OB6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O02 | C16 | sing | 1.36Å | 1.36Å | |
| C17 | C16 | doub | 1.39Å | 1.32Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.37Å | Aromatic |
| C16 | C15 | sing | 1.39Å | 1.38Å | Aromatic |
| C02 | C03 | doub | 1.38Å | 1.36Å | Aromatic |
| C02 | C01 | sing | 1.39Å | 1.34Å | Aromatic |
| C18 | C13 | doub | 1.40Å | 1.36Å | Aromatic |
| O01 | C01 | sing | 1.36Å | 1.38Å | |
| C03 | C04 | sing | 1.40Å | 1.36Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.37Å | Aromatic |
| C01 | C06 | doub | 1.39Å | 1.36Å | Aromatic |
| C13 | C14 | sing | 1.40Å | 1.37Å | Aromatic |
| C13 | C08 | sing | 1.47Å | 1.38Å | |
| C04 | C07 | sing | 1.47Å | 1.41Å | |
| C04 | C05 | doub | 1.40Å | 1.35Å | Aromatic |
| C08 | C07 | doub | 1.36Å | 1.36Å | |
| C08 | C09 | sing | 1.53Å | 1.56Å | |
| C06 | C05 | sing | 1.38Å | 1.38Å | Aromatic |
| C07 | C12 | sing | 1.53Å | 1.54Å | |
| C25 | C26 | doub | 1.38Å | 1.34Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.34Å | Aromatic |
| C09 | O03 | sing | 1.47Å | 1.39Å | |
| C09 | C10 | sing | 1.56Å | 1.54Å | |
| O03 | C12 | sing | 1.47Å | 1.42Å | |
| C26 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| CL1 | C24 | sing | 1.74Å | 1.74Å | |
| C12 | C11 | sing | 1.55Å | 1.53Å | |
| C24 | C23 | doub | 1.38Å | 1.36Å | Aromatic |
| C21 | C20 | sing | 1.53Å | 1.54Å | |
| C10 | C11 | sing | 1.55Å | 1.54Å | |
| C10 | S01 | sing | 1.81Å | 1.74Å | |
| C19 | N01 | sing | 1.40Å | 1.28Å | |
| C19 | C22 | doub | 1.39Å | 1.36Å | Aromatic |
| C20 | N01 | sing | 1.47Å | 1.51Å | |
| N01 | S01 | sing | 1.66Å | 1.70Å | |
| C23 | C22 | sing | 1.38Å | 1.34Å | Aromatic |
| O04 | S01 | doub | 1.42Å | 1.41Å | |
| S01 | O05 | doub | 1.42Å | 1.45Å | |
| C02 | H1 | sing | 1.08Å | 1.08Å | |
| C03 | H2 | sing | 1.08Å | 1.08Å | |
| C05 | H3 | sing | 1.08Å | 1.08Å | |
| C06 | H4 | sing | 1.08Å | 1.08Å | |
| O01 | H5 | sing | 0.97Å | 0.95Å | |
| C09 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H12 | sing | 1.08Å | 1.08Å | |
| C17 | H13 | sing | 1.08Å | 1.08Å | |
| C18 | H14 | sing | 1.08Å | 1.08Å | |
| O02 | H15 | sing | 0.97Å | 0.95Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.08Å | 1.08Å | |
| C23 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H23 | sing | 1.08Å | 1.08Å | |
| C26 | H24 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O02 | C16 | C17 | 122.2° | 119.9° |
| O02 | C16 | C15 | 119.6° | 119.9° |
| C16 | O02 | H15 | 109.5° | 114.0° |
| C16 | C17 | C18 | 121.4° | 120.1° |
| C17 | C16 | C15 | 118.3° | 120.2° |
| C16 | C17 | H13 | 119.3° | 120.0° |
| C17 | C18 | C13 | 122.5° | 120.0° |
