XWO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.51Å | 1.52Å | |
| C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.49Å | 1.48Å | |
| C6 | C7 | doub | 1.36Å | 1.38Å | Aromatic |
| C7 | N8 | sing | 1.35Å | 1.34Å | Aromatic |
| N8 | C9 | sing | 1.46Å | 1.46Å | |
| N8 | N10 | sing | 1.40Å | 1.35Å | Aromatic |
| N10 | C11 | doub | 1.31Å | 1.32Å | Aromatic |
| C5 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.48Å | 1.48Å | |
| C14 | C15 | doub | 1.36Å | 1.38Å | Aromatic |
| C15 | N16 | sing | 1.35Å | 1.34Å | Aromatic |
| N16 | C17 | sing | 1.46Å | 1.46Å | |
| N16 | N18 | sing | 1.40Å | 1.35Å | Aromatic |
| N18 | C19 | doub | 1.31Å | 1.33Å | Aromatic |
| C13 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | N21 | sing | 1.46Å | 1.46Å | |
| N21 | C22 | sing | 1.35Å | 1.34Å | |
| C22 | C23 | sing | 1.48Å | 1.50Å | |
| C23 | C24 | doub | 1.40Å | 1.40Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | O26 | sing | 1.36Å | 1.37Å | |
| O26 | C27 | sing | 1.43Å | 1.44Å | |
| C27 | C28 | sing | 1.53Å | 1.50Å | |
| C28 | N29 | sing | 1.47Å | 1.50Å | |
| N29 | C30 | sing | 1.47Å | 1.49Å | |
| N29 | C31 | sing | 1.47Å | 1.49Å | |
| C25 | C32 | doub | 1.39Å | 1.38Å | Aromatic |
| C32 | C33 | sing | 1.38Å | 1.38Å | Aromatic |
| C33 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | C35 | sing | 1.51Å | 1.51Å | |
| C22 | O36 | doub | 1.22Å | 1.23Å | |
| C20 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C6 | sing | 1.41Å | 1.41Å | Aromatic |
| C19 | C14 | sing | 1.41Å | 1.40Å | Aromatic |
| C34 | C23 | sing | 1.40Å | 1.41Å | Aromatic |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1C | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C27 | H27B | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C31 | H31B | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C31 | H31C | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C9 | H9C | sing | 1.09Å | 1.10Å | |
| C9 | H9B | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C17 | H17B | sing | 1.09Å | 1.10Å | |
| C17 | H17C | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C28 | H28B | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C30 | H30B | sing | 1.09Å | 1.10Å | |
| C30 | H30C | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C35 | H35B | sing | 1.09Å | 1.10Å | |
| C35 | H35C | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| N21 | H21 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 112.2° | 109.5° |
