° |
| O5 | C10 | C9 | 116.2° | 120.0° |
| C11 | C10 | C9 | 119.8° | 119.9° |
| C10 | C11 | C12 | 119.9° | 119.7° |
| C10 | C11 | H4 | 120.0° | 120.2° |
| C10 | C9 | C7 | 131.8° | 132.1° |
| C10 | C9 | C14 | 118.0° | 120.8° |
| C11 | C12 | O4 | 111.3° | 119.8° |
| C11 | C12 | C13 | 122.2° | 120.3° |
| C12 | C11 | H4 | 120.1° | 120.2° |
| O6 | C7 | C9 | 111.6° | 114.0° |
| O6 | C7 | C8 | 109.0° | 113.3° |
| O6 | C7 | C6 | 114.3° | 113.6° |
| C7 | O6 | H31 | 109.5° | 114.0° |
| C7 | C9 | C14 | 110.2° | 107.1° |
| C9 | C7 | C8 | 114.2° | 108.8° |
| C9 | C7 | C6 | 101.5° | 101.5° |
| C9 | C14 | C13 | 124.6° | 119.0° |
| C9 | C14 | O3 | 112.8° | 111.2° |
| C12 | O4 | C15 | 118.4° | 117.0° |
| O4 | C12 | C13 | 126.5° | 119.8° |
| O4 | C15 | H6 | 109.5° | 109.5° |
| O4 | C15 | H7 | 109.5° | 109.4° |
| O4 | C15 | H8 | 109.4° | 109.5° |
| O2 | C8 | C7 | 111.0° | 110.1° |
| O2 | C8 | C4 | 109.2° | 110.1° |
| O2 | C8 | H29 | 111.5° | 110.1° |
| C8 | O2 | H30 | 109.5° | 114.0° |
| C12 | C13 | C14 | 115.4° | 120.3° |
| C12 | C13 | H5 | 122.3° | 119.9° |
| C7 | C8 | C4 | 105.5° | 106.2° |
| C8 | C7 | C6 | 106.3° | 104.6° |
| C7 | C8 | H29 | 109.7° | 110.1° |
| C8 | C4 | C3 | 113.7° | 109.8° |
| C8 | C4 | C5 | 102.9° | 107.4° |
| C8 | C4 | H27 | 108.3° | 109.9° |
| C4 | C8 | H29 | 109.7° | 110.1° |
| C7 | C6 | C17 | 117.8° | 112.6° |
| C7 | C6 | O3 | 105.8° | 102.6° |
| C7 | C6 | C5 | 104.0° | 106.3° |
| C2 | N1 | C1 | 115.6° | 120.0° |
| C2 | N1 | C3 | 124.6° | 120.0° |
| N1 | C2 | H14 | 109.5° | 109.5° |
| N1 | C2 | H15 | 109.5° | 109.5° |
| N1 | C2 | H16 | 109.5° | 109.5° |
| C13 | C14 | O3 | 122.6° | 129.8° |
| C14 | C13 | H5 | 122.3° | 119.9° |
| C14 | O3 | C6 | 108.7° | 109.2° |
| C19 | C18 | C17 | 121.5° | 120.0° |
| C18 | C19 | C20 | 119.7° | 120.0° |
| C19 | C18 | H12 | 119.2° | 120.0° |
| C18 | C19 | H13 | 120.2° | 120.0° |
| C18 | C17 | C6 | 121.7° | 119.9° |
| C18 | C17 | C22 | 118.0° | 120.1° |
| C17 | C18 | H12 | 119.2° | 120.0° |
| C1 | N1 | C3 | 119.8° | 119.9° |
| N1 | C1 | H1 | 109.5° | 109.5° |
| N1 | C1 | H2 | 109.5° | 109.5° |
| N1 | C1 | H3 | 109.5° | 109.5° |
| N1 | C3 | C4 | 117.1° | 120.1° |
| N1 | C3 | O1 | 121.6° | 119.9° |
| C3 | C4 | C5 | 114.7° | 109.9° |
| C4 | C3 | O1 | 121.3° | 120.0° |
| C3 | C4 | H27 | 108.7° | 109.9° |
| C4 | C5 | C6 | 102.8° | 106.7° |
| C4 | C5 | C24 | 116.6° | 109.9° |
| C5 | C4 | H27 | 108.4° | 109.9° |