| C18 | C17 | H13 | 119.3° | 120.0° |
| C17 | C18 | H14 | 118.7° | 120.0° |
| C16 | C15 | C14 | 120.4° | 120.1° |
| C16 | C15 | H12 | 119.8° | 120.0° |
| C03 | C02 | C01 | 119.9° | 120.1° |
| C02 | C03 | C04 | 125.7° | 119.9° |
| C03 | C02 | H1 | 120.0° | 119.9° |
| C02 | C03 | H2 | 117.1° | 120.0° |
| C02 | C01 | O01 | 120.0° | 119.9° |
| C02 | C01 | C06 | 116.7° | 120.2° |
| C01 | C02 | H1 | 120.0° | 120.0° |
| C18 | C13 | C14 | 115.5° | 119.7° |
| C18 | C13 | C08 | 123.4° | 120.2° |
| C13 | C18 | H14 | 118.8° | 120.0° |
| O01 | C01 | C06 | 123.2° | 119.9° |
| C01 | O01 | H5 | 109.5° | 114.0° |
| C03 | C04 | C07 | 124.1° | 120.1° |
| C03 | C04 | C05 | 113.2° | 119.8° |
| C04 | C03 | H2 | 117.1° | 120.1° |
| C15 | C14 | C13 | 122.0° | 119.9° |
| C15 | C14 | H11 | 119.0° | 120.1° |
| C14 | C15 | H12 | 119.8° | 119.9° |
| C01 | C06 | C05 | 121.4° | 120.1° |
| C01 | C06 | H4 | 119.3° | 119.9° |
| C14 | C13 | C08 | 120.6° | 120.1° |
| C13 | C14 | H11 | 119.0° | 120.1° |
| C13 | C08 | C07 | 135.3° | 127.0° |
| C13 | C08 | C09 | 119.9° | 127.0° |
| C07 | C04 | C05 | 122.7° | 120.2° |
| C04 | C07 | C08 | 133.3° | 127.0° |
| C04 | C07 | C12 | 122.8° | 127.0° |
| C04 | C05 | C06 | 122.9° | 119.9° |
| C04 | C05 | H3 | 118.5° | 120.0° |
| C07 | C08 | C09 | 103.6° | 105.9° |
| C08 | C07 | C12 | 103.9° | 106.0° |
| C08 | C09 | O03 | 103.8° | 100.7° |
| C08 | C09 | C10 | 101.4° | 105.1° |
| C08 | C09 | H6 | 114.1° | 115.6° |
| C06 | C05 | H3 | 118.5° | 120.0° |
| C05 | C06 | H4 | 119.3° | 120.0° |
| C07 | C12 | O03 | 105.1° | 100.5° |
| C07 | C12 | C11 | 106.8° | 105.5° |
| C07 | C12 | H10 | 114.1° | 115.6° |
| C26 | C25 | C24 | 121.3° | 120.1° |
| C25 | C26 | C19 | 122.4° | 119.9° |
| C26 | C25 | H23 | 119.3° | 120.0° |
| C25 | C26 | H24 | 118.8° | 120.0° |
| C25 | C24 | CL1 | 122.0° | 119.9° |
| C25 | C24 | C23 | 117.9° | 120.1° |
| C24 | C25 | H23 | 119.4° | 119.9° |
| O03 | C09 | C10 | 103.8° | 101.1° |
| C09 | O03 | C12 | 96.5° | 96.8° |
| O03 | C09 | H6 | 117.3° | 116.0° |
| C09 | C10 | C11 | 99.9° | 101.9° |
| C09 | C10 | S01 | 114.5° | 111.0° |
| C10 | C09 | H6 | 114.5° | 116.1° |
| C09 | C10 | H7 | 111.0° | 111.0° |
| O03 | C12 | C11 | 98.9° | 101.2° |
| O03 | C12 | H10 | 116.2° | 116.6° |
| C26 | C19 | N01 | 124.4° | 120.0° |
| C26 | C19 | C22 | 114.3° | 119.9° |
| C19 | C26 | H24 | 118.8° | 120.0° |
| CL1 | C24 | C23 | 119.9° | 120.0° |
| C12 | C11 | C10 | 100.5° | 102.0° |
| C12 | C11 | H8 | 111.6° | 111.0° |
| C12 | C11 | H9 | 111.7° | 110.9° |
| C11 | C12 | H10 | 114.2° | 115.4° |
| C24 | C23 | C22 | 120.4° | 120.1° |
| C24 | C23 | H22 | 119.8° | 119.9° |