| C1 | C2 | N21 | 109.1° | 109.5° |
| C2 | C1 | H1B | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.4° | 109.5° |
| C2 | C1 | H1C | 109.5° | 109.4° |
| C1 | C2 | H2 | 107.7° | 109.5° |
| C2 | C3 | C4 | 122.7° | 119.9° |
| C3 | C2 | N21 | 111.4° | 109.5° |
| C2 | C3 | C20 | 118.7° | 119.9° |
| C3 | C2 | H2 | 107.8° | 109.5° |
| C3 | C4 | C5 | 121.0° | 120.1° |
| C4 | C3 | C20 | 118.6° | 120.3° |
| C3 | C4 | H4 | 119.5° | 119.9° |
| C4 | C5 | C6 | 120.1° | 120.1° |
| C4 | C5 | C12 | 119.7° | 119.9° |
| C5 | C4 | H4 | 119.5° | 119.9° |
| C5 | C6 | C7 | 127.3° | 126.2° |
| C6 | C5 | C12 | 120.1° | 120.1° |
| C5 | C6 | C11 | 129.0° | 126.2° |
| C6 | C7 | N8 | 107.6° | 107.6° |
| C7 | C6 | C11 | 103.7° | 107.6° |
| C6 | C7 | H7 | 126.2° | 126.2° |
| C7 | N8 | C9 | 127.7° | 125.9° |
| C7 | N8 | N10 | 112.0° | 108.2° |
| N8 | C7 | H7 | 126.2° | 126.2° |
| C9 | N8 | N10 | 120.3° | 125.9° |
| N8 | C9 | H9A | 109.5° | 109.5° |
| N8 | C9 | H9C | 109.5° | 109.5° |
| N8 | C9 | H9B | 109.5° | 109.5° |
| N8 | N10 | C11 | 104.6° | 108.5° |
| N10 | C11 | C6 | 112.1° | 108.1° |
| N10 | C11 | H11 | 123.9° | 126.0° |
| C5 | C12 | C13 | 119.9° | 119.8° |
| C5 | C12 | H12 | 120.0° | 120.1° |
| C12 | C13 | C14 | 120.1° | 120.0° |
| C12 | C13 | C20 | 119.7° | 119.9° |
| C13 | C12 | H12 | 120.1° | 120.1° |
| C13 | C14 | C15 | 127.4° | 126.3° |
| C14 | C13 | C20 | 120.1° | 120.1° |
| C13 | C14 | C19 | 129.0° | 126.2° |
| C14 | C15 | N16 | 107.6° | 107.6° |
| C15 | C14 | C19 | 103.6° | 107.5° |
| C14 | C15 | H15 | 126.2° | 126.1° |
| C15 | N16 | C17 | 127.7° | 125.9° |
| C15 | N16 | N18 | 112.2° | 108.2° |
| N16 | C15 | H15 | 126.2° | 126.2° |
| C17 | N16 | N18 | 120.0° | 125.9° |
| N16 | C17 | H17A | 109.5° | 109.5° |
| N16 | C17 | H17B | 109.5° | 109.5° |
| N16 | C17 | H17C | 109.5° | 109.5° |
| N16 | N18 | C19 | 104.3° | 108.5° |
| N18 | C19 | C14 | 112.3° | 108.1° |
| N18 | C19 | H19 | 123.9° | 126.0° |
| C13 | C20 | C3 | 121.0° | 120.1° |
| C13 | C20 | H20 | 119.5° | 119.9° |
| C2 | N21 | C22 | 122.2° | 120.0° |
| N21 | C2 | H2 | 108.4° | 109.5° |
| C2 | N21 | H21 | 118.9° | 120.0° |
| N21 | C22 | C23 | 116.5° | 120.0° |
| N21 | C22 | O36 | 122.4° | 120.0° |
| C22 | N21 | H21 | 118.9° | 120.0° |
| C22 | C23 | C24 | 119.2° | 120.1° |
| C23 | C22 | O36 | 121.1° | 120.0° |
| C22 | C23 | C34 | 120.7° | 120.1° |
