A1BCW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O2 | sing | 1.43Å | 1.43Å | |
| O2 | C3 | sing | 1.36Å | 1.37Å | |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C11 | doub | 1.41Å | 1.40Å | Aromatic |
| C11 | C7 | sing | 1.41Å | 1.41Å | Aromatic |
| C7 | N8 | sing | 1.38Å | 1.39Å | Aromatic |
| N8 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | C12 | sing | 1.47Å | 1.48Å | |
| C12 | N14 | sing | 1.35Å | 1.34Å | |
| N14 | C15 | sing | 1.47Å | 1.45Å | |
| C15 | C21 | sing | 1.51Å | 1.53Å | |
| C21 | N23 | sing | 1.35Å | 1.34Å | |
| N23 | C24 | sing | 1.47Å | 1.46Å | |
| C24 | C26 | sing | 1.53Å | 1.52Å | |
| C26 | O38 | sing | 1.43Å | 1.42Å | |
| C24 | C34 | sing | 1.53Å | 1.53Å | |
| C34 | C36 | sing | 1.53Å | 1.52Å | |
| S37 | C36 | sing | 1.81Å | 1.78Å | |
| S37 | O39 | doub | 1.42Å | 1.44Å | |
| S37 | C40 | sing | 1.81Å | 1.75Å | |
| S37 | O41 | doub | 1.42Å | 1.44Å | |
| C21 | O22 | doub | 1.21Å | 1.23Å | |
| C15 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | C42 | sing | 1.53Å | 1.53Å | |
| C42 | C43 | sing | 1.53Å | 1.49Å | |
| C43 | C44 | sing | 1.53Å | 1.49Å | |
| C12 | O13 | doub | 1.22Å | 1.23Å | |
| C9 | C10 | doub | 1.36Å | 1.37Å | Aromatic |
| C7 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.41Å | 1.43Å | Aromatic |
| C44 | C42 | sing | 1.53Å | 1.49Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H170 | sing | 1.09Å | 1.10Å | |
| C24 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H260 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C34 | H340 | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C36 | H32 | sing | 1.09Å | 1.10Å | |
| C36 | H33 | sing | 1.09Å | 1.10Å | |
| C40 | H40C | sing | 1.09Å | 1.10Å | |
| C40 | H40A | sing | 1.09Å | 1.10Å | |
| C40 | H40B | sing | 1.09Å | 1.10Å | |
| C42 | H42 | sing | 1.09Å | 1.10Å | |
| C43 | H43B | sing | 1.09Å | 1.10Å | |
| C43 | H43A | sing | 1.09Å | 1.10Å | |
| C44 | H44B | sing | 1.09Å | 1.10Å | |
| C44 | H44A | sing | 1.09Å | 1.10Å | |
| N14 | H9 | sing | 0.97Å | 1.00Å | |
| N23 | H20 | sing | 0.97Å | 1.00Å | |
| N8 | H7 | sing | 0.97Å | 1.00Å | |
| O38 | H38 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | O2 | C3 | 117.5° | 117.0° |
| O2 | C1 | H3 | 109.5° | 109.5° |
| O2 | C1 | H2 | 109.5° | 109.4° |
| O2 | C1 | H1 | 109.4° | 109.4° |
| O2 | C3 | C4 | 124.6° | 120.2° |
| O2 | C3 | C11 | 115.3° | 120.2° |
| C3 | C4 | C5 | 120.3° | 120.4° |
| C4 | C3 | C11 | 120.0° | 119.6° |
| C3 | C4 | H4 | 119.9° | 119.8° |
| C4 | C5 | C6 | 121.3° | 120.7° |
| C5 | C4 | H4 | 119.9° | 119.8° |
| C4 | C5 | H5 | 119.4° | 119.6° |
