G3X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | doub | 1.29Å | 1.37Å | |
| C1 | C42 | sing | 1.49Å | 1.57Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | C2 | sing | 1.50Å | 1.53Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| O18 | C3 | sing | 1.43Å | 1.44Å | |
| C3 | C4 | sing | 1.52Å | 1.55Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | C41 | sing | 1.50Å | 1.58Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| O5 | C41 | sing | 1.43Å | 1.47Å | |
| O5 | C13 | sing | 1.35Å | 1.37Å | |
| O17 | C6 | sing | 1.36Å | 1.39Å | |
| C13 | C6 | doub | 1.40Å | 1.41Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.42Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 1.41Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C15 | C8 | sing | 1.40Å | 1.41Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | C9 | sing | 1.50Å | 1.55Å | |
| C9 | N10 | sing | 1.45Å | 1.50Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C11 | N10 | sing | 1.45Å | 1.50Å | |
| N10 | C19 | sing | 1.47Å | 1.48Å | |
| C12 | C11 | sing | 1.50Å | 1.54Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C42 | C12 | sing | 1.52Å | 1.54Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.41Å | 1.39Å | Aromatic |
| C42 | C14 | sing | 1.52Å | 1.39Å | |
| C14 | C15 | doub | 1.36Å | 1.41Å | Aromatic |
| C16 | O17 | sing | 1.43Å | 1.44Å | |
| 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 | C20 | sing | 1.53Å | 1.53Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| N22 | C21 | sing | 1.47Å | 1.47Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| N22 | C27 | sing | 1.47Å | 1.48Å | |
| N22 | C23 | sing | 1.47Å | 1.49Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | C25 | sing | 1.53Å | 1.54Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C26 | C27 | sing | 1.53Å | 1.53Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C41 | C42 | sing | 1.53Å | 1.60Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C42 | 126.3° | 125.4° |
| C2 | C1 | H1 | 116.9° | 117.3° |
| C1 | C2 | C3 | 121.9° | 123.7° |
| C1 | C2 | H2 | 119.1° | 118.2° |
| C42 | C1 | H1 | 116.8° | 117.4° |
| C1 | C42 | C12 | 110.9° | 111.4° |
| C1 | C42 | C14 | 107.2° | 109.2° |
| C1 | C42 | C41 | 110.3° | 112.9° |
| C3 | C2 | H2 | 119.0° | 118.2° |
| C2 | C3 | O18 | 108.2° | 109.1° |
| C2 | C3 | C4 | 108.8° | 111.8° |
| C2 | C3 | H3 | 111.6° | 109.0° |
| O18 | C3 | C4 | 111.9° | 109.0° |
| O18 | C3 | H3 | 108.5° | 108.9° |
| C3 | O18 | HO18 | 109.5° | 114.0° |
| C4 | C3 | H3 | 107.9° | 109.0° |
| C3 | C4 | C41 | 111.3° | 113.8° |
| C3 | C4 | H4 | 108.9° | 108.6° |
| C3 | C4 | H4A | 108.9° | 108.6° |