| C4 | C5 | H28 | 106.7° | 109.9° |
| C19 | C20 | O7 | 120.7° | 120.1° |
| C19 | C20 | C21 | 119.4° | 119.8° |
| C20 | C19 | H13 | 120.1° | 120.0° |
| C17 | C6 | O3 | 108.1° | 112.4° |
| C17 | C6 | C5 | 112.1° | 112.4° |
| C6 | C17 | C22 | 120.3° | 119.9° |
| O3 | C6 | C5 | 108.6° | 110.0° |
| C6 | C5 | C24 | 116.3° | 110.2° |
| C6 | C5 | H28 | 106.6° | 110.3° |
| C17 | C22 | C21 | 121.6° | 120.0° |
| C17 | C22 | H18 | 119.2° | 120.0° |
| C23 | O7 | C20 | 117.9° | 117.0° |
| O7 | C23 | H19 | 109.5° | 109.4° |
| O7 | C23 | H20 | 109.5° | 109.5° |
| O7 | C23 | H21 | 109.5° | 109.5° |
| O7 | C20 | C21 | 119.9° | 120.1° |
| C20 | C21 | C22 | 119.7° | 120.0° |
| C20 | C21 | H17 | 120.1° | 120.0° |
| C5 | C24 | C25 | 121.2° | 120.0° |
| C5 | C24 | C29 | 120.8° | 120.0° |
| C24 | C5 | H28 | 107.2° | 109.8° |
| C22 | C21 | H17 | 120.1° | 120.1° |
| C21 | C22 | H18 | 119.2° | 120.0° |
| C25 | C24 | C29 | 117.9° | 120.0° |
| C24 | C25 | C26 | 121.0° | 120.0° |
| C24 | C25 | H22 | 119.5° | 120.0° |
| C24 | C29 | C28 | 121.0° | 120.0° |
| C24 | C29 | H26 | 119.5° | 120.0° |
| C25 | C26 | C27 | 120.1° | 120.0° |
| C26 | C25 | H22 | 119.5° | 120.0° |
| C25 | C26 | H23 | 119.9° | 120.0° |
| C29 | C28 | C27 | 120.2° | 119.9° |
| C29 | C28 | H25 | 119.9° | 120.0° |
| C28 | C29 | H26 | 119.5° | 120.0° |
| C26 | C27 | C28 | 119.8° | 120.0° |
| C27 | C26 | H23 | 119.9° | 120.0° |
| C26 | C27 | H24 | 120.1° | 120.0° |
| C28 | C27 | H24 | 120.1° | 120.0° |
| C27 | C28 | H25 | 119.9° | 120.1° |
| H1 | C1 | H2 | 109.4° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.4° |
| H6 | C15 | H7 | 109.5° | 109.4° |
| H6 | C15 | H8 | 109.5° | 109.5° |
| H7 | C15 | H8 | 109.5° | 109.5° |
| H9 | C16 | H10 | 109.5° | 109.4° |
| H9 | C16 | H11 | 109.5° | 109.4° |
| H10 | C16 | H11 | 109.4° | 109.4° |
| H14 | C2 | H15 | 109.5° | 109.5° |
| H14 | C2 | H16 | 109.5° | 109.4° |
| H15 | C2 | H16 | 109.5° | 109.4° |
| H19 | C23 | H20 | 109.5° | 109.5° |
| H19 | C23 | H21 | 109.5° | 109.5° |
| H20 | C23 | H21 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | O5 | C10 | C11 | 0.9° | 0.0° |
| C16 | O5 | C10 | C9 | 178.7° | 179.8° |
| O5 | C16 | H9 | H10 | 120.0° | 120.0° |
| O5 | C16 | H9 | H11 | 120.0° | 120.0° |
| O5 | C16 | H10 | H11 | 120.0° | 120.0° |
| O5 | C10 | C11 | C9 | 179.6° | 179.7° |
| O5 | C10 | C11 | C12 | 179.8° | 179.8° |
| O5 | C10 | C9 | C7 | 1.4° | 0.7° |