| C21 | C20 | N01 | 113.1° | 109.4° |
| C21 | C20 | H16 | 108.6° | 109.5° |
| C21 | C20 | H17 | 108.6° | 109.4° |
| C20 | C21 | H18 | 109.5° | 109.4° |
| C20 | C21 | H19 | 109.5° | 109.4° |
| C20 | C21 | H20 | 109.4° | 109.4° |
| C11 | C10 | S01 | 111.6° | 110.9° |
| C11 | C10 | H7 | 111.1° | 110.9° |
| C10 | C11 | H8 | 111.7° | 110.9° |
| C10 | C11 | H9 | 111.6° | 111.0° |
| C10 | S01 | N01 | 105.6° | 104.5° |
| C10 | S01 | O04 | 108.3° | 110.6° |
| C10 | S01 | O05 | 107.4° | 110.5° |
| S01 | C10 | H7 | 108.5° | 110.9° |
| N01 | C19 | C22 | 121.2° | 120.1° |
| C19 | N01 | C20 | 119.8° | 120.0° |
| C19 | N01 | S01 | 121.4° | 120.1° |
| C19 | C22 | C23 | 123.5° | 119.9° |
| C19 | C22 | H21 | 118.3° | 120.0° |
| C20 | N01 | S01 | 118.7° | 120.0° |
| N01 | C20 | H16 | 108.5° | 109.5° |
| N01 | C20 | H17 | 108.6° | 109.5° |
| N01 | S01 | O04 | 103.1° | 104.3° |
| N01 | S01 | O05 | 97.9° | 104.2° |
| C23 | C22 | H21 | 118.3° | 120.1° |
| C22 | C23 | H22 | 119.8° | 120.0° |
| O04 | S01 | O05 | 131.4° | 121.0° |
| H8 | C11 | H9 | 109.5° | 110.8° |
| H16 | C20 | H17 | 109.4° | 109.5° |
| H18 | C21 | H19 | 109.5° | 109.6° |
| H18 | C21 | H20 | 109.5° | 109.5° |
| H19 | C21 | H20 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O02 | C16 | C17 | C15 | 179.3° | 180.0° |
| O02 | C16 | C17 | C18 | 180.0° | 179.7° |
| O02 | C16 | C15 | C14 | 179.7° | 180.0° |
| O02 | C16 | C15 | H12 | 0.3° | 0.0° |
| O02 | C16 | C17 | H13 | 0.1° | 0.1° |
| C16 | C17 | C18 | H13 | 180.0° | 179.8° |
| C16 | C17 | C18 | C13 | 1.5° | 0.5° |
| C17 | C16 | C15 | C14 | 0.3° | 0.0° |
| C17 | C16 | C15 | H12 | 179.6° | 180.0° |
| C16 | C17 | C18 | H14 | 178.5° | 180.0° |
| C17 | C16 | O02 | H15 | 180.0° | 90.0° |
| C18 | C17 | C16 | C15 | 0.6° | 0.2° |
| C17 | C18 | C13 | H14 | 180.0° | 179.5° |
| C17 | C18 | C13 | C14 | 2.0° | 0.5° |
| C17 | C18 | C13 | C08 | 173.9° | 179.7° |
| C16 | C15 | C14 | H12 | 180.0° | 180.0° |
| C16 | C15 | C14 | C13 | 0.9° | 0.0° |
| C16 | C15 | C14 | H11 | 179.1° | 180.0° |
| C15 | C16 | C17 | H13 | 179.4° | 179.9° |
| C15 | C16 | O02 | H15 | 0.7° | 90.0° |
| C03 | C02 | C01 | H1 | 180.0° | 180.0° |
| C03 | C02 | C01 | O01 | 179.2° | 179.7° |
| C02 | C03 | C04 | H2 | 180.0° | 179.9° |
| C03 | C02 | C01 | C06 | 2.6° | 0.0° |
| C02 | C03 | C04 | C07 | 179.2° | 180.0° |
| C02 | C03 | C04 | C05 | 0.5° | 0.0° |
| C02 | C01 | O01 | C06 | 176.4° | 179.7° |
| C01 | C02 | C03 | C04 | 1.3° | 0.0° |
| C02 | C01 | C06 | C05 | 3.3° | 0.0° |
| C01 | C02 | C03 | H2 | 178.7° | 179.9° |
| C02 | C01 | C06 | H4 | 176.7° | 180.0° |
| C02 | C01 | O01 | H5 | 180.0° | 89.7° |