| C5 | C6 | C7 | 118.1° | 120.1° |
| C6 | C5 | H5 | 119.3° | 119.7° |
| C5 | C6 | H6 | 120.9° | 120.0° |
| C3 | C11 | C7 | 118.3° | 119.6° |
| C3 | C11 | C10 | 135.2° | 133.4° |
| C11 | C7 | N8 | 107.8° | 107.3° |
| C11 | C7 | C6 | 122.0° | 119.6° |
| C7 | C11 | C10 | 106.5° | 107.0° |
| C7 | N8 | C9 | 108.9° | 108.8° |
| N8 | C7 | C6 | 130.2° | 133.1° |
| C7 | N8 | H7 | 125.6° | 125.6° |
| N8 | C9 | C12 | 119.3° | 125.5° |
| N8 | C9 | C10 | 109.1° | 109.1° |
| C9 | N8 | H7 | 125.5° | 125.6° |
| C9 | C12 | N14 | 116.2° | 120.0° |
| C9 | C12 | O13 | 120.9° | 120.0° |
| C12 | C9 | C10 | 131.5° | 125.4° |
| C12 | N14 | C15 | 122.1° | 120.0° |
| N14 | C12 | O13 | 122.9° | 120.0° |
| C12 | N14 | H9 | 119.0° | 120.0° |
| N14 | C15 | C21 | 112.6° | 109.5° |
| N14 | C15 | C17 | 110.6° | 109.4° |
| N14 | C15 | H10 | 108.2° | 109.5° |
| C15 | N14 | H9 | 118.9° | 120.0° |
| C15 | C21 | N23 | 116.1° | 120.0° |
| C15 | C21 | O22 | 120.7° | 120.0° |
| C21 | C15 | C17 | 110.5° | 109.5° |
| C21 | C15 | H10 | 107.3° | 109.4° |
| C21 | N23 | C24 | 123.6° | 120.0° |
| N23 | C21 | O22 | 123.2° | 120.0° |
| C21 | N23 | H20 | 118.2° | 120.1° |
| N23 | C24 | C26 | 109.3° | 109.4° |
| N23 | C24 | C34 | 110.5° | 109.5° |
| N23 | C24 | H21 | 108.9° | 109.5° |
| C24 | N23 | H20 | 118.2° | 119.9° |
| C24 | C26 | O38 | 111.3° | 109.5° |
| C26 | C24 | C34 | 111.9° | 109.5° |
| C26 | C24 | H21 | 108.2° | 109.5° |
| C24 | C26 | H260 | 109.0° | 109.5° |
| C24 | C26 | H26 | 109.0° | 109.4° |
| O38 | C26 | H260 | 109.1° | 109.5° |
| O38 | C26 | H26 | 109.0° | 109.5° |
| C26 | O38 | H38 | 109.5° | 114.0° |
| C24 | C34 | C36 | 113.1° | 109.5° |
| C34 | C24 | H21 | 108.0° | 109.5° |
| C24 | C34 | H340 | 108.6° | 109.5° |
| C24 | C34 | H34 | 108.6° | 109.5° |
| C34 | C36 | S37 | 112.4° | 109.5° |
| C36 | C34 | H340 | 108.5° | 109.5° |
| C36 | C34 | H34 | 108.5° | 109.5° |
| C34 | C36 | H32 | 108.7° | 109.4° |
| C34 | C36 | H33 | 108.7° | 109.5° |
| C36 | S37 | O39 | 108.2° | 108.6° |
| C36 | S37 | C40 | 104.6° | 101.9° |
| C36 | S37 | O41 | 108.2° | 108.6° |
| S37 | C36 | H32 | 108.7° | 109.5° |
| S37 | C36 | H33 | 108.7° | 109.4° |
| O39 | S37 | C40 | 108.9° | 108.5° |
| O39 | S37 | O41 | 117.3° | 119.2° |
| C40 | S37 | O41 | 108.9° | 108.6° |
| S37 | C40 | H40C | 109.5° | 109.5° |
| S37 | C40 | H40A | 109.5° | 109.5° |
| S37 | C40 | H40B | 109.5° | 109.4° |
| C15 | C17 | C42 | 114.3° | 109.5° |
| C17 | C15 | H10 | 107.3° | 109.5° |
| C15 | C17 | H17 | 108.3° | 109.5° |
| C15 | C17 | H170 | 108.2° | 109.4° |
| C17 | C42 | C43 | 119.7° | 117.5° |
| C17 | C42 | C44 | 119.8° | 117.5° |