| C41 | C4 | H4 | 108.9° | 108.6° |
| C41 | C4 | H4A | 108.9° | 108.6° |
| C4 | C41 | O5 | 109.3° | 112.4° |
| C4 | C41 | C42 | 114.2° | 114.5° |
| C4 | C41 | H41 | 105.1° | 108.6° |
| H4 | C4 | H4A | 110.0° | 108.4° |
| C41 | O5 | C13 | 105.9° | 109.1° |
| O5 | C41 | C42 | 105.1° | 104.4° |
| O5 | C41 | H41 | 114.2° | 108.6° |
| O5 | C13 | C6 | 130.2° | 127.2° |
| O5 | C13 | C14 | 110.6° | 112.4° |
| O17 | C6 | C13 | 118.6° | 121.6° |
| O17 | C6 | C7 | 121.9° | 121.5° |
| C6 | O17 | C16 | 114.2° | 117.0° |
| C13 | C6 | C7 | 119.4° | 116.9° |
| C6 | C13 | C14 | 119.2° | 120.4° |
| C6 | C7 | C8 | 120.2° | 121.7° |
| C6 | C7 | H7 | 119.9° | 119.2° |
| C8 | C7 | H7 | 119.9° | 119.1° |
| C7 | C8 | C15 | 120.7° | 121.8° |
| C7 | C8 | H8 | 119.7° | 119.1° |
| C15 | C8 | H8 | 119.7° | 119.1° |
| C8 | C15 | C9 | 118.0° | 115.9° |
| C8 | C15 | C14 | 117.6° | 116.6° |
| C15 | C9 | N10 | 113.7° | 112.7° |
| C15 | C9 | H9 | 108.1° | 109.1° |
| C15 | C9 | H9A | 108.1° | 108.5° |
| C9 | C15 | C14 | 124.3° | 127.3° |
| N10 | C9 | H9 | 108.1° | 108.9° |
| N10 | C9 | H9A | 108.1° | 108.9° |
| C9 | N10 | C11 | 115.9° | 116.0° |
| C9 | N10 | C19 | 111.2° | 111.0° |
| H9 | C9 | H9A | 110.8° | 108.8° |
| C11 | N10 | C19 | 109.7° | 111.0° |
| N10 | C11 | C12 | 114.5° | 114.5° |
| N10 | C11 | H11 | 107.8° | 108.5° |
| N10 | C11 | H11A | 107.8° | 108.5° |
| N10 | C19 | C20 | 113.6° | 109.5° |
| N10 | C19 | H19 | 108.1° | 109.5° |
| N10 | C19 | H19A | 108.1° | 109.4° |
| C12 | C11 | H11 | 107.8° | 108.2° |
| C12 | C11 | H11A | 107.8° | 108.6° |
| C11 | C12 | C42 | 112.2° | 112.6° |
| C11 | C12 | H12 | 108.6° | 108.9° |
| C11 | C12 | H12A | 108.6° | 108.8° |
| H11 | C11 | H11A | 111.1° | 108.4° |
| C42 | C12 | H12 | 108.6° | 108.9° |
| C42 | C12 | H12A | 108.6° | 108.9° |
| C12 | C42 | C14 | 121.1° | 111.2° |
| C12 | C42 | C41 | 106.3° | 109.3° |
| H12 | C12 | H12A | 110.4° | 108.7° |
| C13 | C14 | C42 | 113.7° | 105.6° |
| C13 | C14 | C15 | 122.9° | 122.5° |
| C42 | C14 | C15 | 123.3° | 131.8° |
| C14 | C42 | C41 | 100.3° | 102.5° |
| O17 | C16 | H16 | 109.5° | 109.5° |
| O17 | C16 | H16A | 109.5° | 109.5° |
| O17 | C16 | H16B | 109.5° | 109.5° |
| H16 | C16 | H16A | 109.5° | 109.4° |
| H16 | C16 | H16B | 109.5° | 109.5° |
| H16A | C16 | H16B | 109.5° | 109.5° |
| C20 | C19 | H19 | 108.1° | 109.5° |
| C20 | C19 | H19A | 108.1° | 109.5° |
| C19 | C20 | C21 | 111.8° | 109.5° |
| C19 | C20 | H20 | 108.7° | 109.5° |
| C19 | C20 | H20A | 108.7° | 109.5° |
| H19 | C19 | H19A | 110.8° | 109.5° |
| C21 | C20 | H20 | 108.7° | 109.4° |
| C21 | C20 | H20A | 108.7° | 109.5° |
| C20 | C21 | N22 | 110.2° | 109.5° |