| C23 | C24 | C25 | 120.3° | 119.8° |
| C24 | C23 | C34 | 120.2° | 119.7° |
| C23 | C24 | H24 | 119.8° | 120.1° |
| C24 | C25 | O26 | 118.1° | 120.0° |
| C24 | C25 | C32 | 120.1° | 120.0° |
| C25 | C24 | H24 | 119.8° | 120.1° |
| C25 | O26 | C27 | 118.1° | 117.0° |
| O26 | C25 | C32 | 121.8° | 120.0° |
| O26 | C27 | C28 | 106.2° | 109.4° |
| O26 | C27 | H27B | 110.3° | 109.5° |
| O26 | C27 | H27A | 110.3° | 109.4° |
| C27 | C28 | N29 | 113.9° | 109.5° |
| C28 | C27 | H27B | 110.3° | 109.5° |
| C28 | C27 | H27A | 110.3° | 109.5° |
| C27 | C28 | H28B | 108.3° | 109.4° |
| C27 | C28 | H28A | 108.4° | 109.4° |
| C28 | N29 | C30 | 112.2° | 111.0° |
| C28 | N29 | C31 | 111.8° | 111.0° |
| N29 | C28 | H28B | 108.3° | 109.5° |
| N29 | C28 | H28A | 108.3° | 109.5° |
| C30 | N29 | C31 | 110.7° | 111.0° |
| N29 | C30 | H30B | 109.5° | 109.5° |
| N29 | C30 | H30C | 109.4° | 109.5° |
| N29 | C30 | H30A | 109.5° | 109.5° |
| N29 | C31 | H31B | 109.5° | 109.5° |
| N29 | C31 | H31A | 109.4° | 109.5° |
| N29 | C31 | H31C | 109.5° | 109.4° |
| C25 | C32 | C33 | 119.5° | 120.3° |
| C25 | C32 | H32 | 120.3° | 119.9° |
| C32 | C33 | C34 | 122.1° | 120.2° |
| C33 | C32 | H32 | 120.3° | 119.9° |
| C32 | C33 | H33 | 119.0° | 119.9° |
| C33 | C34 | C35 | 119.7° | 120.0° |
| C33 | C34 | C23 | 117.8° | 120.0° |
| C34 | C33 | H33 | 118.9° | 119.9° |
| C35 | C34 | C23 | 122.5° | 120.0° |
| C34 | C35 | H35B | 109.5° | 109.5° |
| C34 | C35 | H35C | 109.5° | 109.5° |
| C34 | C35 | H35A | 109.4° | 109.5° |
| C3 | C20 | H20 | 119.5° | 120.0° |
| C6 | C11 | H11 | 124.0° | 126.0° |
| C14 | C19 | H19 | 123.8° | 125.9° |
| H1B | C1 | H1A | 109.5° | 109.5° |
| H1B | C1 | H1C | 109.4° | 109.4° |
| H1A | C1 | H1C | 109.5° | 109.5° |
| H27B | C27 | H27A | 109.5° | 109.5° |
| H31B | C31 | H31A | 109.5° | 109.5° |
| H31B | C31 | H31C | 109.5° | 109.5° |
| H31A | C31 | H31C | 109.5° | 109.5° |
| H9A | C9 | H9C | 109.5° | 109.5° |
| H9A | C9 | H9B | 109.4° | 109.4° |
| H9C | C9 | H9B | 109.5° | 109.5° |
| H17A | C17 | H17B | 109.5° | 109.5° |
| H17A | C17 | H17C | 109.4° | 109.4° |
| H17B | C17 | H17C | 109.5° | 109.5° |
| H28B | C28 | H28A | 109.5° | 109.4° |
| H30B | C30 | H30C | 109.4° | 109.5° |
| H30B | C30 | H30A | 109.5° | 109.4° |
| H30C | C30 | H30A | 109.5° | 109.4° |
| H35B | C35 | H35C | 109.5° | 109.4° |
| H35B | C35 | H35A | 109.5° | 109.5° |