| C18 | C13 | C14 | C15 | 1.6° | 0.3° |
| C18 | C13 | C14 | C08 | 172.2° | 179.8° |
| C18 | C13 | C08 | C07 | 144.3° | 115.2° |
| C18 | C13 | C08 | C09 | 50.2° | 64.8° |
| C18 | C13 | C14 | H11 | 178.4° | 179.8° |
| C13 | C18 | C17 | H13 | 178.5° | 179.7° |
| O01 | C01 | C06 | C05 | 179.8° | 179.7° |
| O01 | C01 | C02 | H1 | 0.8° | 0.3° |
| O01 | C01 | C06 | H4 | 0.2° | 0.2° |
| C03 | C04 | C07 | C05 | 179.7° | 180.0° |
| C03 | C04 | C07 | C08 | 26.0° | 65.3° |
| C03 | C04 | C05 | C06 | 1.2° | 0.1° |
| C03 | C04 | C07 | C12 | 153.4° | 115.1° |
| C04 | C03 | C02 | H1 | 178.7° | 180.0° |
| C03 | C04 | C05 | H3 | 178.8° | 180.0° |
| C15 | C14 | C13 | H11 | 180.0° | 180.0° |
| C15 | C14 | C13 | C08 | 173.8° | 180.0° |
| C01 | C06 | C05 | C04 | 2.7° | 0.1° |
| C01 | C06 | C05 | H4 | 180.0° | 179.9° |
| C06 | C01 | C02 | H1 | 177.4° | 180.0° |
| C01 | C06 | C05 | H3 | 177.3° | 180.0° |
| C06 | C01 | O01 | H5 | 3.6° | 90.0° |
| C14 | C13 | C08 | C07 | 44.2° | 65.0° |
| C14 | C13 | C08 | C09 | 121.3° | 115.0° |
| C13 | C14 | C15 | H12 | 179.1° | 180.0° |
| C14 | C13 | C18 | H14 | 178.0° | 180.0° |
| C13 | C08 | C07 | C04 | 10.3° | 0.1° |
| C13 | C08 | C07 | C09 | 167.1° | 180.0° |
| C13 | C08 | C07 | C12 | 170.1° | 179.7° |
| C13 | C08 | C09 | O03 | 156.3° | 147.8° |
| C13 | C08 | C09 | C10 | 96.2° | 107.4° |
| C13 | C08 | C09 | H6 | 27.5° | 22.1° |
| C08 | C13 | C14 | H11 | 6.2° | 0.0° |
| C08 | C13 | C18 | H14 | 6.1° | 0.2° |
| C04 | C07 | C08 | C12 | 179.5° | 179.7° |
| C04 | C07 | C08 | C09 | 177.4° | 179.9° |
| C07 | C04 | C05 | C06 | 178.6° | 179.9° |
| C04 | C07 | C12 | O03 | 151.6° | 147.8° |
| C04 | C07 | C12 | C11 | 104.0° | 107.3° |
| C07 | C04 | C03 | H2 | 0.8° | 0.0° |
| C07 | C04 | C05 | H3 | 1.5° | 0.0° |
| C04 | C07 | C12 | H10 | 23.2° | 21.4° |
| C05 | C04 | C07 | C08 | 154.2° | 114.7° |
| C04 | C05 | C06 | H3 | 180.0° | 179.9° |
| C05 | C04 | C07 | C12 | 26.3° | 64.9° |
| C05 | C04 | C03 | H2 | 179.5° | 180.0° |
| C04 | C05 | C06 | H4 | 177.3° | 180.0° |
| C07 | C08 | C09 | O03 | 34.1° | 32.2° |
| C07 | C08 | C09 | C10 | 73.4° | 72.6° |
| C08 | C07 | C12 | O03 | 28.0° | 32.5° |
| C08 | C07 | C12 | C11 | 76.5° | 72.3° |
| C07 | C08 | C09 | H6 | 163.0° | 158.0° |
| C08 | C07 | C12 | H10 | 156.4° | 158.9° |
| C09 | C08 | C07 | C12 | 3.1° | 0.3° |
| C08 | C09 | O03 | C10 | 105.7° | 107.9° |
| C08 | C09 | O03 | H6 | 126.9° | 125.5° |
| C08 | C09 | C10 | H6 | 123.4° | 129.2° |
| C08 | C09 | O03 | C12 | 49.5° | 50.7° |
| C08 | C09 | C10 | C11 | 80.2° | 69.7° |
| C08 | C09 | C10 | S01 | 160.4° | 172.2° |
| C08 | C09 | C10 | H7 | 37.1° | 48.5° |