| C20 | C21 | H21 | 109.2° | 109.4° |
| C20 | C21 | H21A | 109.2° | 109.5° |
| H20 | C20 | H20A | 110.2° | 109.5° |
| N22 | C21 | H21 | 109.2° | 109.5° |
| N22 | C21 | H21A | 109.2° | 109.5° |
| C21 | N22 | C27 | 113.0° | 111.0° |
| C21 | N22 | C23 | 112.9° | 111.0° |
| H21 | C21 | H21A | 109.7° | 109.5° |
| C27 | N22 | C23 | 115.6° | 111.2° |
| N22 | C27 | C26 | 109.2° | 109.5° |
| N22 | C27 | H27 | 109.6° | 109.4° |
| N22 | C27 | H27A | 109.6° | 109.5° |
| N22 | C23 | C24 | 109.2° | 109.5° |
| N22 | C23 | H23 | 109.5° | 109.5° |
| N22 | C23 | H23A | 109.6° | 109.5° |
| C24 | C23 | H23 | 109.6° | 109.5° |
| C24 | C23 | H23A | 109.6° | 109.4° |
| C23 | C24 | C25 | 109.9° | 109.3° |
| C23 | C24 | H24 | 109.3° | 109.6° |
| C23 | C24 | H24A | 109.3° | 109.5° |
| H23 | C23 | H23A | 109.4° | 109.5° |
| C25 | C24 | H24 | 109.3° | 109.5° |
| C25 | C24 | H24A | 109.3° | 109.5° |
| C24 | C25 | C26 | 110.8° | 109.2° |
| C24 | C25 | H25 | 109.0° | 109.5° |
| C24 | C25 | H25A | 109.0° | 109.5° |
| H24 | C24 | H24A | 109.6° | 109.5° |
| C26 | C25 | H25 | 109.0° | 109.6° |
| C26 | C25 | H25A | 109.1° | 109.5° |
| C25 | C26 | C27 | 110.1° | 109.2° |
| C25 | C26 | H26 | 109.3° | 109.5° |
| C25 | C26 | H26A | 109.3° | 109.5° |
| H25 | C25 | H25A | 109.9° | 109.5° |
| C27 | C26 | H26 | 109.3° | 109.5° |
| C27 | C26 | H26A | 109.3° | 109.5° |
| C26 | C27 | H27 | 109.6° | 109.4° |
| C26 | C27 | H27A | 109.6° | 109.4° |
| H26 | C26 | H26A | 109.6° | 109.5° |
| H27 | C27 | H27A | 109.4° | 109.5° |
| C42 | C41 | H41 | 109.2° | 108.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C42 | H1 | 180.0° | 179.7° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | O18 | 90.2° | 101.6° |
| C1 | C2 | C3 | C4 | 31.6° | 19.1° |
| C1 | C2 | C3 | H3 | 150.5° | 139.6° |
| C2 | C1 | C42 | C12 | 119.6° | 118.0° |
| C2 | C1 | C42 | C14 | 106.2° | 118.8° |
| C2 | C1 | C42 | C41 | 2.0° | 5.5° |
| C42 | C1 | C2 | C3 | 1.9° | 0.5° |
| C42 | C1 | C2 | H2 | 178.1° | 179.6° |
| C1 | C42 | C41 | C4 | 24.6° | 29.5° |
| C1 | C42 | C41 | O5 | 95.2° | 93.7° |
| C1 | C42 | C12 | C11 | 51.6° | 57.3° |
| C1 | C42 | C12 | C14 | 126.8° | 122.1° |
| C1 | C42 | C12 | C41 | 119.9° | 125.5° |
| C1 | C42 | C12 | H12 | 68.4° | 63.5° |
| C1 | C42 | C12 | H12A | 171.6° | 178.1° |
| C1 | C42 | C14 | C13 | 106.8° | 103.5° |
| C1 | C42 | C14 | C41 | 115.2° | 120.0° |
| C1 | C42 | C14 | C15 | 78.0° | 71.7° |
| C1 | C42 | C41 | H41 | 141.9° | 150.8° |
| H1 | C1 | C2 | C3 | 178.1° | 179.8° |
| H1 | C1 | C2 | H2 | 1.9° | 0.1° |
| H1 | C1 | C42 | C12 | 60.4° | 61.7° |
| H1 | C1 | C42 | C14 | 73.7° | 61.6° |
| H1 | C1 | C42 | C41 | 178.0° | 174.9° |
