17L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.41Å | 1.42Å | |
| C1 | C6 | sing | 1.42Å | 1.44Å | |
| C1 | C15 | sing | 1.41Å | 1.43Å | |
| C2 | C3 | sing | 1.40Å | 1.40Å | |
| C2 | O18 | sing | 1.35Å | 1.35Å | |
| C3 | C4 | doub | 1.34Å | 1.33Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C4 | O7 | sing | 1.35Å | 1.35Å | |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| C5 | C9 | sing | 1.51Å | 1.51Å | |
| C5 | C19 | sing | 1.53Å | 1.54Å | |
| C6 | O14 | doub | 1.21Å | 1.21Å | |
| O7 | C8 | sing | 1.37Å | 1.38Å | |
| C8 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C8 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C9 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C11 | doub | 1.40Å | 1.41Å | Aromatic |
| C10 | C21 | sing | 1.47Å | 1.47Å | |
| C11 | C12 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | O35 | sing | 1.36Å | 1.36Å | |
| C12 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | O20 | sing | 1.36Å | 1.36Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C15 | O17 | doub | 1.21Å | 1.22Å | |
| C21 | O22 | doub | 1.22Å | 1.22Å | |
| C21 | N23 | sing | 1.35Å | 1.35Å | |
| N23 | C24 | sing | 1.46Å | 1.47Å | |
| C24 | C25 | sing | 1.51Å | 1.50Å | |
| C25 | C26 | doub | 1.36Å | 1.37Å | Aromatic |
| C25 | C30 | sing | 1.41Å | 1.42Å | Aromatic |
| C26 | C27 | sing | 1.40Å | 1.40Å | Aromatic |
| C27 | C28 | doub | 1.37Å | 1.38Å | Aromatic |
| C27 | O37 | sing | 1.36Å | 1.37Å | |
| C28 | C29 | sing | 1.40Å | 1.42Å | Aromatic |
| C29 | C30 | doub | 1.42Å | 1.43Å | Aromatic |
| C29 | C31 | sing | 1.41Å | 1.41Å | Aromatic |
| C30 | C34 | sing | 1.41Å | 1.42Å | Aromatic |
| C31 | C32 | doub | 1.36Å | 1.37Å | Aromatic |
| C32 | C33 | sing | 1.39Å | 1.40Å | Aromatic |
| C33 | C34 | doub | 1.36Å | 1.37Å | Aromatic |
| O35 | C36 | sing | 1.43Å | 1.43Å | |
| O37 | C38 | sing | 1.43Å | 1.43Å | |
| C38 | C39 | sing | 1.53Å | 1.53Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C16 | H16B | sing | 1.09Å | 1.10Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| O20 | HO20 | sing | 0.97Å | 0.95Å | |
| N23 | HN23 | sing | 0.97Å | 1.00Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C36 | H36B | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.09Å | 1.10Å | |
| C38 | H38A | sing | 1.09Å | 1.10Å | |