| C42 | C17 | H17 | 108.2° | 109.5° |
| C42 | C17 | H170 | 108.3° | 109.5° |
| C17 | C42 | H42 | 115.0° | 115.5° |
| C42 | C43 | C44 | 60.0° | 60.0° |
| C43 | C42 | C44 | 60.0° | 60.0° |
| C43 | C42 | H42 | 115.7° | 117.5° |
| C42 | C43 | H43B | 120.0° | 117.5° |
| C42 | C43 | H43A | 120.0° | 117.6° |
| C43 | C44 | C42 | 60.0° | 60.0° |
| C44 | C43 | H43B | 120.0° | 117.5° |
| C44 | C43 | H43A | 120.0° | 117.5° |
| C43 | C44 | H44B | 120.0° | 117.5° |
| C43 | C44 | H44A | 120.0° | 117.5° |
| C9 | C10 | C11 | 107.7° | 107.7° |
| C9 | C10 | H8 | 126.2° | 126.2° |
| C7 | C6 | H6 | 120.9° | 119.9° |
| C11 | C10 | H8 | 126.2° | 126.1° |
| C44 | C42 | H42 | 115.7° | 117.5° |
| C42 | C44 | H44B | 120.0° | 117.5° |
| C42 | C44 | H44A | 120.0° | 117.5° |
| H17 | C17 | H170 | 109.5° | 109.5° |
| H260 | C26 | H26 | 109.5° | 109.4° |
| H3 | C1 | H2 | 109.5° | 109.5° |
| H3 | C1 | H1 | 109.5° | 109.5° |
| H2 | C1 | H1 | 109.5° | 109.5° |
| H340 | C34 | H34 | 109.5° | 109.5° |
| H32 | C36 | H33 | 109.5° | 109.5° |
| H40C | C40 | H40A | 109.5° | 109.4° |
| H40C | C40 | H40B | 109.5° | 109.5° |
| H40A | C40 | H40B | 109.5° | 109.5° |
| H43B | C43 | H43A | 109.5° | 115.5° |
| H44B | C44 | H44A | 109.4° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | O2 | C3 | C4 | 4.6° | 0.0° |
| C1 | O2 | C3 | C11 | 174.1° | 179.5° |
| O2 | C1 | H3 | H2 | 120.0° | 120.0° |
| O2 | C1 | H3 | H1 | 120.0° | 120.0° |
| O2 | C1 | H2 | H1 | 120.0° | 120.0° |
| O2 | C3 | C4 | C11 | 178.7° | 179.4° |
| O2 | C3 | C4 | C5 | 178.7° | 180.0° |
| O2 | C3 | C11 | C7 | 178.7° | 180.0° |
| O2 | C3 | C11 | C10 | 0.3° | 0.4° |
| O2 | C3 | C4 | H4 | 1.4° | 0.3° |
| C3 | O2 | C1 | H3 | 180.0° | 180.0° |
| C3 | O2 | C1 | H2 | 60.0° | 60.0° |
| C3 | O2 | C1 | H1 | 60.0° | 60.0° |
| C3 | C4 | C5 | H4 | 180.0° | 179.7° |
| C3 | C4 | C5 | C6 | 0.0° | 0.3° |
| C4 | C3 | C11 | C7 | 0.1° | 0.6° |
| C4 | C3 | C11 | C10 | 179.1° | 179.9° |
| C3 | C4 | C5 | H5 | 180.0° | 179.7° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C5 | C4 | C3 | C11 | 0.1° | 0.5° |
| C4 | C5 | C6 | C7 | 0.0° | 0.0° |
| C4 | C5 | C6 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C11 | 0.0° | 0.0° |
| C5 | C6 | C7 | N8 | 179.1° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C6 | C5 | C4 | H4 | 180.0° | 180.0° |
| C3 | C11 | C7 | C10 | 179.3° | 179.7° |
| C3 | C11 | C7 | N8 | 179.2° | 179.7° |
| C3 | C11 | C10 | C9 | 179.0° | 179.6° |
| C3 | C11 | C7 | C6 | 0.1° | 0.3° |
| C11 | C3 | C4 | H4 | 179.9° | 179.7° |
| C3 | C11 | C10 | H8 | 1.0° | 0.4° |
| C11 | C7 | N8 | C6 | 179.2° | 180.0° |