| O5 | C10 | C9 | C14 | 180.0° | 179.5° |
| O5 | C10 | C11 | H4 | 0.2° | 0.3° |
| C10 | O5 | C16 | H9 | 180.0° | 60.0° |
| C10 | O5 | C16 | H10 | 60.0° | 180.0° |
| C10 | O5 | C16 | H11 | 60.0° | 60.0° |
| C10 | C11 | C12 | H4 | 180.0° | 180.0° |
| C11 | C10 | C9 | C7 | 179.0° | 179.5° |
| C11 | C10 | C9 | C14 | 0.4° | 0.3° |
| C10 | C11 | C12 | O4 | 179.9° | 179.8° |
| C10 | C11 | C12 | C13 | 0.4° | 0.2° |
| C9 | C10 | C11 | C12 | 0.2° | 0.0° |
| C10 | C9 | C7 | O6 | 62.9° | 41.0° |
| C10 | C9 | C7 | C14 | 178.7° | 179.8° |
| C10 | C9 | C7 | C8 | 61.2° | 86.4° |
| C10 | C9 | C7 | C6 | 175.0° | 163.6° |
| C10 | C9 | C14 | C13 | 0.0° | 0.4° |
| C10 | C9 | C14 | O3 | 179.0° | 179.4° |
| C9 | C10 | C11 | H4 | 179.8° | 180.0° |
| C11 | C12 | O4 | C13 | 179.7° | 180.0° |
| C11 | C12 | O4 | C15 | 178.4° | 0.0° |
| C11 | C12 | C13 | C14 | 0.7° | 0.0° |
| C11 | C12 | C13 | H5 | 179.3° | 180.0° |
| O6 | C7 | C9 | C8 | 124.1° | 127.5° |
| O6 | C7 | C9 | C6 | 122.1° | 122.6° |
| O6 | C7 | C9 | C14 | 115.8° | 138.8° |
| O6 | C7 | C8 | O2 | 129.9° | 145.5° |
| O6 | C7 | C8 | C6 | 123.6° | 124.2° |
| O6 | C7 | C8 | C4 | 111.9° | 95.4° |
| O6 | C7 | C6 | C17 | 10.5° | 28.2° |
| O6 | C7 | C6 | O3 | 110.5° | 149.3° |
| O6 | C7 | C6 | C5 | 135.2° | 95.2° |
| O6 | C7 | C8 | H29 | 6.2° | 23.8° |
| C9 | C7 | C8 | O2 | 4.4° | 17.5° |
| C9 | C7 | C8 | C6 | 111.0° | 107.9° |
| C9 | C7 | C8 | C4 | 122.6° | 136.7° |
| C7 | C9 | C14 | C13 | 178.9° | 179.4° |
| C7 | C9 | C14 | O3 | 0.1° | 0.8° |
| C9 | C7 | C6 | C17 | 130.7° | 94.7° |
| C9 | C7 | C6 | O3 | 9.7° | 26.4° |
| C9 | C7 | C6 | C5 | 104.6° | 141.9° |
| C9 | C7 | C8 | H29 | 119.3° | 104.1° |
| C9 | C7 | O6 | H31 | 180.0° | 64.3° |
| C9 | C14 | C13 | C12 | 0.6° | 0.3° |
| C14 | C9 | C7 | C8 | 120.1° | 93.7° |
| C14 | C9 | C7 | C6 | 6.3° | 16.2° |
| C9 | C14 | C13 | O3 | 178.9° | 179.7° |
| C9 | C14 | O3 | C6 | 6.7° | 19.6° |
| C9 | C14 | C13 | H5 | 179.5° | 179.7° |
| O4 | C12 | C13 | C14 | 179.6° | 180.0° |
| O4 | C12 | C11 | H4 | 0.1° | 0.1° |
| O4 | C12 | C13 | H5 | 0.3° | 0.0° |
| C12 | O4 | C15 | H6 | 180.0° | 60.0° |
| C12 | O4 | C15 | H7 | 60.0° | 180.0° |
| C12 | O4 | C15 | H8 | 60.0° | 60.0° |
| C15 | O4 | C12 | C13 | 1.9° | 180.0° |
| O4 | C15 | H6 | H7 | 120.0° | 119.9° |
| O4 | C15 | H6 | H8 | 120.0° | 120.0° |
| O4 | C15 | H7 | H8 | 119.9° | 120.0° |
| O2 | C8 | C7 | C4 | 118.2° | 119.1° |
| O2 | C8 | C7 | H29 | 123.7° | 121.6° |
