D3X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | O8 | sing | 1.43Å | 1.43Å | |
| C1 | O10 | sing | 1.43Å | 1.43Å | |
| N1 | C3 | sing | 1.35Å | 1.33Å | |
| N1 | O11 | sing | 1.42Å | 1.38Å | |
| O1 | C3 | doub | 1.21Å | 1.23Å | |
| S1 | N2 | sing | 1.65Å | 1.54Å | |
| S1 | O2 | doub | 1.42Å | 1.44Å | |
| S1 | O3 | doub | 1.42Å | 1.44Å | |
| S1 | C12 | sing | 1.76Å | 1.61Å | |
| C2 | O4 | sing | 1.43Å | 1.42Å | |
| C2 | C7 | sing | 1.53Å | 1.52Å | |
| N2 | C9 | sing | 1.47Å | 1.46Å | |
| N2 | C10 | sing | 1.47Å | 1.47Å | |
| C3 | C10 | sing | 1.51Å | 1.51Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | O9 | sing | 1.43Å | 1.43Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C5 | O8 | sing | 1.43Å | 1.44Å | |
| O5 | C7 | sing | 1.43Å | 1.43Å | |
| C6 | O6 | sing | 1.43Å | 1.41Å | |
| C6 | C7 | sing | 1.53Å | 1.54Å | |
| O7 | C16 | sing | 1.36Å | 1.38Å | |
| O7 | C17 | sing | 1.43Å | 1.44Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C8 | O10 | sing | 1.43Å | 1.42Å | |
| C11 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.41Å | Aromatic |
| C12 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C13 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| O9 | HO9 | sing | 0.97Å | 0.95Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| O11 | HO11 | sing | 0.97Å | 0.95Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C17 | H17B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O8 | 108.8° | 109.4° |
| C2 | C1 | O10 | 108.0° | 109.5° |
| C1 | C2 | O4 | 106.6° | 109.5° |
| C1 | C2 | C7 | 111.5° | 109.1° |
| C2 | C1 | H1 | 110.7° | 109.5° |
| C1 | C2 | H2 | 110.5° | 109.5° |
| O8 | C1 | O10 | 108.9° | 109.5° |
| C1 | O8 | C5 | 113.7° | 114.1° |
| O8 | C1 | H1 | 109.8° | 109.5° |
| C1 | O10 | C8 | 114.9° | 114.0° |
| O10 | C1 | H1 | 110.5° | 109.5° |
| C3 | N1 | O11 | 115.7° | 120.1° |
| N1 | C3 | O1 | 122.2° | 120.0° |
| N1 | C3 | C10 | 116.9° | 120.0° |
| C3 | N1 | HN1 | 122.2° | 120.0° |
| O11 | N1 | HN1 | 122.2° | 120.0° |
| N1 | O11 | HO11 | 109.5° | 114.0° |
| O1 | C3 | C10 | 120.8° | 120.0° |
| N2 | S1 | O2 | 108.6° | 106.4° |
| N2 | S1 | O3 | 111.8° | 106.4° |
| N2 | S1 | C12 | 113.0° | 107.2° |
| S1 | N2 | C9 | 118.6° | 120.0° |
| S1 | N2 | C10 | 119.6° | 120.0° |
| O2 | S1 | O3 | 108.5° | 123.1° |
| O2 | S1 | C12 | 107.3° | 106.4° |