| C11 | C7 | N8 | C9 | 0.0° | 0.1° |
| C7 | C11 | C10 | C9 | 0.1° | 0.0° |
| C11 | C7 | C6 | H6 | 180.0° | 180.0° |
| C7 | C11 | C10 | H8 | 179.9° | 180.0° |
| C11 | C7 | N8 | H7 | 180.0° | 180.0° |
| C7 | N8 | C9 | H7 | 180.0° | 179.9° |
| C7 | N8 | C9 | C12 | 178.5° | 180.0° |
| C7 | N8 | C9 | C10 | 0.1° | 0.0° |
| N8 | C7 | C11 | C10 | 0.0° | 0.1° |
| N8 | C7 | C6 | H6 | 0.9° | 0.0° |
| N8 | C9 | C12 | C10 | 178.2° | 180.0° |
| N8 | C9 | C12 | N14 | 179.2° | 0.0° |
| N8 | C9 | C12 | O13 | 1.0° | 180.0° |
| C9 | N8 | C7 | C6 | 179.2° | 180.0° |
| N8 | C9 | C10 | C11 | 0.1° | 0.0° |
| N8 | C9 | C10 | H8 | 179.9° | 180.0° |
| C9 | C12 | N14 | O13 | 179.8° | 180.0° |
| C9 | C12 | N14 | C15 | 178.0° | 180.0° |
| C12 | C9 | C10 | C11 | 178.3° | 180.0° |
| C12 | C9 | C10 | H8 | 1.7° | 0.0° |
| C9 | C12 | N14 | H9 | 1.9° | 0.1° |
| C12 | C9 | N8 | H7 | 1.5° | 0.0° |
| C12 | N14 | C15 | H9 | 180.0° | 179.9° |
| C12 | N14 | C15 | C21 | 63.2° | 155.0° |
| C12 | N14 | C15 | C17 | 172.7° | 85.1° |
| N14 | C12 | C9 | C10 | 2.6° | 180.0° |
| C12 | N14 | C15 | H10 | 55.3° | 35.0° |
| N14 | C15 | C21 | C17 | 124.2° | 120.0° |
| N14 | C15 | C21 | H10 | 119.0° | 120.0° |
| N14 | C15 | C21 | N23 | 144.9° | 179.9° |
| N14 | C15 | C21 | O22 | 35.0° | 0.0° |
| N14 | C15 | C17 | H10 | 117.9° | 120.0° |
| N14 | C15 | C17 | C42 | 62.7° | 65.0° |
| C15 | N14 | C12 | O13 | 1.8° | 0.0° |
| N14 | C15 | C17 | H17 | 58.0° | 55.0° |
| N14 | C15 | C17 | H170 | 176.6° | 175.0° |
| C15 | C21 | N23 | O22 | 179.9° | 179.9° |
| C15 | C21 | N23 | C24 | 178.3° | 180.0° |
| C21 | C15 | C17 | H10 | 116.8° | 120.0° |
| C21 | C15 | C17 | C42 | 171.9° | 175.0° |
| C21 | C15 | C17 | H17 | 67.4° | 65.0° |
| C21 | C15 | C17 | H170 | 51.2° | 55.0° |
| C21 | C15 | N14 | H9 | 116.9° | 24.9° |
| C15 | C21 | N23 | H20 | 1.7° | 0.1° |
| C21 | N23 | C24 | H20 | 180.0° | 179.9° |
| C21 | N23 | C24 | C26 | 128.3° | 85.1° |
| C21 | N23 | C24 | C34 | 108.1° | 154.9° |
| N23 | C21 | C15 | C17 | 90.9° | 60.0° |
| N23 | C21 | C15 | H10 | 25.9° | 60.1° |
| C21 | N23 | C24 | H21 | 10.4° | 34.9° |
| N23 | C24 | C26 | C34 | 122.7° | 120.0° |
| N23 | C24 | C26 | H21 | 118.4° | 120.0° |
| N23 | C24 | C26 | O38 | 177.5° | 65.0° |
| N23 | C24 | C34 | H21 | 119.0° | 120.0° |
| N23 | C24 | C34 | C36 | 70.3° | 65.0° |
| C24 | N23 | C21 | O22 | 1.7° | 0.1° |
| N23 | C24 | C26 | H260 | 62.2° | 55.0° |
| N23 | C24 | C26 | H26 | 57.2° | 175.0° |
| N23 | C24 | C34 | H340 | 50.2° | 55.0° |
| N23 | C24 | C34 | H34 | 169.2° | 175.0° |
| C24 | C26 | O38 | H260 | 120.3° | 120.0° |
| C24 | C26 | O38 | H26 | 120.3° | 120.0° |