| O2 | C8 | C4 | H29 | 122.6° | 121.7° |
| O2 | C8 | C7 | C6 | 106.5° | 90.3° |
| O2 | C8 | C4 | C3 | 39.4° | 18.6° |
| O2 | C8 | C4 | C5 | 85.2° | 101.0° |
| O2 | C8 | C4 | H27 | 160.2° | 139.5° |
| C12 | C13 | C14 | H5 | 180.0° | 180.0° |
| C12 | C13 | C14 | O3 | 179.4° | 179.5° |
| C13 | C12 | C11 | H4 | 179.6° | 179.9° |
| C7 | C8 | C4 | H29 | 118.1° | 119.2° |
| C7 | C8 | C4 | C3 | 158.8° | 137.7° |
| C7 | C8 | C4 | C5 | 34.2° | 18.2° |
| C8 | C7 | C6 | C17 | 109.7° | 152.2° |
| C8 | C7 | C6 | O3 | 129.3° | 86.7° |
| C8 | C7 | C6 | C5 | 15.0° | 28.8° |
| C7 | C8 | C4 | H27 | 80.4° | 101.3° |
| C7 | C8 | O2 | H30 | 180.0° | 180.0° |
| C8 | C7 | O6 | H31 | 53.0° | 60.8° |
| C4 | C8 | C7 | C6 | 11.6° | 28.8° |
| C8 | C4 | C3 | N1 | 80.5° | 62.1° |
| C8 | C4 | C3 | C5 | 118.0° | 117.9° |
| C8 | C4 | C3 | H27 | 120.6° | 121.0° |
| C8 | C4 | C5 | H27 | 114.5° | 119.5° |
| C8 | C4 | C5 | C6 | 43.5° | 0.2° |
| C8 | C4 | C3 | O1 | 98.5° | 117.9° |
| C8 | C4 | C5 | C24 | 171.9° | 119.7° |
| C8 | C4 | C5 | H28 | 68.5° | 119.3° |
| C4 | C8 | O2 | H30 | 64.1° | 63.3° |
| C7 | C6 | O3 | C14 | 10.4° | 28.8° |
| C7 | C6 | C17 | C18 | 39.7° | 18.4° |
| C7 | C6 | C5 | C4 | 36.0° | 17.7° |
| C7 | C6 | C17 | O3 | 119.7° | 115.2° |
| C7 | C6 | C17 | C5 | 120.6° | 120.0° |
| C7 | C6 | O3 | C5 | 111.1° | 112.8° |
| C7 | C6 | C17 | C22 | 141.1° | 161.9° |
| C7 | C6 | C5 | C24 | 164.6° | 101.6° |
| C7 | C6 | C5 | H28 | 76.0° | 137.0° |
| C6 | C7 | C8 | H29 | 129.8° | 148.0° |
| C6 | C7 | O6 | H31 | 65.6° | 180.0° |
| C2 | N1 | C1 | C3 | 179.2° | 180.0° |
| C2 | N1 | C3 | C4 | 6.4° | 180.0° |
| C2 | N1 | C3 | O1 | 174.7° | 0.0° |
| C2 | N1 | C1 | H1 | 180.0° | 90.0° |
| C2 | N1 | C1 | H2 | 60.0° | 150.0° |
| C2 | N1 | C1 | H3 | 60.0° | 30.0° |
| N1 | C2 | H14 | H15 | 120.0° | 120.1° |
| N1 | C2 | H14 | H16 | 120.0° | 120.0° |
| N1 | C2 | H15 | H16 | 120.0° | 120.0° |
| C13 | C14 | O3 | C6 | 174.3° | 160.6° |
| C14 | O3 | C6 | C17 | 137.4° | 92.3° |
| C14 | O3 | C6 | C5 | 100.8° | 141.6° |
| O3 | C14 | C13 | H5 | 0.6° | 0.5° |
| C19 | C18 | C17 | H12 | 180.0° | 180.0° |
| C18 | C19 | C20 | H13 | 180.0° | 180.0° |
| C19 | C18 | C17 | C6 | 179.9° | 179.7° |
| C19 | C18 | C17 | C22 | 0.9° | 0.0° |
| C18 | C19 | C20 | O7 | 179.8° | 180.0° |
| C18 | C19 | C20 | C21 | 0.3° | 0.0° |
| C17 | C18 | C19 | C20 | 0.6° | 0.0° |
| C18 | C17 | C6 | C22 | 179.2° | 179.7° |