| C2 | C3 | O18 | C4 | 119.9° | 122.3° |
| C2 | C3 | O18 | H3 | 121.2° | 118.8° |
| C2 | C3 | C4 | H3 | 121.2° | 120.5° |
| C2 | C3 | C4 | C41 | 56.9° | 42.6° |
| C2 | C3 | C4 | H4 | 176.9° | 163.7° |
| C2 | C3 | C4 | H4A | 63.1° | 78.5° |
| C2 | C3 | O18 | HO18 | 180.0° | 60.0° |
| H2 | C2 | C3 | O18 | 89.9° | 78.3° |
| H2 | C2 | C3 | C4 | 148.4° | 161.0° |
| H2 | C2 | C3 | H3 | 29.4° | 40.5° |
| O18 | C3 | C4 | H3 | 119.3° | 118.8° |
| O18 | C3 | C4 | C41 | 62.6° | 78.1° |
| O18 | C3 | C4 | H4 | 57.4° | 43.1° |
| O18 | C3 | C4 | H4A | 177.4° | 160.8° |
| C3 | C4 | C41 | H4 | 120.0° | 121.1° |
| C3 | C4 | C41 | H4A | 120.0° | 121.1° |
| C3 | C4 | H4 | H4A | 119.2° | 117.9° |
| C3 | C4 | C41 | O5 | 61.8° | 69.7° |
| C4 | C3 | O18 | HO18 | 60.1° | 177.7° |
| C3 | C4 | C41 | C42 | 55.6° | 49.1° |
| C3 | C4 | C41 | H41 | 175.3° | 170.1° |
| H3 | C3 | C4 | C41 | 178.1° | 163.1° |
| H3 | C3 | C4 | H4 | 61.9° | 75.7° |
| H3 | C3 | C4 | H4A | 58.1° | 42.0° |
| H3 | C3 | O18 | HO18 | 58.8° | 58.8° |
| C41 | C4 | H4 | H4A | 119.3° | 117.9° |
| C4 | C41 | O5 | C42 | 123.0° | 124.6° |
| C4 | C41 | O5 | H41 | 117.3° | 120.2° |
| C4 | C41 | O5 | C13 | 144.1° | 147.7° |
| C4 | C41 | C42 | C12 | 95.8° | 95.1° |
| C4 | C41 | C42 | C14 | 137.3° | 146.8° |
| C4 | C41 | C42 | H41 | 117.3° | 121.2° |
| H4 | C4 | C41 | O5 | 58.2° | 51.4° |
| H4 | C4 | C41 | C42 | 175.6° | 170.3° |
| H4 | C4 | C41 | H41 | 64.7° | 68.7° |
| H4A | C4 | C41 | O5 | 178.2° | 169.1° |
| H4A | C4 | C41 | C42 | 64.4° | 72.0° |
| H4A | C4 | C41 | H41 | 55.3° | 49.0° |
| C41 | O5 | C13 | C6 | 162.3° | 168.7° |
| O5 | C41 | C42 | C12 | 144.5° | 141.6° |
| C41 | O5 | C13 | C14 | 16.7° | 13.0° |
| O5 | C41 | C42 | C14 | 17.6° | 23.6° |
| O5 | C41 | C42 | H41 | 122.9° | 115.5° |
| O5 | C13 | C6 | O17 | 1.6° | 3.3° |
| O5 | C13 | C6 | C14 | 179.0° | 178.2° |
| O5 | C13 | C6 | C7 | 179.5° | 176.6° |
| O5 | C13 | C14 | C42 | 4.8° | 3.1° |
| O5 | C13 | C14 | C15 | 180.0° | 178.9° |
| C13 | O5 | C41 | C42 | 21.0° | 23.1° |
| C13 | O5 | C41 | H41 | 98.6° | 92.1° |
| O17 | C6 | C13 | C7 | 177.9° | 179.9° |
| O17 | C6 | C7 | C8 | 177.7° | 178.9° |
| O17 | C6 | C7 | H7 | 2.3° | 1.1° |
| O17 | C6 | C13 | C14 | 177.3° | 178.5° |
| C6 | O17 | C16 | H16 | 180.0° | 59.9° |
| C6 | O17 | C16 | H16A | 60.0° | 60.0° |
| C6 | O17 | C16 | H16B | 60.0° | 180.0° |
| C13 | C6 | C7 | C8 | 0.1° | 1.2° |
| C13 | C6 | C7 | H7 | 179.9° | 178.9° |
| C6 | C13 | C14 | C42 | 174.4° | 175.3° |
| C6 | C13 | C14 | C15 | 0.8° | 0.5° |
| C13 | C6 | O17 | C16 | 154.0° | 180.0° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C15 | 0.1° | 1.2° |
| C6 | C7 | C8 | H8 | 179.9° | 178.8° |