| H35C | C35 | H35A | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | N21 | 122.7° | 120.0° |
| C1 | C2 | C3 | H2 | 118.5° | 120.0° |
| C1 | C2 | C3 | C4 | 59.0° | 100.0° |
| C1 | C2 | N21 | H2 | 117.0° | 120.0° |
| C1 | C2 | N21 | C22 | 152.6° | 84.9° |
| C1 | C2 | C3 | C20 | 121.2° | 80.3° |
| C2 | C1 | H1B | H1A | 120.0° | 120.1° |
| C2 | C1 | H1B | H1C | 120.0° | 120.0° |
| C2 | C1 | H1A | H1C | 120.0° | 120.0° |
| C1 | C2 | N21 | H21 | 27.4° | 95.0° |
| C2 | C3 | C4 | C20 | 179.8° | 179.7° |
| C2 | C3 | C4 | C5 | 179.7° | 180.0° |
| C2 | C3 | C20 | C13 | 179.7° | 179.8° |
| C3 | C2 | N21 | H2 | 118.5° | 120.0° |
| C3 | C2 | N21 | C22 | 82.9° | 155.0° |
| C3 | C2 | C1 | H1B | 180.0° | 59.9° |
| C3 | C2 | C1 | H1A | 60.0° | 180.0° |
| C3 | C2 | C1 | H1C | 60.0° | 60.0° |
| C2 | C3 | C4 | H4 | 0.3° | 0.1° |
| C2 | C3 | C20 | H20 | 0.3° | 0.3° |
| C3 | C2 | N21 | H21 | 97.1° | 25.0° |
| C3 | C4 | C5 | H4 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 177.6° | 180.0° |
| C3 | C4 | C5 | C12 | 0.2° | 0.0° |
| C4 | C3 | C20 | C13 | 0.1° | 0.1° |
| C4 | C3 | C2 | N21 | 63.6° | 140.0° |
| C4 | C3 | C2 | H2 | 177.5° | 20.0° |
| C4 | C3 | C20 | H20 | 179.9° | 180.0° |
| C4 | C5 | C6 | C12 | 177.8° | 180.0° |
| C4 | C5 | C6 | C7 | 3.2° | 180.0° |
| C4 | C5 | C12 | C13 | 0.3° | 0.5° |
| C5 | C4 | C3 | C20 | 0.1° | 0.3° |
| C4 | C5 | C6 | C11 | 178.2° | 0.3° |
| C4 | C5 | C12 | H12 | 179.7° | 180.0° |
| C5 | C6 | C7 | C11 | 178.9° | 179.7° |
| C5 | C6 | C7 | N8 | 178.9° | 179.7° |
| C5 | C6 | C11 | N10 | 178.9° | 179.7° |
| C6 | C5 | C12 | C13 | 177.5° | 179.5° |
| C5 | C6 | C7 | H7 | 1.1° | 0.3° |
| C5 | C6 | C11 | H11 | 1.1° | 0.3° |
| C6 | C5 | C4 | H4 | 2.4° | 0.1° |
| C6 | C5 | C12 | H12 | 2.5° | 0.0° |
| C6 | C7 | N8 | H7 | 180.0° | 180.0° |
| C6 | C7 | N8 | C9 | 179.4° | 180.0° |
| C6 | C7 | N8 | N10 | 0.1° | 0.0° |
| C7 | C6 | C11 | N10 | 0.0° | 0.0° |
| C7 | C6 | C5 | C12 | 174.6° | 0.0° |
| C7 | C6 | C11 | H11 | 180.0° | 180.0° |
| C7 | N8 | C9 | N10 | 179.4° | 180.0° |
| C7 | N8 | N10 | C11 | 0.1° | 0.0° |
| N8 | C7 | C6 | C11 | 0.1° | 0.0° |
| C7 | N8 | C9 | H9A | 179.4° | 90.0° |
| C7 | N8 | C9 | H9C | 59.4° | 150.0° |
| C7 | N8 | C9 | H9B | 60.6° | 30.0° |
| C9 | N8 | N10 | C11 | 179.5° | 180.0° |
| C9 | N8 | C7 | H7 | 0.6° | 0.0° |
| N8 | C9 | H9A | H9C | 120.0° | 120.0° |
| N8 | C9 | H9A | H9B | 120.0° | 120.0° |
| N8 | C9 | H9C | H9B | 120.0° | 120.0° |