| O3 | S1 | C12 | 107.4° | 106.4° |
| S1 | C12 | C13 | 121.9° | 120.0° |
| S1 | C12 | C14 | 118.8° | 119.9° |
| O4 | C2 | C7 | 110.9° | 109.5° |
| O4 | C2 | H2 | 111.1° | 109.5° |
| C2 | O4 | HO4 | 109.5° | 114.0° |
| C2 | C7 | O5 | 108.4° | 109.5° |
| C2 | C7 | C6 | 111.5° | 109.0° |
| C7 | C2 | H2 | 106.2° | 109.6° |
| C2 | C7 | H7 | 109.9° | 109.6° |
| C9 | N2 | C10 | 121.7° | 120.0° |
| N2 | C9 | C8 | 109.2° | 109.5° |
| N2 | C9 | H9 | 109.5° | 109.4° |
| N2 | C9 | H9A | 109.6° | 109.5° |
| N2 | C10 | C3 | 106.7° | 109.5° |
| N2 | C10 | H10 | 110.4° | 109.5° |
| N2 | C10 | H10A | 110.4° | 109.4° |
| C3 | C10 | H10 | 110.4° | 109.5° |
| C3 | C10 | H10A | 110.4° | 109.5° |
| C5 | C4 | O9 | 111.6° | 109.5° |
| C4 | C5 | C6 | 114.2° | 109.5° |
| C4 | C5 | O8 | 108.0° | 109.5° |
| C5 | C4 | H4 | 108.8° | 109.5° |
| C5 | C4 | H4A | 108.8° | 109.5° |
| C4 | C5 | H5 | 108.0° | 109.5° |
| O9 | C4 | H4 | 108.8° | 109.5° |
| O9 | C4 | H4A | 108.8° | 109.4° |
| C4 | O9 | HO9 | 109.5° | 114.0° |
| C6 | C5 | O8 | 111.5° | 109.4° |
| C5 | C6 | O6 | 106.6° | 109.5° |
| C5 | C6 | C7 | 111.4° | 109.1° |
| C6 | C5 | H5 | 104.2° | 109.5° |
| C5 | C6 | H6 | 110.1° | 109.5° |
| O8 | C5 | H5 | 110.9° | 109.5° |
| O5 | C7 | C6 | 112.3° | 109.5° |
| C7 | O5 | HO5 | 109.5° | 114.0° |
| O5 | C7 | H7 | 109.0° | 109.5° |
| O6 | C6 | C7 | 109.7° | 109.5° |
| O6 | C6 | H6 | 111.9° | 109.5° |
| C6 | O6 | HO6 | 109.5° | 114.0° |
| C7 | C6 | H6 | 107.1° | 109.6° |
| C6 | C7 | H7 | 105.8° | 109.6° |
| C16 | O7 | C17 | 123.5° | 117.0° |
| O7 | C16 | C11 | 117.7° | 120.1° |
| O7 | C16 | C15 | 122.5° | 120.1° |
| O7 | C17 | H17 | 109.5° | 109.4° |
| O7 | C17 | H17A | 109.4° | 109.5° |
| O7 | C17 | H17B | 109.4° | 109.5° |
| C9 | C8 | O10 | 107.5° | 109.5° |
| C9 | C8 | H8 | 110.1° | 109.5° |
| C9 | C8 | H8A | 110.1° | 109.5° |
| C8 | C9 | H9 | 109.6° | 109.5° |
| C8 | C9 | H9A | 109.5° | 109.5° |
| O10 | C8 | H8 | 110.1° | 109.5° |
| O10 | C8 | H8A | 110.1° | 109.5° |
| C14 | C11 | C16 | 120.6° | 120.0° |
| C11 | C14 | C12 | 120.3° | 120.0° |
| C14 | C11 | H11 | 119.7° | 120.0° |
| C11 | C14 | H14 | 119.8° | 120.0° |
| C11 | C16 | C15 | 119.8° | 119.9° |
| C16 | C11 | H11 | 119.7° | 120.0° |
| C13 | C12 | C14 | 119.2° | 120.1° |
| C12 | C13 | C15 | 120.3° | 120.1° |
| C12 | C13 | H13 | 119.9° | 120.0° |
| C12 | C14 | H14 | 119.9° | 120.0° |