| C7 | C6 | C13 | C14 | 0.6° | 1.6° |
| C7 | C6 | O17 | C16 | 28.2° | 0.1° |
| C7 | C8 | C15 | H8 | 180.0° | 180.0° |
| C7 | C8 | C15 | C9 | 176.3° | 172.7° |
| C7 | C8 | C15 | C14 | 0.1° | 3.2° |
| H7 | C7 | C8 | C15 | 179.9° | 178.7° |
| H7 | C7 | C8 | H8 | 0.1° | 1.2° |
| C8 | C15 | C9 | C14 | 176.2° | 175.4° |
| C8 | C15 | C9 | N10 | 124.3° | 138.7° |
| C8 | C15 | C9 | H9 | 115.8° | 17.7° |
| C8 | C15 | C9 | H9A | 4.3° | 100.6° |
| C8 | C15 | C14 | C13 | 0.6° | 2.8° |
| C8 | C15 | C14 | C42 | 174.1° | 171.8° |
| H8 | C8 | C15 | C9 | 3.7° | 7.2° |
| H8 | C8 | C15 | C14 | 179.9° | 176.8° |
| C15 | C9 | N10 | H9 | 120.0° | 121.1° |
| C15 | C9 | N10 | H9A | 120.0° | 120.4° |
| C15 | C9 | H9 | H9A | 118.3° | 118.2° |
| C15 | C9 | N10 | C11 | 73.4° | 70.0° |
| C15 | C9 | N10 | C19 | 160.4° | 162.0° |
| C9 | C15 | C14 | C13 | 175.6° | 172.6° |
| C9 | C15 | C14 | C42 | 9.7° | 12.9° |
| N10 | C9 | H9 | H9A | 118.2° | 118.5° |
| C9 | N10 | C11 | C19 | 126.9° | 127.9° |
| C9 | N10 | C11 | C12 | 70.1° | 84.8° |
| C9 | N10 | C11 | H11 | 49.9° | 36.1° |
| C9 | N10 | C11 | H11A | 169.9° | 153.7° |
| N10 | C9 | C15 | C14 | 59.6° | 36.7° |
| C9 | N10 | C19 | C20 | 76.9° | 66.0° |
| C9 | N10 | C19 | H19 | 163.1° | 173.9° |
| C9 | N10 | C19 | H19A | 43.1° | 54.0° |
| H9 | C9 | N10 | C11 | 46.5° | 168.9° |
| H9 | C9 | N10 | C19 | 79.6° | 40.9° |
| H9 | C9 | C15 | C14 | 60.4° | 157.7° |
| H9A | C9 | N10 | C11 | 166.5° | 50.4° |
| H9A | C9 | N10 | C19 | 40.4° | 77.6° |
| H9A | C9 | C15 | C14 | 179.6° | 84.0° |
| N10 | C11 | C12 | H11 | 120.0° | 121.1° |
| N10 | C11 | C12 | H11A | 120.0° | 121.4° |
| N10 | C11 | H11 | H11A | 117.9° | 117.6° |
| N10 | C11 | C12 | C42 | 67.8° | 78.0° |
| N10 | C11 | C12 | H12 | 172.2° | 161.2° |
| N10 | C11 | C12 | H12A | 52.2° | 42.9° |
| C11 | N10 | C19 | C20 | 153.6° | 163.4° |
| C11 | N10 | C19 | H19 | 33.7° | 43.4° |
| C11 | N10 | C19 | H19A | 86.4° | 76.6° |
| C19 | N10 | C11 | C12 | 163.0° | 147.2° |
| C19 | N10 | C11 | H11 | 77.0° | 91.8° |
| C19 | N10 | C11 | H11A | 43.0° | 25.8° |
| N10 | C19 | C20 | H19 | 120.0° | 120.0° |
| N10 | C19 | C20 | H19A | 120.0° | 120.0° |
| N10 | C19 | H19 | H19A | 118.3° | 119.9° |
| N10 | C19 | C20 | C21 | 66.3° | 180.0° |
| N10 | C19 | C20 | H20 | 173.7° | 60.0° |
| N10 | C19 | C20 | H20A | 53.7° | 60.0° |
| C12 | C11 | H11 | H11A | 117.9° | 117.6° |
| C11 | C12 | C42 | H12 | 120.0° | 120.8° |
| C11 | C12 | C42 | H12A | 120.0° | 120.8° |
| C11 | C12 | H12 | H12A | 118.9° | 118.4° |
| C11 | C12 | C42 | C14 | 75.3° | 64.7° |
| C11 | C12 | C42 | C41 | 171.5° | 177.2° |
| H11 | C11 | C12 | C42 | 52.2° | 43.2° |
| H11 | C11 | C12 | H12 | 67.8° | 77.6° |