| N8 | N10 | C11 | C6 | 0.0° | 0.0° |
| N10 | N8 | C7 | H7 | 180.0° | 180.0° |
| N8 | N10 | C11 | H11 | 180.0° | 180.0° |
| N10 | N8 | C9 | H9A | 0.0° | 90.0° |
| N10 | N8 | C9 | H9C | 120.0° | 30.0° |
| N10 | N8 | C9 | H9B | 120.0° | 150.0° |
| N10 | C11 | C6 | H11 | 180.0° | 180.0° |
| C5 | C12 | C13 | H12 | 180.0° | 179.5° |
| C5 | C12 | C13 | C14 | 178.3° | 179.9° |
| C5 | C12 | C13 | C20 | 0.3° | 0.8° |
| C12 | C5 | C6 | C11 | 4.0° | 179.7° |
| C12 | C5 | C4 | H4 | 179.8° | 179.9° |
| C12 | C13 | C14 | C20 | 178.5° | 179.3° |
| C12 | C13 | C14 | C15 | 176.0° | 0.0° |
| C12 | C13 | C20 | C3 | 0.2° | 0.5° |
| C12 | C13 | C14 | C19 | 3.1° | 179.7° |
| C12 | C13 | C20 | H20 | 179.8° | 179.5° |
| C13 | C14 | C15 | C19 | 179.3° | 179.7° |
| C13 | C14 | C15 | N16 | 179.3° | 180.0° |
| C13 | C14 | C19 | N18 | 179.2° | 180.0° |
| C14 | C13 | C20 | C3 | 178.3° | 179.8° |
| C14 | C13 | C12 | H12 | 1.7° | 0.5° |
| C13 | C14 | C15 | H15 | 0.7° | 0.1° |
| C13 | C14 | C19 | H19 | 0.8° | 0.0° |
| C14 | C13 | C20 | H20 | 1.7° | 0.2° |
| C14 | C15 | N16 | H15 | 180.0° | 179.9° |
| C14 | C15 | N16 | C17 | 179.5° | 180.0° |
| C14 | C15 | N16 | N18 | 0.0° | 0.2° |
| C15 | C14 | C19 | N18 | 0.0° | 0.3° |
| C15 | C14 | C13 | C20 | 2.5° | 179.3° |
| C15 | C14 | C19 | H19 | 180.0° | 179.7° |
| C15 | N16 | C17 | N18 | 179.5° | 179.8° |
| C15 | N16 | N18 | C19 | 0.0° | 0.0° |
| N16 | C15 | C14 | C19 | 0.0° | 0.3° |
| C15 | N16 | C17 | H17A | 179.5° | 90.0° |
| C15 | N16 | C17 | H17B | 60.5° | 150.0° |
| C15 | N16 | C17 | H17C | 59.5° | 30.0° |
| C17 | N16 | N18 | C19 | 179.6° | 179.8° |
| N16 | C17 | H17A | H17B | 120.0° | 120.0° |
| N16 | C17 | H17A | H17C | 120.0° | 120.0° |
| N16 | C17 | H17B | H17C | 120.0° | 120.0° |
| C17 | N16 | C15 | H15 | 0.5° | 0.0° |
| N16 | N18 | C19 | C14 | 0.1° | 0.2° |
| N18 | N16 | C17 | H17A | 0.0° | 89.9° |
| N18 | N16 | C17 | H17B | 120.0° | 30.1° |
| N18 | N16 | C17 | H17C | 120.0° | 150.2° |
| N18 | N16 | C15 | H15 | 180.0° | 179.9° |
| N16 | N18 | C19 | H19 | 180.0° | 179.8° |
| N18 | C19 | C14 | H19 | 180.0° | 180.0° |
| C13 | C20 | C3 | H20 | 180.0° | 179.9° |
| C20 | C13 | C14 | C19 | 178.3° | 1.1° |
| C20 | C13 | C12 | H12 | 179.7° | 179.7° |
| C2 | N21 | C22 | H21 | 180.0° | 179.9° |
| C2 | N21 | C22 | C23 | 179.6° | 180.0° |
| C2 | N21 | C22 | O36 | 0.1° | 0.1° |
| N21 | C2 | C3 | C20 | 116.2° | 39.7° |
| N21 | C2 | C1 | H1B | 56.0° | 60.1° |