| C39 | H39 | sing | 1.09Å | 1.10Å | |
| C39 | H39A | sing | 1.09Å | 1.10Å | |
| C39 | H39B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 119.2° | 120.5° |
| C2 | C1 | C15 | 119.2° | 119.8° |
| C1 | C2 | C3 | 122.7° | 122.4° |
| C1 | C2 | O18 | 121.3° | 118.8° |
| C6 | C1 | C15 | 121.6° | 119.8° |
| C1 | C6 | C5 | 117.2° | 116.9° |
| C1 | C6 | O14 | 123.1° | 121.6° |
| C1 | C15 | C16 | 122.7° | 120.0° |
| C1 | C15 | O17 | 120.4° | 120.0° |
| C3 | C2 | O18 | 115.7° | 118.8° |
| C2 | C3 | C4 | 122.6° | 121.4° |
| C2 | C3 | H3 | 118.7° | 119.3° |
| C2 | O18 | HO18 | 109.5° | 117.0° |
| C3 | C4 | C5 | 118.7° | 119.0° |
| C3 | C4 | O7 | 137.8° | 138.7° |
| C4 | C3 | H3 | 118.7° | 119.3° |
| C5 | C4 | O7 | 103.4° | 102.0° |
| C4 | C5 | C6 | 116.4° | 116.3° |
| C4 | C5 | C9 | 102.8° | 100.1° |
| C4 | C5 | C19 | 109.0° | 109.9° |
| C4 | O7 | C8 | 108.8° | 107.9° |
| C6 | C5 | C9 | 119.8° | 110.1° |
| C6 | C5 | C19 | 102.6° | 109.7° |
| C5 | C6 | O14 | 119.2° | 121.5° |
| C9 | C5 | C19 | 105.6° | 110.4° |
| C5 | C9 | C8 | 102.9° | 104.4° |
| C5 | C9 | C13 | 135.5° | 134.7° |
| C5 | C19 | H19 | 109.5° | 109.5° |
| C5 | C19 | H19A | 109.5° | 109.4° |
| C5 | C19 | H19B | 109.5° | 109.5° |
| O7 | C8 | C9 | 112.1° | 109.8° |
| O7 | C8 | C10 | 129.8° | 131.2° |
| C9 | C8 | C10 | 118.1° | 118.9° |
| C8 | C9 | C13 | 121.5° | 120.9° |
| C8 | C10 | C11 | 120.7° | 119.8° |
| C8 | C10 | C21 | 118.8° | 120.1° |
| C9 | C13 | C12 | 120.1° | 120.3° |
| C9 | C13 | O20 | 120.4° | 119.9° |
| C11 | C10 | C21 | 120.5° | 120.1° |
| C10 | C11 | C12 | 119.8° | 120.2° |
| C10 | C11 | O35 | 119.0° | 119.9° |
| C10 | C21 | O22 | 120.8° | 120.0° |
| C10 | C21 | N23 | 117.2° | 120.0° |
| C12 | C11 | O35 | 121.1° | 119.9° |
| C11 | C12 | C13 | 119.7° | 119.9° |
| C11 | C12 | H12 | 120.1° | 120.0° |
| C11 | O35 | C36 | 120.5° | 117.0° |
| C12 | C13 | O20 | 119.5° | 119.9° |
| C13 | C12 | H12 | 120.1° | 120.0° |
| C13 | O20 | HO20 | 109.5° | 114.0° |
| C16 | C15 | O17 | 116.9° | 120.0° |
| C15 | C16 | H16 | 109.5° | 109.5° |
| C15 | C16 | H16A | 109.4° | 109.5° |
| C15 | C16 | H16B | 109.5° | 109.5° |
| O22 | C21 | N23 | 122.0° | 120.0° |
| C21 | N23 | C24 | 122.9° | 120.0° |
| C21 | N23 | HN23 | 118.6° | 120.0° |
| N23 | C24 | C25 | 105.9° | 109.5° |
| C24 | N23 | HN23 | 118.6° | 120.0° |
| N23 | C24 | H24 | 110.4° | 109.5° |