| H11 | C11 | C12 | H12A | 172.2° | 164.0° |
| H11A | C11 | C12 | C42 | 172.2° | 160.6° |
| H11A | C11 | C12 | H12 | 52.2° | 39.8° |
| H11A | C11 | C12 | H12A | 67.8° | 78.5° |
| C42 | C12 | H12 | H12A | 118.9° | 118.5° |
| C12 | C42 | C14 | C13 | 124.7° | 133.1° |
| C12 | C42 | C14 | C41 | 116.3° | 116.6° |
| C12 | C42 | C14 | C15 | 50.5° | 51.7° |
| C12 | C42 | C41 | H41 | 21.5° | 26.1° |
| H12 | C12 | C42 | C14 | 164.7° | 174.4° |
| H12 | C12 | C42 | C41 | 51.5° | 62.0° |
| H12A | C12 | C42 | C14 | 44.7° | 56.1° |
| H12A | C12 | C42 | C41 | 68.5° | 56.4° |
| C13 | C14 | C42 | C15 | 175.2° | 175.2° |
| C13 | C14 | C42 | C41 | 8.3° | 16.5° |
| C14 | C42 | C41 | H41 | 105.3° | 91.9° |
| C15 | C14 | C42 | C41 | 166.8° | 168.3° |
| O17 | C16 | H16 | H16A | 120.0° | 120.0° |
| O17 | C16 | H16 | H16B | 120.0° | 120.0° |
| O17 | C16 | H16A | H16B | 120.0° | 120.0° |
| H16 | C16 | H16A | H16B | 120.0° | 120.0° |
| C20 | C19 | H19 | H19A | 118.3° | 120.0° |
| C19 | C20 | C21 | H20 | 120.0° | 120.0° |
| C19 | C20 | C21 | H20A | 120.0° | 120.0° |
| C19 | C20 | H20 | H20A | 119.1° | 120.0° |
| C19 | C20 | C21 | N22 | 73.1° | 180.0° |
| C19 | C20 | C21 | H21 | 46.9° | 60.0° |
| C19 | C20 | C21 | H21A | 166.9° | 60.0° |
| H19 | C19 | C20 | C21 | 53.7° | 60.0° |
| H19 | C19 | C20 | H20 | 66.4° | 180.0° |
| H19 | C19 | C20 | H20A | 173.7° | 60.0° |
| H19A | C19 | C20 | C21 | 173.7° | 60.0° |
| H19A | C19 | C20 | H20 | 53.7° | 60.0° |
| H19A | C19 | C20 | H20A | 66.3° | 180.0° |
| C21 | C20 | H20 | H20A | 119.0° | 120.0° |
| C20 | C21 | N22 | H21 | 120.0° | 120.0° |
| C20 | C21 | N22 | H21A | 120.0° | 120.0° |
| C20 | C21 | H21 | H21A | 119.7° | 120.0° |
| C20 | C21 | N22 | C27 | 129.1° | 170.0° |
| C20 | C21 | N22 | C23 | 97.4° | 65.8° |
| H20 | C20 | C21 | N22 | 166.8° | 60.0° |
| H20 | C20 | C21 | H21 | 73.2° | 180.0° |
| H20 | C20 | C21 | H21A | 46.9° | 60.0° |
| H20A | C20 | C21 | N22 | 46.9° | 60.0° |
| H20A | C20 | C21 | H21 | 166.9° | 60.0° |
| H20A | C20 | C21 | H21A | 73.1° | 180.0° |
| N22 | C21 | H21 | H21A | 119.7° | 120.0° |
| C21 | N22 | C27 | C23 | 132.2° | 124.1° |
| C21 | N22 | C23 | C24 | 170.7° | 174.1° |
| C21 | N22 | C23 | H23 | 69.3° | 65.8° |
| C21 | N22 | C23 | H23A | 50.7° | 54.2° |
| C21 | N22 | C27 | C26 | 170.6° | 174.2° |
| C21 | N22 | C27 | H27 | 50.6° | 54.2° |
| C21 | N22 | C27 | H27A | 69.4° | 65.8° |
| H21 | C21 | N22 | C27 | 9.1° | 50.0° |
| H21 | C21 | N22 | C23 | 142.6° | 174.2° |
| H21A | C21 | N22 | C27 | 111.0° | 70.0° |
| H21A | C21 | N22 | C23 | 22.6° | 54.2° |
| C27 | N22 | C23 | C24 | 57.0° | 61.8° |
| C27 | N22 | C23 | H23 | 62.9° | 58.3° |