| N21 | C2 | C1 | H1A | 176.0° | 60.0° |
| N21 | C2 | C1 | H1C | 64.0° | 180.0° |
| N21 | C22 | C23 | O36 | 179.7° | 179.9° |
| N21 | C22 | C23 | C24 | 68.5° | 5.6° |
| N21 | C22 | C23 | C34 | 111.3° | 174.0° |
| C22 | N21 | C2 | H2 | 35.6° | 35.1° |
| C22 | C23 | C24 | C34 | 179.8° | 179.7° |
| C22 | C23 | C24 | C25 | 179.7° | 179.9° |
| C22 | C23 | C34 | C33 | 179.8° | 179.8° |
| C22 | C23 | C34 | C35 | 0.4° | 0.3° |
| C22 | C23 | C24 | H24 | 0.3° | 0.0° |
| C23 | C22 | N21 | H21 | 0.4° | 0.1° |
| C23 | C24 | C25 | H24 | 180.0° | 179.9° |
| C23 | C24 | C25 | O26 | 179.9° | 180.0° |
| C23 | C24 | C25 | C32 | 0.1° | 0.0° |
| C24 | C23 | C34 | C33 | 0.0° | 0.5° |
| C24 | C23 | C34 | C35 | 179.8° | 180.0° |
| C24 | C23 | C22 | O36 | 111.2° | 174.2° |
| C24 | C25 | O26 | C32 | 179.9° | 179.9° |
| C24 | C25 | O26 | C27 | 179.5° | 180.0° |
| C24 | C25 | C32 | C33 | 0.1° | 0.0° |
| C25 | C24 | C23 | C34 | 0.0° | 0.2° |
| C24 | C25 | C32 | H32 | 179.9° | 180.0° |
| C25 | O26 | C27 | C28 | 152.3° | 180.0° |
| O26 | C25 | C32 | C33 | 179.9° | 180.0° |
| C25 | O26 | C27 | H27B | 32.8° | 60.0° |
| C25 | O26 | C27 | H27A | 88.2° | 60.0° |
| O26 | C25 | C24 | H24 | 0.1° | 0.1° |
| O26 | C25 | C32 | H32 | 0.1° | 0.1° |
| O26 | C27 | C28 | H27B | 119.5° | 120.0° |
| O26 | C27 | C28 | H27A | 119.5° | 119.9° |
| O26 | C27 | C28 | N29 | 114.0° | 65.2° |
| C27 | O26 | C25 | C32 | 0.5° | 0.1° |
| O26 | C27 | H27B | H27A | 121.5° | 119.9° |
| O26 | C27 | C28 | H28B | 6.7° | 174.7° |
| O26 | C27 | C28 | H28A | 125.4° | 54.8° |
| C27 | C28 | N29 | H28B | 120.6° | 120.0° |
| C27 | C28 | N29 | H28A | 120.7° | 120.0° |
| C27 | C28 | N29 | C30 | 35.5° | 77.2° |
| C27 | C28 | N29 | C31 | 89.6° | 158.9° |
| C28 | C27 | H27B | H27A | 121.5° | 120.1° |
| C27 | C28 | H28B | H28A | 118.0° | 119.9° |
| C28 | N29 | C30 | C31 | 125.7° | 124.0° |
| N29 | C28 | C27 | H27B | 126.5° | 174.8° |
| N29 | C28 | C27 | H27A | 5.5° | 54.7° |
| C28 | N29 | C31 | H31B | 180.0° | 64.4° |
| C28 | N29 | C31 | H31A | 60.0° | 175.6° |
| C28 | N29 | C31 | H31C | 60.0° | 55.6° |
| N29 | C28 | H28B | H28A | 118.0° | 120.0° |
| C28 | N29 | C30 | H30B | 180.0° | 60.0° |
| C28 | N29 | C30 | H30C | 60.0° | 179.9° |
| C28 | N29 | C30 | H30A | 60.0° | 60.0° |
| C30 | N29 | C31 | H31B | 54.1° | 171.6° |
| C30 | N29 | C31 | H31A | 65.9° | 51.6° |
| C30 | N29 | C31 | H31C | 174.2° | 68.4° |