| N23 | C24 | H24A | 110.4° | 109.5° |
| C24 | C25 | C26 | 118.0° | 120.2° |
| C24 | C25 | C30 | 121.8° | 120.2° |
| C25 | C24 | H24 | 110.4° | 109.5° |
| C25 | C24 | H24A | 110.4° | 109.5° |
| C26 | C25 | C30 | 120.2° | 119.7° |
| C25 | C26 | C27 | 121.2° | 121.0° |
| C25 | C26 | H26 | 119.4° | 119.5° |
| C25 | C30 | C29 | 118.7° | 119.5° |
| C25 | C30 | C34 | 122.7° | 121.2° |
| C26 | C27 | C28 | 120.5° | 120.8° |
| C26 | C27 | O37 | 116.9° | 119.6° |
| C27 | C26 | H26 | 119.4° | 119.5° |
| C28 | C27 | O37 | 122.6° | 119.6° |
| C27 | C28 | C29 | 120.0° | 119.6° |
| C27 | C28 | H28 | 120.0° | 120.2° |
| C27 | O37 | C38 | 120.7° | 117.0° |
| C28 | C29 | C30 | 119.3° | 119.4° |
| C28 | C29 | C31 | 121.3° | 121.3° |
| C29 | C28 | H28 | 120.0° | 120.2° |
| C30 | C29 | C31 | 119.3° | 119.4° |
| C29 | C30 | C34 | 118.5° | 119.3° |
| C29 | C31 | C32 | 120.2° | 119.7° |
| C29 | C31 | H31 | 119.9° | 120.1° |
| C30 | C34 | C33 | 120.6° | 119.6° |
| C30 | C34 | H34 | 119.7° | 120.1° |
| C31 | C32 | C33 | 120.8° | 121.0° |
| C32 | C31 | H31 | 119.9° | 120.2° |
| C31 | C32 | H32 | 119.6° | 119.5° |
| C32 | C33 | C34 | 120.6° | 121.0° |
| C33 | C32 | H32 | 119.6° | 119.5° |
| C32 | C33 | H33 | 119.7° | 119.5° |
| C34 | C33 | H33 | 119.7° | 119.5° |
| C33 | C34 | H34 | 119.7° | 120.2° |
| O35 | C36 | H36 | 109.5° | 109.5° |
| O35 | C36 | H36A | 109.5° | 109.4° |
| O35 | C36 | H36B | 109.5° | 109.4° |
| O37 | C38 | C39 | 109.5° | 109.4° |
| O37 | C38 | H38 | 109.5° | 109.4° |
| O37 | C38 | H38A | 109.5° | 109.5° |
| C39 | C38 | H38 | 109.5° | 109.5° |
| C39 | C38 | H38A | 109.4° | 109.5° |
| C38 | C39 | H39 | 109.5° | 109.5° |
| C38 | C39 | H39A | 109.5° | 109.5° |
| C38 | C39 | H39B | 109.4° | 109.5° |
| H16 | C16 | H16A | 109.5° | 109.5° |
| H16 | C16 | H16B | 109.5° | 109.5° |
| H16A | C16 | H16B | 109.5° | 109.4° |
| H19 | C19 | H19A | 109.4° | 109.5° |
| H19 | C19 | H19B | 109.5° | 109.5° |
| H19A | C19 | H19B | 109.4° | 109.5° |
| H24 | C24 | H24A | 109.5° | 109.4° |
| H36 | C36 | H36A | 109.4° | 109.5° |
| H36 | C36 | H36B | 109.5° | 109.5° |
| H36A | C36 | H36B | 109.4° | 109.5° |
| H38 | C38 | H38A | 109.5° | 109.5° |
| H39 | C39 | H39A | 109.5° | 109.5° |
| H39 | C39 | H39B | 109.5° | 109.4° |
| H39A | C39 | H39B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | C15 | 179.1° | 179.7° |