| C07 | C12 | O03 | C09 | 48.1° | 50.8° |
| C07 | C12 | O03 | C11 | 110.2° | 108.2° |
| C07 | C12 | O03 | H10 | 127.2° | 125.7° |
| C07 | C12 | C11 | H10 | 127.2° | 128.9° |
| C07 | C12 | C11 | C10 | 65.0° | 69.5° |
| C07 | C12 | C11 | H8 | 53.5° | 172.3° |
| C07 | C12 | C11 | H9 | 176.4° | 48.7° |
| C26 | C25 | C24 | H23 | 180.0° | 179.5° |
| C25 | C26 | C19 | H24 | 180.0° | 179.5° |
| C26 | C25 | C24 | CL1 | 180.0° | 179.7° |
| C26 | C25 | C24 | C23 | 4.1° | 0.3° |
| C25 | C26 | C19 | N01 | 179.8° | 179.7° |
| C25 | C26 | C19 | C22 | 3.0° | 0.5° |
| C24 | C25 | C26 | C19 | 3.6° | 0.5° |
| C25 | C24 | CL1 | C23 | 175.8° | 180.0° |
| C25 | C24 | C23 | C22 | 4.3° | 0.0° |
| C25 | C24 | C23 | H22 | 175.7° | 180.0° |
| C24 | C25 | C26 | H24 | 176.4° | 180.0° |
| O03 | C09 | C10 | H6 | 129.1° | 126.4° |
| C09 | O03 | C12 | C11 | 62.1° | 57.4° |
| O03 | C09 | C10 | C11 | 27.3° | 34.8° |
| O03 | C09 | C10 | S01 | 92.1° | 83.3° |
| O03 | C09 | C10 | H7 | 144.6° | 152.9° |
| C09 | O03 | C12 | H10 | 175.3° | 176.6° |
| C10 | C09 | O03 | C12 | 56.2° | 57.2° |
| C09 | C10 | C11 | C12 | 10.2° | 0.1° |
| C09 | C10 | C11 | S01 | 121.5° | 118.2° |
| C09 | C10 | C11 | H7 | 117.3° | 118.2° |
| C09 | C10 | S01 | H7 | 124.7° | 123.8° |
| C09 | C10 | S01 | N01 | 65.8° | 179.6° |
| C09 | C10 | S01 | O04 | 44.1° | 67.9° |
| C09 | C10 | S01 | O05 | 169.5° | 68.9° |
| C09 | C10 | C11 | H8 | 128.7° | 118.1° |
| C09 | C10 | C11 | H9 | 108.4° | 118.2° |
| O03 | C12 | C11 | H10 | 124.1° | 126.8° |
| O03 | C12 | C11 | C10 | 43.8° | 34.9° |
| C12 | O03 | C09 | H6 | 176.4° | 176.3° |
| O03 | C12 | C11 | H8 | 162.3° | 83.4° |
| O03 | C12 | C11 | H9 | 74.8° | 153.0° |
| C26 | C19 | N01 | C22 | 177.0° | 179.8° |
| C26 | C19 | N01 | C20 | 67.0° | 153.8° |
| C26 | C19 | N01 | S01 | 112.9° | 26.2° |
| C26 | C19 | C22 | C23 | 3.3° | 0.3° |
| C26 | C19 | C22 | H21 | 176.7° | 179.8° |
| C19 | C26 | C25 | H23 | 176.4° | 180.0° |
| CL1 | C24 | C23 | C22 | 179.7° | 180.0° |
| CL1 | C24 | C23 | H22 | 0.3° | 0.0° |
| CL1 | C24 | C25 | H23 | 0.0° | 0.2° |
| C12 | C11 | C10 | H8 | 118.5° | 118.2° |
| C12 | C11 | C10 | H9 | 118.6° | 118.1° |
| C12 | C11 | C10 | S01 | 131.7° | 118.3° |
| C12 | C11 | C10 | H7 | 107.1° | 118.1° |
| C12 | C11 | H8 | H9 | 124.2° | 123.6° |
| C24 | C23 | C22 | C19 | 4.1° | 0.0° |
| C24 | C23 | C22 | H22 | 180.0° | 180.0° |
| C24 | C23 | C22 | H21 | 175.9° | 180.0° |
| C23 | C24 | C25 | H23 | 175.9° | 179.8° |
| C21 | C20 | N01 | C19 | 0.1° | 85.0° |
| C21 | C20 | N01 | H16 | 120.5° | 120.0° |
| C21 | C20 | N01 | H17 | 120.6° | 119.9° |
| C21 | C20 | N01 | S01 | 180.0° | 95.0° |