| C13 | C15 | C16 | 119.8° | 120.0° |
| C15 | C13 | H13 | 119.9° | 120.0° |
| C13 | C15 | H15 | 120.1° | 120.0° |
| C16 | C15 | H15 | 120.1° | 120.0° |
| H4 | C4 | H4A | 110.2° | 109.5° |
| H8 | C8 | H8A | 108.8° | 109.4° |
| H9 | C9 | H9A | 109.4° | 109.5° |
| H10 | C10 | H10A | 108.5° | 109.4° |
| H17 | C17 | H17A | 109.5° | 109.4° |
| H17 | C17 | H17B | 109.5° | 109.5° |
| H17A | C17 | H17B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O8 | O10 | 117.6° | 120.0° |
| C2 | C1 | O8 | H1 | 121.3° | 120.0° |
| C2 | C1 | O10 | H1 | 121.2° | 120.1° |
| C1 | C2 | O4 | C7 | 121.6° | 119.6° |
| C1 | C2 | O4 | H2 | 120.5° | 120.1° |
| C1 | C2 | C7 | H2 | 120.5° | 120.0° |
| C2 | C1 | O8 | C5 | 62.8° | 61.2° |
| C1 | C2 | C7 | O5 | 175.0° | 176.9° |
| C1 | C2 | C7 | C6 | 51.0° | 57.0° |
| C2 | C1 | O10 | C8 | 141.4° | 175.0° |
| C1 | C2 | O4 | HO4 | 180.0° | 60.1° |
| C1 | C2 | C7 | H7 | 65.9° | 63.0° |
| O8 | C1 | O10 | H1 | 120.7° | 120.0° |
| O8 | C1 | C2 | O4 | 178.9° | 177.5° |
| O8 | C1 | C2 | C7 | 57.7° | 57.7° |
| C1 | O8 | C5 | C4 | 174.2° | 178.9° |
| C1 | O8 | C5 | C6 | 59.5° | 61.2° |
| O8 | C1 | O10 | C8 | 100.5° | 65.0° |
| O8 | C1 | C2 | H2 | 60.2° | 62.4° |
| C1 | O8 | C5 | H5 | 56.1° | 58.8° |
| O10 | C1 | C2 | O4 | 62.9° | 62.5° |
| O10 | C1 | C2 | C7 | 175.9° | 177.6° |
| O10 | C1 | O8 | C5 | 179.6° | 178.9° |
| C1 | O10 | C8 | C9 | 164.6° | 180.0° |
| O10 | C1 | C2 | H2 | 58.0° | 57.6° |
| C1 | O10 | C8 | H8 | 44.6° | 60.0° |
| C1 | O10 | C8 | H8A | 75.4° | 60.0° |
| C3 | N1 | O11 | HN1 | 180.0° | 180.0° |
| N1 | C3 | O1 | C10 | 178.9° | 180.0° |
| N1 | C3 | C10 | N2 | 128.3° | 180.0° |
| N1 | C3 | C10 | H10 | 111.7° | 60.0° |
| N1 | C3 | C10 | H10A | 8.3° | 60.0° |
| C3 | N1 | O11 | HO11 | 1.3° | 180.0° |
| O11 | N1 | C3 | O1 | 2.8° | 0.0° |
| O11 | N1 | C3 | C10 | 176.1° | 180.0° |
| O1 | C3 | C10 | N2 | 50.7° | 0.0° |
| O1 | C3 | N1 | HN1 | 177.2° | 180.0° |
| O1 | C3 | C10 | H10 | 69.3° | 120.0° |
| O1 | C3 | C10 | H10A | 170.7° | 120.0° |
| N2 | S1 | O2 | O3 | 121.8° | 123.0° |
| N2 | S1 | O2 | C12 | 122.4° | 114.1° |
| N2 | S1 | O3 | C12 | 124.5° | 114.1° |
| S1 | N2 | C9 | C10 | 177.8° | 179.9° |
| S1 | N2 | C10 | C3 | 90.2° | 95.0° |
| S1 | N2 | C9 | C8 | 150.3° | 95.0° |
| N2 | S1 | C12 | C13 | 90.0° | 90.0° |
| N2 | S1 | C12 | C14 | 92.7° | 90.0° |