| C1 | C2 | C3 | O18 | 174.0° | 180.0° |
| C1 | C2 | C3 | C4 | 4.8° | 8.0° |
| C2 | C1 | C6 | C5 | 7.0° | 2.9° |
| C2 | C1 | C6 | O14 | 179.1° | 177.1° |
| C2 | C1 | C15 | C16 | 179.9° | 178.5° |
| C2 | C1 | C15 | O17 | 1.3° | 1.5° |
| C1 | C2 | C3 | H3 | 175.2° | 171.9° |
| C1 | C2 | O18 | HO18 | 0.8° | 180.0° |
| C6 | C1 | C2 | C3 | 5.3° | 10.5° |
| C6 | C1 | C2 | O18 | 179.0° | 169.5° |
| C1 | C6 | C5 | C4 | 18.6° | 17.2° |
| C1 | C6 | C5 | O14 | 172.4° | 180.0° |
| C1 | C6 | C5 | C9 | 143.3° | 130.1° |
| C1 | C6 | C5 | C19 | 100.3° | 108.3° |
| C6 | C1 | C15 | C16 | 0.7° | 1.8° |
| C6 | C1 | C15 | O17 | 179.5° | 178.2° |
| C15 | C1 | C2 | C3 | 173.9° | 169.8° |
| C15 | C1 | C2 | O18 | 0.2° | 10.2° |
| C15 | C1 | C6 | C5 | 173.9° | 176.8° |
| C15 | C1 | C6 | O14 | 1.8° | 3.2° |
| C1 | C15 | C16 | O17 | 178.8° | 180.0° |
| C1 | C15 | C16 | H16 | 178.9° | 60.8° |
| C1 | C15 | C16 | H16A | 61.2° | 179.2° |
| C1 | C15 | C16 | H16B | 58.8° | 59.2° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 8.1° | 7.7° |
| C2 | C3 | C4 | O7 | 176.0° | 164.9° |
| C3 | C2 | O18 | HO18 | 174.9° | 0.0° |
| O18 | C2 | C3 | C4 | 178.8° | 172.0° |
| O18 | C2 | C3 | H3 | 1.2° | 8.0° |
| C3 | C4 | C5 | O7 | 177.1° | 175.0° |
| C3 | C4 | C5 | C6 | 19.5° | 20.1° |
| C3 | C4 | C5 | C9 | 152.5° | 138.6° |
| C3 | C4 | C5 | C19 | 95.8° | 105.3° |
| C3 | C4 | O7 | C8 | 153.1° | 134.2° |
| C4 | C5 | C6 | C9 | 124.7° | 112.9° |
| C4 | C5 | C6 | C19 | 118.8° | 125.5° |
| C4 | C5 | C9 | C19 | 114.2° | 115.8° |
| C4 | C5 | C6 | O14 | 169.0° | 162.8° |
| C5 | C4 | O7 | C8 | 30.6° | 39.2° |
| C4 | C5 | C9 | C8 | 18.6° | 21.4° |
| C4 | C5 | C9 | C13 | 165.9° | 158.7° |
| C5 | C4 | C3 | H3 | 171.9° | 172.3° |
| C4 | C5 | C19 | H19 | 180.0° | 61.4° |
| C4 | C5 | C19 | H19A | 60.0° | 178.5° |
| C4 | C5 | C19 | H19B | 60.0° | 58.6° |
| O7 | C4 | C5 | C6 | 163.3° | 155.0° |
| O7 | C4 | C5 | C9 | 30.3° | 36.5° |
| O7 | C4 | C5 | C19 | 81.3° | 79.7° |
| C4 | O7 | C8 | C9 | 19.7° | 26.3° |
| C4 | O7 | C8 | C10 | 160.6° | 153.6° |
| O7 | C4 | C3 | H3 | 3.9° | 15.0° |
| C6 | C5 | C9 | C19 | 114.9° | 121.2° |
| C6 | C5 | C9 | C8 | 149.6° | 144.4° |
| C6 | C5 | C9 | C13 | 34.9° | 35.7° |
| C6 | C5 | C19 | H19 | 56.1° | 67.6° |
| C6 | C5 | C19 | H19A | 176.1° | 52.4° |