| C21 | C20 | H16 | H17 | 118.3° | 120.0° |
| C20 | C21 | H18 | H19 | 120.0° | 120.0° |
| C20 | C21 | H18 | H20 | 120.0° | 120.0° |
| C20 | C21 | H19 | H20 | 120.0° | 119.9° |
| C11 | C10 | S01 | H7 | 122.7° | 123.7° |
| C11 | C10 | S01 | N01 | 178.4° | 67.0° |
| C11 | C10 | S01 | O04 | 68.5° | 44.7° |
| C11 | C10 | S01 | O05 | 77.8° | 178.6° |
| C11 | C10 | C09 | H6 | 156.5° | 161.2° |
| C10 | C11 | H8 | H9 | 124.2° | 123.7° |
| C10 | C11 | C12 | H10 | 167.8° | 161.6° |
| C10 | S01 | N01 | C19 | 51.7° | 67.1° |
| C10 | S01 | N01 | C20 | 128.3° | 112.8° |
| C10 | S01 | N01 | O04 | 113.5° | 116.1° |
| C10 | S01 | N01 | O05 | 110.6° | 116.0° |
| C10 | S01 | O04 | O05 | 135.2° | 131.5° |
| S01 | C10 | C09 | H6 | 37.0° | 43.1° |
| S01 | C10 | C11 | H8 | 109.8° | 0.0° |
| S01 | C10 | C11 | H9 | 13.1° | 123.6° |
| C19 | N01 | C20 | S01 | 180.0° | 179.9° |
| N01 | C19 | C22 | C23 | 179.4° | 179.9° |
| C19 | N01 | S01 | O04 | 165.2° | 176.8° |
| C19 | N01 | S01 | O05 | 58.9° | 48.9° |
| C19 | N01 | C20 | H16 | 120.5° | 35.0° |
| C19 | N01 | C20 | H17 | 120.6° | 155.0° |
| N01 | C19 | C22 | H21 | 0.6° | 0.0° |
| N01 | C19 | C26 | H24 | 0.2° | 0.2° |
| C22 | C19 | N01 | C20 | 116.0° | 25.9° |
| C22 | C19 | N01 | S01 | 64.1° | 154.0° |
| C19 | C22 | C23 | H21 | 180.0° | 179.9° |
| C19 | C22 | C23 | H22 | 175.9° | 180.0° |
| C22 | C19 | C26 | H24 | 177.0° | 180.0° |
| C20 | N01 | S01 | O04 | 14.7° | 3.3° |
| C20 | N01 | S01 | O05 | 121.2° | 131.1° |
| N01 | C20 | H16 | H17 | 118.3° | 120.0° |
| N01 | C20 | C21 | H18 | 180.0° | 60.0° |
| N01 | C20 | C21 | H19 | 60.0° | 60.0° |
| N01 | C20 | C21 | H20 | 60.0° | 180.0° |
| N01 | S01 | O04 | O05 | 113.2° | 116.7° |
| N01 | S01 | C10 | H7 | 58.8° | 56.6° |
| S01 | N01 | C20 | H16 | 59.5° | 145.0° |
| S01 | N01 | C20 | H17 | 59.4° | 24.9° |
| O04 | S01 | C10 | H7 | 168.7° | 168.3° |
| O05 | S01 | C10 | H7 | 44.9° | 54.9° |
| H1 | C02 | C03 | H2 | 1.3° | 0.1° |
| H3 | C05 | C06 | H4 | 2.7° | 0.1° |
| H6 | C09 | C10 | H7 | 86.2° | 80.7° |
| H7 | C10 | C11 | H8 | 11.4° | 123.7° |
| H7 | C10 | C11 | H9 | 134.3° | 0.0° |
| H8 | C11 | C12 | H10 | 73.6° | 43.4° |
| H9 | C11 | C12 | H10 | 49.3° | 80.2° |
| H11 | C14 | C15 | H12 | 0.9° | 0.1° |
| H13 | C17 | C18 | H14 | 1.5° | 0.2° |
| H16 | C20 | C21 | H18 | 59.5° | 180.0° |
| H16 | C20 | C21 | H19 | 60.6° | 59.9° |
| H16 | C20 | C21 | H20 | 179.5° | 60.0° |
| H17 | C20 | C21 | H18 | 59.4° | 59.9° |
| H17 | C20 | C21 | H19 | 179.5° | 180.0° |
| H17 | C20 | C21 | H20 | 60.6° | 60.1° |
| H18 | C21 | H19 | H20 | 120.0° | 120.1° |
| H21 | C22 | C23 | H22 | 4.1° | 0.1° |
| H23 | C25 | C26 | H24 | 3.6° | 0.5° |