| S1 | N2 | C9 | H9 | 89.7° | 145.0° |
| S1 | N2 | C9 | H9A | 30.3° | 25.0° |
| S1 | N2 | C10 | H10 | 149.8° | 145.0° |
| S1 | N2 | C10 | H10A | 29.8° | 25.1° |
| O2 | S1 | O3 | C12 | 115.7° | 122.9° |
| O2 | S1 | N2 | C9 | 156.5° | 156.5° |
| O2 | S1 | N2 | C10 | 25.7° | 23.6° |
| O2 | S1 | C12 | C13 | 150.3° | 23.6° |
| O2 | S1 | C12 | C14 | 27.0° | 156.4° |
| O3 | S1 | N2 | C9 | 36.8° | 23.6° |
| O3 | S1 | N2 | C10 | 145.4° | 156.5° |
| O3 | S1 | C12 | C13 | 33.8° | 156.4° |
| O3 | S1 | C12 | C14 | 143.6° | 23.6° |
| C12 | S1 | N2 | C9 | 84.6° | 90.0° |
| C12 | S1 | N2 | C10 | 93.3° | 89.9° |
| S1 | C12 | C14 | C11 | 177.5° | 180.0° |
| S1 | C12 | C13 | C14 | 177.4° | 180.0° |
| S1 | C12 | C13 | C15 | 178.4° | 180.0° |
| S1 | C12 | C13 | H13 | 1.6° | 0.0° |
| S1 | C12 | C14 | H14 | 2.6° | 0.0° |
| O4 | C2 | C7 | H2 | 120.9° | 120.2° |
| O4 | C2 | C7 | O5 | 66.3° | 63.3° |
| O4 | C2 | C7 | C6 | 169.6° | 176.9° |
| O4 | C2 | C1 | H1 | 58.2° | 57.5° |
| O4 | C2 | C7 | H7 | 52.7° | 56.9° |
| C2 | C7 | C6 | C5 | 46.4° | 57.0° |
| C2 | C7 | O5 | C6 | 123.6° | 119.5° |
| C2 | C7 | O5 | H7 | 119.6° | 120.2° |
| C2 | C7 | C6 | O6 | 164.3° | 176.9° |
| C2 | C7 | C6 | H7 | 119.4° | 120.0° |
| C7 | C2 | C1 | H1 | 63.0° | 62.3° |
| C7 | C2 | O4 | HO4 | 58.4° | 179.7° |
| C2 | C7 | O5 | HO5 | 180.0° | 60.0° |
| C2 | C7 | C6 | H6 | 74.1° | 62.9° |
| C9 | N2 | C10 | C3 | 87.6° | 85.0° |
| N2 | C9 | C8 | H9 | 120.0° | 119.9° |
| N2 | C9 | C8 | H9A | 120.0° | 120.0° |
| N2 | C9 | C8 | O10 | 78.4° | 65.0° |
| N2 | C9 | C8 | H8 | 161.6° | 175.0° |
| N2 | C9 | C8 | H8A | 41.6° | 55.0° |
| N2 | C9 | H9 | H9A | 120.1° | 120.0° |
| C9 | N2 | C10 | H10 | 32.5° | 35.0° |
| C9 | N2 | C10 | H10A | 152.4° | 155.0° |
| N2 | C10 | C3 | H10 | 120.0° | 120.0° |
| N2 | C10 | C3 | H10A | 120.0° | 120.0° |
| C10 | N2 | C9 | C8 | 31.9° | 85.0° |
| C10 | N2 | C9 | H9 | 88.1° | 35.0° |
| C10 | N2 | C9 | H9A | 151.9° | 155.0° |
| N2 | C10 | H10 | H10A | 121.1° | 119.9° |
| C10 | C3 | N1 | HN1 | 3.9° | 0.0° |
| C3 | C10 | H10 | H10A | 121.2° | 120.0° |
| C5 | C4 | O9 | H4 | 120.0° | 120.0° |
| C5 | C4 | O9 | H4A | 120.0° | 120.0° |
| C4 | C5 | C6 | O8 | 122.8° | 120.0° |
| C4 | C5 | C6 | H5 | 117.5° | 120.0° |
| C4 | C5 | O8 | H5 | 118.1° | 120.0° |
| C4 | C5 | C6 | O6 | 67.9° | 62.5° |
| C4 | C5 | C6 | C7 | 172.4° | 177.6° |