| C6 | C5 | C19 | H19B | 63.9° | 172.4° |
| C9 | C5 | C6 | O14 | 44.3° | 49.9° |
| C5 | C9 | C8 | O7 | 1.3° | 0.6° |
| C5 | C9 | C8 | C13 | 176.3° | 180.0° |
| C5 | C9 | C8 | C10 | 178.4° | 179.4° |
| C5 | C9 | C13 | C12 | 177.4° | 179.6° |
| C5 | C9 | C13 | O20 | 3.7° | 0.3° |
| C9 | C5 | C19 | H19 | 70.2° | 170.9° |
| C9 | C5 | C19 | H19A | 49.8° | 69.0° |
| C9 | C5 | C19 | H19B | 169.8° | 50.9° |
| C19 | C5 | C6 | O14 | 72.2° | 71.8° |
| C19 | C5 | C9 | C8 | 95.5° | 94.4° |
| C19 | C5 | C9 | C13 | 80.0° | 85.5° |
| C5 | C19 | H19 | H19A | 120.0° | 120.0° |
| C5 | C19 | H19 | H19B | 120.0° | 120.0° |
| C5 | C19 | H19A | H19B | 120.0° | 120.0° |
| O7 | C8 | C9 | C10 | 179.7° | 180.0° |
| O7 | C8 | C9 | C13 | 177.6° | 179.4° |
| O7 | C8 | C10 | C11 | 179.1° | 179.5° |
| O7 | C8 | C10 | C21 | 2.2° | 0.5° |
| C9 | C8 | C10 | C11 | 0.6° | 0.5° |
| C9 | C8 | C10 | C21 | 178.1° | 179.4° |
| C8 | C9 | C13 | C12 | 2.6° | 0.4° |
| C8 | C9 | C13 | O20 | 178.6° | 179.7° |
| C10 | C8 | C9 | C13 | 2.1° | 0.6° |
| C8 | C10 | C11 | C21 | 178.7° | 180.0° |
| C8 | C10 | C11 | C12 | 0.4° | 0.2° |
| C8 | C10 | C11 | O35 | 179.6° | 179.9° |
| C8 | C10 | C21 | O22 | 38.7° | 90.1° |
| C8 | C10 | C21 | N23 | 139.9° | 90.0° |
| C9 | C13 | C12 | C11 | 1.5° | 0.1° |
| C9 | C13 | C12 | O20 | 178.8° | 179.9° |
| C9 | C13 | C12 | H12 | 178.5° | 180.0° |
| C9 | C13 | O20 | HO20 | 10.5° | 90.0° |
| C10 | C11 | C12 | O35 | 179.9° | 179.9° |
| C10 | C11 | C12 | C13 | 0.0° | 0.0° |
| C11 | C10 | C21 | O22 | 142.6° | 90.0° |
| C11 | C10 | C21 | N23 | 38.8° | 90.0° |
| C10 | C11 | O35 | C36 | 176.1° | 180.0° |
| C10 | C11 | C12 | H12 | 180.0° | 179.9° |
| C21 | C10 | C11 | C12 | 179.1° | 179.8° |
| C21 | C10 | C11 | O35 | 0.9° | 0.2° |
| C10 | C21 | O22 | N23 | 178.5° | 179.9° |
| C10 | C21 | N23 | C24 | 179.7° | 180.0° |
| C10 | C21 | N23 | HN23 | 0.3° | 0.0° |
| C11 | C12 | C13 | H12 | 180.0° | 179.9° |
| C11 | C12 | C13 | O20 | 179.7° | 180.0° |
| C12 | C11 | O35 | C36 | 3.9° | 0.1° |
| O35 | C11 | C12 | C13 | 179.9° | 179.9° |
| O35 | C11 | C12 | H12 | 0.0° | 0.2° |
| C11 | O35 | C36 | H36 | 180.0° | 60.0° |
| C11 | O35 | C36 | H36A | 60.0° | 60.1° |
| C11 | O35 | C36 | H36B | 60.0° | 179.9° |
| C12 | C13 | O20 | HO20 | 168.4° | 90.0° |
| O20 | C13 | C12 | H12 | 0.3° | 0.1° |
| C15 | C16 | H16 | H16A | 120.0° | 120.1° |