| C30 | N29 | C28 | H28B | 156.1° | 42.8° |
| C30 | N29 | C28 | H28A | 85.2° | 162.8° |
| N29 | C30 | H30B | H30C | 120.0° | 120.1° |
| N29 | C30 | H30B | H30A | 120.0° | 120.0° |
| N29 | C30 | H30C | H30A | 120.0° | 120.0° |
| N29 | C31 | H31B | H31A | 120.0° | 120.0° |
| N29 | C31 | H31B | H31C | 120.0° | 120.0° |
| N29 | C31 | H31A | H31C | 120.0° | 120.0° |
| C31 | N29 | C28 | H28B | 31.1° | 81.1° |
| C31 | N29 | C28 | H28A | 149.7° | 38.9° |
| C31 | N29 | C30 | H30B | 54.3° | 64.0° |
| C31 | N29 | C30 | H30C | 174.3° | 56.1° |
| C31 | N29 | C30 | H30A | 65.7° | 176.0° |
| C25 | C32 | C33 | H32 | 180.0° | 179.9° |
| C25 | C32 | C33 | C34 | 0.1° | 0.2° |
| C32 | C25 | C24 | H24 | 179.9° | 180.0° |
| C25 | C32 | C33 | H33 | 179.9° | 179.9° |
| C32 | C33 | C34 | H33 | 180.0° | 179.7° |
| C32 | C33 | C34 | C35 | 179.8° | 180.0° |
| C32 | C33 | C34 | C23 | 0.0° | 0.5° |
| C33 | C34 | C35 | C23 | 179.8° | 179.5° |
| C34 | C33 | C32 | H32 | 179.9° | 179.7° |
| C33 | C34 | C35 | H35B | 89.9° | 96.4° |
| C33 | C34 | C35 | H35C | 150.1° | 143.6° |
| C33 | C34 | C35 | H35A | 30.1° | 23.7° |
| C35 | C34 | C33 | H33 | 0.2° | 0.3° |
| C34 | C35 | H35B | H35C | 120.0° | 120.0° |
| C34 | C35 | H35B | H35A | 120.0° | 120.0° |
| C34 | C35 | H35C | H35A | 120.0° | 120.0° |
| O36 | C22 | C23 | C34 | 69.1° | 6.1° |
| O36 | C22 | N21 | H21 | 179.9° | 180.0° |
| C20 | C3 | C2 | H2 | 2.7° | 159.7° |
| C20 | C3 | C4 | H4 | 179.9° | 179.8° |
| C11 | C6 | C7 | H7 | 180.0° | 180.0° |
| C19 | C14 | C15 | H15 | 180.0° | 179.8° |
| C34 | C23 | C24 | H24 | 180.0° | 179.7° |
| C23 | C34 | C33 | H33 | 180.0° | 179.8° |
| C23 | C34 | C35 | H35B | 89.9° | 83.1° |
| C23 | C34 | C35 | H35C | 30.1° | 36.9° |
| C23 | C34 | C35 | H35A | 150.1° | 156.8° |
| H1B | C1 | H1A | H1C | 120.0° | 119.9° |
| H1B | C1 | C2 | H2 | 61.5° | 179.9° |
| H1A | C1 | C2 | H2 | 58.5° | 60.0° |
| H1C | C1 | C2 | H2 | 178.5° | 60.0° |
| H27B | C27 | C28 | H28B | 112.8° | 54.7° |
| H27B | C27 | C28 | H28A | 5.8° | 65.2° |
| H27A | C27 | C28 | H28B | 126.1° | 65.4° |
| H27A | C27 | C28 | H28A | 115.2° | 174.7° |
| H31B | C31 | H31A | H31C | 120.0° | 120.0° |
| H2 | C2 | N21 | H21 | 144.4° | 145.0° |
| H9A | C9 | H9C | H9B | 119.9° | 120.0° |
| H17A | C17 | H17B | H17C | 120.0° | 120.0° |
| H30B | C30 | H30C | H30A | 120.0° | 120.0° |
| H32 | C32 | C33 | H33 | 0.1° | 0.0° |
| H35B | C35 | H35C | H35A | 120.0° | 119.9° |