| C18 | C17 | C6 | O3 | 159.4° | 96.8° |
| C18 | C17 | C6 | C5 | 80.9° | 138.4° |
| C18 | C17 | C22 | C21 | 0.8° | 0.0° |
| C17 | C18 | C19 | H13 | 179.4° | 180.0° |
| C18 | C17 | C22 | H18 | 179.2° | 180.0° |
| C1 | N1 | C3 | C4 | 174.6° | 0.0° |
| C1 | N1 | C3 | O1 | 4.4° | 180.0° |
| N1 | C1 | H1 | H2 | 120.0° | 120.0° |
| N1 | C1 | H1 | H3 | 120.0° | 120.0° |
| N1 | C1 | H2 | H3 | 120.0° | 120.0° |
| C1 | N1 | C2 | H14 | 180.0° | 0.0° |
| C1 | N1 | C2 | H15 | 60.0° | 120.0° |
| C1 | N1 | C2 | H16 | 60.0° | 120.0° |
| N1 | C3 | C4 | O1 | 179.0° | 180.0° |
| N1 | C3 | C4 | C5 | 161.5° | 180.0° |
| C3 | N1 | C1 | H1 | 0.9° | 90.0° |
| C3 | N1 | C1 | H2 | 120.9° | 30.0° |
| C3 | N1 | C1 | H3 | 119.2° | 150.0° |
| C3 | N1 | C2 | H14 | 0.9° | 179.9° |
| C3 | N1 | C2 | H15 | 119.1° | 60.0° |
| C3 | N1 | C2 | H16 | 120.9° | 60.0° |
| N1 | C3 | C4 | H27 | 40.1° | 58.9° |
| C3 | C4 | C5 | H27 | 121.6° | 121.1° |
| C3 | C4 | C5 | C6 | 167.4° | 119.7° |
| C3 | C4 | C5 | C24 | 64.2° | 120.8° |
| C3 | C4 | C5 | H28 | 55.5° | 0.1° |
| C3 | C4 | C8 | H29 | 83.1° | 103.1° |
| C4 | C5 | C6 | C17 | 92.3° | 141.2° |
| C4 | C5 | C6 | O3 | 148.3° | 92.7° |
| C4 | C5 | C6 | C24 | 128.5° | 119.3° |
| C4 | C5 | C6 | H28 | 112.1° | 119.3° |
| C5 | C4 | C3 | O1 | 19.5° | 0.0° |
| C4 | C5 | C24 | H28 | 119.5° | 121.0° |
| C4 | C5 | C24 | C25 | 18.4° | 123.0° |
| C4 | C5 | C24 | C29 | 164.0° | 56.7° |
| C5 | C4 | C8 | H29 | 152.2° | 137.4° |
| C19 | C20 | O7 | C23 | 5.1° | 180.0° |
| C19 | C20 | O7 | C21 | 179.6° | 180.0° |
| C19 | C20 | C21 | C22 | 0.2° | 0.0° |
| C20 | C19 | C18 | H12 | 179.4° | 180.0° |
| C19 | C20 | C21 | H17 | 179.7° | 180.0° |
| C17 | C6 | O3 | C5 | 121.8° | 126.0° |
| C17 | C6 | C5 | C24 | 36.3° | 21.9° |
| C6 | C17 | C22 | C21 | 180.0° | 179.7° |
| C6 | C17 | C18 | H12 | 0.1° | 0.3° |
| C6 | C17 | C22 | H18 | 0.0° | 0.3° |
| C17 | C6 | C5 | H28 | 155.6° | 99.5° |
| O3 | C6 | C17 | C22 | 21.4° | 82.9° |
| O3 | C6 | C5 | C24 | 83.1° | 148.0° |
| O3 | C6 | C5 | H28 | 36.3° | 26.6° |
| C5 | C6 | C17 | C22 | 98.3° | 41.9° |
| C6 | C5 | C24 | H28 | 119.1° | 121.7° |
| C6 | C5 | C24 | C25 | 103.1° | 119.6° |
| C6 | C5 | C24 | C29 | 74.5° | 60.7° |
| C6 | C5 | C4 | H27 | 71.0° | 119.3° |
| O1 | C3 | C4 | H27 | 140.9° | 121.1° |
| C17 | C22 | C21 | C20 | 0.6° | 0.0° |
| C17 | C22 | C21 | H18 | 180.0° | 180.0° |
| C22 | C17 | C18 | H12 | 179.1° | 180.0° |