| C15 | C16 | H16 | H16B | 120.0° | 120.0° |
| C15 | C16 | H16A | H16B | 120.0° | 120.0° |
| O17 | C15 | C16 | H16 | 0.0° | 119.2° |
| O17 | C15 | C16 | H16A | 120.0° | 0.8° |
| O17 | C15 | C16 | H16B | 120.0° | 120.8° |
| O22 | C21 | N23 | C24 | 1.7° | 0.0° |
| O22 | C21 | N23 | HN23 | 178.3° | 180.0° |
| C21 | N23 | C24 | HN23 | 180.0° | 180.0° |
| C21 | N23 | C24 | C25 | 172.6° | 180.0° |
| C21 | N23 | C24 | H24 | 53.2° | 60.0° |
| C21 | N23 | C24 | H24A | 67.9° | 60.0° |
| N23 | C24 | C25 | H24 | 119.4° | 120.0° |
| N23 | C24 | C25 | H24A | 119.4° | 120.0° |
| N23 | C24 | C25 | C26 | 107.1° | 100.0° |
| N23 | C24 | C25 | C30 | 72.6° | 79.7° |
| N23 | C24 | H24 | H24A | 121.7° | 120.0° |
| C24 | C25 | C26 | C30 | 179.8° | 179.8° |
| C24 | C25 | C26 | C27 | 179.4° | 180.0° |
| C24 | C25 | C30 | C29 | 179.5° | 179.7° |
| C24 | C25 | C30 | C34 | 0.7° | 0.1° |
| C25 | C24 | N23 | HN23 | 7.3° | 0.0° |
| C25 | C24 | H24 | H24A | 121.7° | 120.0° |
| C24 | C25 | C26 | H26 | 0.6° | 0.0° |
| C25 | C26 | C27 | H26 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.1° | 0.1° |
| C25 | C26 | C27 | O37 | 179.8° | 180.0° |
| C26 | C25 | C30 | C29 | 0.2° | 0.6° |
| C26 | C25 | C30 | C34 | 179.6° | 179.7° |
| C26 | C25 | C24 | H24 | 12.3° | 140.0° |
| C26 | C25 | C24 | H24A | 133.4° | 20.0° |
| C30 | C25 | C26 | C27 | 0.4° | 0.3° |
| C25 | C30 | C29 | C28 | 0.2° | 0.6° |
| C25 | C30 | C29 | C34 | 179.8° | 179.7° |
| C25 | C30 | C29 | C31 | 180.0° | 179.8° |
| C25 | C30 | C34 | C33 | 179.8° | 179.1° |
| C30 | C25 | C24 | H24 | 167.9° | 40.3° |
| C30 | C25 | C24 | H24A | 46.8° | 160.3° |
| C30 | C25 | C26 | H26 | 179.6° | 179.8° |
| C25 | C30 | C34 | H34 | 0.2° | 0.1° |
| C26 | C27 | C28 | O37 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 0.3° | 0.0° |
| C26 | C27 | O37 | C38 | 170.9° | 180.0° |
| C26 | C27 | C28 | H28 | 179.7° | 179.9° |
| C27 | C28 | C29 | H28 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.4° | 0.3° |
| C27 | C28 | C29 | C31 | 179.8° | 179.9° |
| C28 | C27 | O37 | C38 | 9.1° | 0.0° |
| C28 | C27 | C26 | H26 | 179.9° | 179.9° |
| O37 | C27 | C28 | C29 | 179.8° | 180.0° |
| C27 | O37 | C38 | C39 | 90.4° | 180.0° |
| O37 | C27 | C26 | H26 | 0.2° | 0.0° |
| O37 | C27 | C28 | H28 | 0.3° | 0.0° |
| C27 | O37 | C38 | H38 | 29.6° | 60.1° |