| C27 | N22 | C23 | H23A | 177.1° | 178.3° |
| N22 | C27 | C26 | C25 | 55.5° | 59.2° |
| N22 | C27 | C26 | H27 | 120.0° | 120.0° |
| N22 | C27 | C26 | H27A | 120.0° | 120.0° |
| N22 | C27 | C26 | H26 | 175.5° | 179.1° |
| N22 | C27 | C26 | H26A | 64.6° | 60.8° |
| N22 | C27 | H27 | H27A | 120.1° | 120.0° |
| N22 | C23 | C24 | H23 | 120.0° | 120.0° |
| N22 | C23 | C24 | H23A | 120.0° | 120.0° |
| N22 | C23 | H23 | H23A | 120.1° | 120.0° |
| N22 | C23 | C24 | C25 | 54.9° | 59.2° |
| N22 | C23 | C24 | H24 | 174.9° | 179.1° |
| N22 | C23 | C24 | H24A | 65.0° | 60.7° |
| C23 | N22 | C27 | C26 | 57.2° | 61.8° |
| C23 | N22 | C27 | H27 | 177.2° | 178.3° |
| C23 | N22 | C27 | H27A | 62.8° | 58.2° |
| C24 | C23 | H23 | H23A | 120.1° | 119.9° |
| C23 | C24 | C25 | H24 | 120.0° | 120.0° |
| C23 | C24 | C25 | H24A | 120.0° | 119.9° |
| C23 | C24 | H24 | H24A | 119.8° | 120.1° |
| C23 | C24 | C25 | C26 | 57.3° | 57.7° |
| C23 | C24 | C25 | H25 | 62.6° | 62.3° |
| C23 | C24 | C25 | H25A | 177.4° | 177.6° |
| H23 | C23 | C24 | C25 | 65.0° | 60.9° |
| H23 | C23 | C24 | H24 | 55.0° | 59.1° |
| H23 | C23 | C24 | H24A | 175.0° | 179.2° |
| H23A | C23 | C24 | C25 | 175.0° | 179.2° |
| H23A | C23 | C24 | H24 | 65.0° | 60.9° |
| H23A | C23 | C24 | H24A | 55.0° | 59.3° |
| C25 | C24 | H24 | H24A | 119.8° | 120.0° |
| C24 | C25 | C26 | H25 | 120.0° | 119.9° |
| C24 | C25 | C26 | H25A | 120.0° | 119.9° |
| C24 | C25 | H25 | H25A | 119.5° | 120.1° |
| C24 | C25 | C26 | C27 | 57.6° | 57.7° |
| C24 | C25 | C26 | H26 | 177.6° | 177.6° |
| C24 | C25 | C26 | H26A | 62.4° | 62.3° |
| H24 | C24 | C25 | C26 | 177.3° | 177.7° |
| H24 | C24 | C25 | H25 | 57.4° | 57.7° |
| H24 | C24 | C25 | H25A | 62.6° | 62.4° |
| H24A | C24 | C25 | C26 | 62.6° | 62.3° |
| H24A | C24 | C25 | H25 | 177.4° | 177.7° |
| H24A | C24 | C25 | H25A | 57.4° | 57.7° |
| C26 | C25 | H25 | H25A | 119.5° | 120.2° |
| C25 | C26 | C27 | H26 | 120.0° | 119.9° |
| C25 | C26 | C27 | H26A | 120.0° | 120.0° |
| C25 | C26 | H26 | H26A | 119.7° | 120.1° |
| C25 | C26 | C27 | H27 | 175.4° | 179.2° |
| C25 | C26 | C27 | H27A | 64.5° | 60.8° |
| H25 | C25 | C26 | C27 | 62.4° | 62.3° |
| H25 | C25 | C26 | H26 | 57.6° | 57.6° |
| H25 | C25 | C26 | H26A | 177.6° | 177.8° |
| H25A | C25 | C26 | C27 | 177.6° | 177.6° |
| H25A | C25 | C26 | H26 | 62.4° | 62.5° |
| H25A | C25 | C26 | H26A | 57.6° | 57.7° |
| C27 | C26 | H26 | H26A | 119.7° | 120.1° |
| C26 | C27 | H27 | H27A | 120.1° | 120.0° |
| H26 | C26 | C27 | H27 | 64.5° | 60.9° |
| H26 | C26 | C27 | H27A | 55.5° | 59.1° |
| H26A | C26 | C27 | H27 | 55.4° | 59.2° |
| H26A | C26 | C27 | H27A | 175.4° | 179.2° |