| C26 | C24 | C34 | H21 | 119.0° | 120.0° |
| C26 | C24 | C34 | C36 | 167.7° | 175.0° |
| C24 | C26 | H260 | H26 | 119.1° | 119.9° |
| C26 | C24 | C34 | H340 | 71.8° | 65.0° |
| C26 | C24 | C34 | H34 | 47.2° | 55.0° |
| C26 | C24 | N23 | H20 | 51.7° | 95.1° |
| C24 | C26 | O38 | H38 | 180.0° | 179.9° |
| O38 | C26 | C24 | C34 | 59.7° | 55.0° |
| O38 | C26 | C24 | H21 | 59.1° | 175.0° |
| O38 | C26 | H260 | H26 | 119.2° | 120.0° |
| C24 | C34 | C36 | H340 | 120.5° | 120.0° |
| C24 | C34 | C36 | H34 | 120.5° | 120.0° |
| C24 | C34 | C36 | S37 | 178.6° | 180.0° |
| C34 | C24 | C26 | H260 | 60.6° | 175.0° |
| C34 | C24 | C26 | H26 | 180.0° | 65.0° |
| C24 | C34 | H340 | H34 | 118.4° | 120.0° |
| C24 | C34 | C36 | H32 | 58.1° | 60.0° |
| C24 | C34 | C36 | H33 | 61.0° | 60.0° |
| C34 | C24 | N23 | H20 | 71.9° | 24.9° |
| C34 | C36 | S37 | H32 | 120.4° | 120.0° |
| C34 | C36 | S37 | H33 | 120.4° | 120.0° |
| C34 | C36 | S37 | O39 | 47.6° | 65.5° |
| C34 | C36 | S37 | C40 | 163.6° | 180.0° |
| C34 | C36 | S37 | O41 | 80.5° | 65.5° |
| C36 | C34 | C24 | H21 | 48.7° | 55.0° |
| C36 | C34 | H340 | H34 | 118.3° | 120.0° |
| C34 | C36 | H32 | H33 | 118.7° | 120.0° |
| C36 | S37 | O39 | C40 | 113.2° | 110.1° |
| C36 | S37 | O39 | O41 | 122.7° | 125.0° |
| C36 | S37 | C40 | O41 | 115.4° | 114.5° |
| S37 | C36 | C34 | H340 | 60.9° | 60.0° |
| S37 | C36 | C34 | H34 | 58.0° | 60.0° |
| S37 | C36 | H32 | H33 | 118.7° | 120.0° |
| C36 | S37 | C40 | H40C | 180.0° | 60.0° |
| C36 | S37 | C40 | H40A | 60.0° | 180.0° |
| C36 | S37 | C40 | H40B | 60.0° | 60.0° |
| O39 | S37 | C40 | O41 | 129.0° | 131.0° |
| O39 | S37 | C36 | H32 | 72.8° | 174.5° |
| O39 | S37 | C36 | H33 | 168.0° | 54.4° |
| O39 | S37 | C40 | H40C | 64.5° | 54.5° |
| O39 | S37 | C40 | H40A | 55.6° | 65.5° |
| O39 | S37 | C40 | H40B | 175.6° | 174.5° |
| C40 | S37 | C36 | H32 | 43.2° | 60.0° |
| C40 | S37 | C36 | H33 | 76.0° | 60.0° |
| S37 | C40 | H40C | H40A | 120.0° | 120.0° |
| S37 | C40 | H40C | H40B | 120.0° | 120.0° |
| S37 | C40 | H40A | H40B | 120.0° | 120.0° |
| O41 | S37 | C36 | H32 | 159.1° | 54.5° |
| O41 | S37 | C36 | H33 | 39.9° | 174.5° |
| O41 | S37 | C40 | H40C | 64.6° | 174.5° |
| O41 | S37 | C40 | H40A | 175.4° | 65.5° |
| O41 | S37 | C40 | H40B | 55.4° | 54.6° |
| O22 | C21 | C15 | C17 | 89.2° | 120.0° |
| O22 | C21 | C15 | H10 | 154.1° | 120.0° |
| O22 | C21 | N23 | H20 | 178.3° | 180.0° |
| C15 | C17 | C42 | H17 | 120.7° | 120.0° |
| C15 | C17 | C42 | H170 | 120.7° | 119.9° |
| C15 | C17 | C42 | C43 | 62.3° | 175.0° |
| C15 | C17 | C42 | C44 | 132.5° | 116.4° |