| C27 | O37 | C38 | H38A | 149.6° | 60.0° |
| C28 | C29 | C30 | C31 | 179.8° | 179.6° |
| C28 | C29 | C30 | C34 | 180.0° | 179.7° |
| C28 | C29 | C31 | C32 | 180.0° | 180.0° |
| C28 | C29 | C31 | H31 | 0.0° | 0.1° |
| C30 | C29 | C31 | C32 | 0.2° | 0.4° |
| C29 | C30 | C34 | C33 | 0.0° | 0.6° |
| C30 | C29 | C28 | H28 | 179.6° | 179.7° |
| C30 | C29 | C31 | H31 | 179.8° | 179.7° |
| C29 | C30 | C34 | H34 | 179.9° | 179.6° |
| C31 | C29 | C30 | C34 | 0.2° | 0.0° |
| C29 | C31 | C32 | H31 | 180.0° | 179.9° |
| C29 | C31 | C32 | C33 | 0.1° | 0.1° |
| C31 | C29 | C28 | H28 | 0.3° | 0.1° |
| C29 | C31 | C32 | H32 | 179.9° | 180.0° |
| C30 | C34 | C33 | C32 | 0.3° | 1.0° |
| C30 | C34 | C33 | H34 | 180.0° | 179.0° |
| C30 | C34 | C33 | H33 | 179.7° | 179.6° |
| C31 | C32 | C33 | H32 | 180.0° | 179.9° |
| C31 | C32 | C33 | C34 | 0.3° | 0.6° |
| C31 | C32 | C33 | H33 | 179.7° | 180.0° |
| C32 | C33 | C34 | H33 | 180.0° | 179.4° |
| C33 | C32 | C31 | H31 | 180.0° | 180.0° |
| C32 | C33 | C34 | H34 | 179.7° | 180.0° |
| C34 | C33 | C32 | H32 | 179.7° | 179.3° |
| O35 | C36 | H36 | H36A | 120.0° | 120.0° |
| O35 | C36 | H36 | H36B | 120.0° | 119.9° |
| O35 | C36 | H36A | H36B | 120.0° | 119.9° |
| O37 | C38 | C39 | H38 | 120.0° | 119.9° |
| O37 | C38 | C39 | H38A | 120.0° | 120.0° |
| O37 | C38 | H38 | H38A | 120.0° | 120.0° |
| O37 | C38 | C39 | H39 | 180.0° | 180.0° |
| O37 | C38 | C39 | H39A | 60.0° | 60.0° |
| O37 | C38 | C39 | H39B | 60.0° | 60.0° |
| C39 | C38 | H38 | H38A | 120.0° | 120.0° |
| C38 | C39 | H39 | H39A | 120.0° | 120.0° |
| C38 | C39 | H39 | H39B | 120.0° | 120.0° |
| C38 | C39 | H39A | H39B | 120.0° | 120.1° |
| H16 | C16 | H16A | H16B | 120.0° | 120.0° |
| H19 | C19 | H19A | H19B | 119.9° | 120.0° |
| HN23 | N23 | C24 | H24 | 126.8° | 120.0° |
| HN23 | N23 | C24 | H24A | 112.1° | 120.0° |
| H31 | C31 | C32 | H32 | 0.1° | 0.1° |
| H32 | C32 | C33 | H33 | 0.3° | 0.1° |
| H33 | C33 | C34 | H34 | 0.3° | 0.6° |
| H36 | C36 | H36A | H36B | 120.0° | 120.1° |
| H38 | C38 | C39 | H39 | 60.0° | 60.0° |
| H38 | C38 | C39 | H39A | 180.0° | 180.0° |
| H38 | C38 | C39 | H39B | 60.0° | 59.9° |
| H38A | C38 | C39 | H39 | 60.0° | 60.0° |
| H38A | C38 | C39 | H39A | 60.0° | 60.0° |
| H38A | C38 | C39 | H39B | 180.0° | 180.0° |
| H39 | C39 | H39A | H39B | 120.0° | 119.9° |