| C17 | C22 | C21 | H17 | 179.4° | 180.0° |
| C23 | O7 | C20 | C21 | 174.5° | 0.1° |
| O7 | C23 | H19 | H20 | 120.0° | 120.0° |
| O7 | C23 | H19 | H21 | 120.0° | 120.0° |
| O7 | C23 | H20 | H21 | 120.0° | 120.0° |
| O7 | C20 | C21 | C22 | 179.8° | 179.9° |
| O7 | C20 | C19 | H13 | 0.2° | 0.0° |
| O7 | C20 | C21 | H17 | 0.2° | 0.1° |
| C20 | O7 | C23 | H19 | 180.0° | 60.0° |
| C20 | O7 | C23 | H20 | 60.0° | 60.0° |
| C20 | O7 | C23 | H21 | 60.0° | 180.0° |
| C20 | C21 | C22 | H17 | 180.0° | 180.0° |
| C21 | C20 | C19 | H13 | 179.7° | 180.0° |
| C20 | C21 | C22 | H18 | 179.4° | 180.0° |
| C5 | C24 | C25 | C29 | 177.7° | 179.7° |
| C5 | C24 | C25 | C26 | 179.5° | 179.7° |
| C5 | C24 | C29 | C28 | 179.4° | 179.7° |
| C5 | C24 | C25 | H22 | 0.6° | 0.4° |
| C5 | C24 | C29 | H26 | 0.6° | 0.3° |
| C24 | C5 | C4 | H27 | 57.4° | 0.2° |
| C24 | C25 | C26 | H22 | 180.0° | 179.9° |
| C25 | C24 | C29 | C28 | 1.7° | 0.0° |
| C24 | C25 | C26 | C27 | 0.9° | 0.1° |
| C24 | C25 | C26 | H23 | 179.1° | 179.9° |
| C25 | C24 | C29 | H26 | 178.3° | 180.0° |
| C25 | C24 | C5 | H28 | 137.9° | 2.0° |
| C29 | C24 | C25 | C26 | 1.8° | 0.1° |
| C24 | C29 | C28 | H26 | 180.0° | 180.0° |
| C24 | C29 | C28 | C27 | 0.8° | 0.0° |
| C29 | C24 | C25 | H22 | 178.2° | 180.0° |
| C24 | C29 | C28 | H25 | 179.2° | 180.0° |
| C29 | C24 | C5 | H28 | 44.5° | 177.6° |
| C25 | C26 | C27 | H23 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.1° | 0.1° |
| C25 | C26 | C27 | H24 | 179.9° | 180.0° |
| C29 | C28 | C27 | C26 | 0.1° | 0.0° |
| C29 | C28 | C27 | H25 | 180.0° | 180.0° |
| C29 | C28 | C27 | H24 | 179.9° | 179.9° |
| C26 | C27 | C28 | H24 | 180.0° | 179.9° |
| C27 | C26 | C25 | H22 | 179.1° | 180.0° |
| C26 | C27 | C28 | H25 | 179.9° | 180.0° |
| C28 | C27 | C26 | H23 | 179.9° | 179.9° |
| C27 | C28 | C29 | H26 | 179.2° | 180.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H6 | C15 | H7 | H8 | 120.0° | 120.0° |
| H9 | C16 | H10 | H11 | 120.0° | 119.9° |
| H12 | C18 | C19 | H13 | 0.6° | 0.0° |
| H14 | C2 | H15 | H16 | 120.0° | 119.9° |
| H17 | C21 | C22 | H18 | 0.6° | 0.0° |
| H19 | C23 | H20 | H21 | 120.0° | 120.0° |
| H22 | C25 | C26 | H23 | 0.9° | 0.0° |
| H23 | C26 | C27 | H24 | 0.0° | 0.0° |
| H24 | C27 | C28 | H25 | 0.1° | 0.1° |
| H25 | C28 | C29 | H26 | 0.8° | 0.0° |
| H27 | C4 | C5 | H28 | 177.1° | 121.2° |
| H27 | C4 | C8 | H29 | 37.7° | 17.9° |
| H29 | C8 | O2 | H30 | 57.4° | 58.4° |