| C15 | C17 | H17 | H170 | 117.8° | 120.0° |
| C15 | C17 | C42 | H42 | 82.6° | 29.3° |
| C17 | C15 | N14 | H9 | 7.3° | 95.0° |
| C17 | C42 | C43 | C44 | 109.3° | 107.5° |
| C17 | C42 | C43 | H42 | 144.6° | 145.0° |
| C17 | C42 | C44 | H42 | 144.7° | 145.0° |
| C42 | C17 | C15 | H10 | 55.2° | 55.0° |
| C42 | C17 | H17 | H170 | 117.8° | 120.0° |
| C17 | C42 | C43 | H43B | 0.2° | 0.0° |
| C17 | C42 | C43 | H43A | 141.2° | 145.0° |
| C17 | C42 | C44 | H44B | 0.2° | 145.0° |
| C17 | C42 | C44 | H44A | 141.3° | 0.0° |
| C42 | C43 | C44 | H43B | 109.4° | 107.5° |
| C42 | C43 | C44 | H43A | 109.5° | 107.5° |
| C43 | C42 | C44 | H42 | 106.1° | 107.5° |
| C43 | C42 | C17 | H17 | 177.0° | 65.0° |
| C43 | C42 | C17 | H170 | 58.4° | 55.0° |
| C42 | C43 | H43B | H43A | 144.7° | 145.7° |
| C43 | C42 | C44 | H44B | 109.5° | 107.5° |
| C43 | C42 | C44 | H44A | 109.5° | 107.5° |
| C44 | C43 | H43B | H43A | 144.8° | 145.7° |
| C43 | C44 | H44B | H44A | 144.7° | 145.7° |
| O13 | C12 | C9 | C10 | 177.2° | 0.0° |
| O13 | C12 | N14 | H9 | 178.3° | 179.9° |
| C9 | C10 | C11 | H8 | 180.0° | 180.0° |
| C10 | C9 | N8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C11 | C10 | 179.3° | 180.0° |
| C7 | C6 | C5 | H5 | 180.0° | 180.0° |
| C6 | C7 | N8 | H7 | 0.8° | 0.0° |
| C44 | C42 | C17 | H17 | 106.7° | 3.6° |
| C44 | C42 | C17 | H170 | 11.8° | 123.7° |
| C42 | C44 | H44B | H44A | 144.7° | 145.7° |
| H4 | C4 | C5 | H5 | 0.0° | 0.0° |
| H5 | C5 | C6 | H6 | 0.0° | 0.0° |
| H10 | C15 | C17 | H17 | 175.9° | 175.0° |
| H10 | C15 | C17 | H170 | 65.6° | 65.0° |
| H10 | C15 | N14 | H9 | 124.6° | 144.9° |
| H17 | C17 | C42 | H42 | 38.2° | 149.3° |
| H170 | C17 | C42 | H42 | 156.8° | 90.6° |
| H21 | C24 | C26 | H260 | 179.4° | 64.9° |
| H21 | C24 | C26 | H26 | 61.1° | 55.0° |
| H21 | C24 | C34 | H340 | 169.2° | 175.0° |
| H21 | C24 | C34 | H34 | 71.8° | 65.0° |
| H21 | C24 | N23 | H20 | 169.6° | 145.0° |
| H260 | C26 | O38 | H38 | 59.7° | 60.0° |
| H26 | C26 | O38 | H38 | 59.7° | 60.0° |
| H3 | C1 | H2 | H1 | 120.0° | 120.1° |
| H340 | C34 | C36 | H32 | 178.7° | 180.0° |
| H340 | C34 | C36 | H33 | 59.5° | 59.9° |
| H34 | C34 | C36 | H32 | 62.4° | 60.0° |
| H34 | C34 | C36 | H33 | 178.5° | 179.9° |
| H40C | C40 | H40A | H40B | 120.0° | 120.0° |
| H42 | C42 | C43 | H43B | 144.4° | 145.0° |
| H42 | C42 | C43 | H43A | 3.4° | 0.0° |
| H42 | C42 | C44 | H44B | 144.5° | 0.0° |
| H42 | C42 | C44 | H44A | 3.4° | 145.0° |
| H43B | C43 | C44 | H44B | 0.1° | 145.0° |
| H43B | C43 | C44 | H44A | 141.1° | 0.0° |
| H43A | C43 | C44 | H44B | 141.0° | 0.0° |
| H43A | C43 | C44 | H44A | 0.0° | 145.0° |