| C5 | C4 | H4 | H4A | 119.1° | 120.0° |
| C4 | C5 | C6 | H6 | 53.7° | 57.6° |
| C5 | C4 | O9 | HO9 | 180.0° | 180.0° |
| O9 | C4 | C5 | C6 | 50.2° | 175.0° |
| O9 | C4 | C5 | O8 | 74.5° | 65.0° |
| O9 | C4 | H4 | H4A | 119.2° | 119.9° |
| O9 | C4 | C5 | H5 | 165.6° | 55.0° |
| C6 | C5 | O8 | H5 | 115.6° | 120.0° |
| C5 | C6 | C7 | O5 | 168.3° | 176.8° |
| C5 | C6 | O6 | C7 | 120.8° | 119.6° |
| C5 | C6 | O6 | H6 | 120.5° | 120.1° |
| C5 | C6 | C7 | H6 | 120.5° | 120.0° |
| C6 | C5 | C4 | H4 | 170.2° | 55.0° |
| C6 | C5 | C4 | H4A | 69.8° | 65.0° |
| C5 | C6 | O6 | HO6 | 180.0° | 180.0° |
| C5 | C6 | C7 | H7 | 73.0° | 63.0° |
| O8 | C5 | C6 | O6 | 169.3° | 177.5° |
| O8 | C5 | C6 | C7 | 49.6° | 57.6° |
| C5 | O8 | C1 | H1 | 58.4° | 58.8° |
| O8 | C5 | C4 | H4 | 45.6° | 174.9° |
| O8 | C5 | C4 | H4A | 165.6° | 54.9° |
| O8 | C5 | C6 | H6 | 69.1° | 62.4° |
| O5 | C7 | C6 | O6 | 73.9° | 63.3° |
| O5 | C7 | C6 | H7 | 118.8° | 120.2° |
| O5 | C7 | C2 | H2 | 54.6° | 56.9° |
| O5 | C7 | C6 | H6 | 47.7° | 56.9° |
| O6 | C6 | C7 | H6 | 121.6° | 120.2° |
| O6 | C6 | C5 | H5 | 49.6° | 57.5° |
| O6 | C6 | C7 | H7 | 44.9° | 56.9° |
| C6 | C7 | C2 | H2 | 69.5° | 62.9° |
| C7 | C6 | C5 | H5 | 70.1° | 62.4° |
| C6 | C7 | O5 | HO5 | 56.4° | 179.5° |
| C7 | C6 | O6 | HO6 | 59.2° | 60.4° |
| O7 | C16 | C11 | C14 | 179.5° | 180.0° |
| O7 | C16 | C11 | C15 | 179.0° | 180.0° |
| O7 | C16 | C15 | C13 | 178.5° | 180.0° |
| O7 | C16 | C11 | H11 | 0.5° | 0.3° |
| O7 | C16 | C15 | H15 | 1.5° | 0.1° |
| C16 | O7 | C17 | H17 | 180.0° | 60.0° |
| C16 | O7 | C17 | H17A | 60.0° | 59.9° |
| C16 | O7 | C17 | H17B | 60.0° | 180.0° |
| C17 | O7 | C16 | C11 | 162.4° | 180.0° |
| C17 | O7 | C16 | C15 | 16.6° | 0.0° |
| O7 | C17 | H17 | H17A | 120.0° | 119.9° |
| O7 | C17 | H17 | H17B | 120.0° | 120.0° |
| O7 | C17 | H17A | H17B | 120.0° | 120.1° |
| C9 | C8 | O10 | H8 | 120.0° | 120.0° |
| C9 | C8 | O10 | H8A | 120.0° | 120.0° |
| C9 | C8 | H8 | H8A | 120.8° | 120.0° |
| C8 | C9 | H9 | H9A | 120.1° | 120.1° |
| C8 | O10 | C1 | H1 | 20.2° | 55.0° |
| O10 | C8 | H8 | H8A | 120.8° | 120.0° |
| O10 | C8 | C9 | H9 | 41.6° | 55.0° |
| O10 | C8 | C9 | H9A | 161.6° | 175.0° |
| C14 | C11 | C16 | H11 | 180.0° | 179.7° |
| C11 | C14 | C12 | C13 | 0.0° | 0.0° |
| C11 | C14 | C12 | H14 | 180.0° | 180.0° |
| C14 | C11 | C16 | C15 | 0.5° | 0.0° |
| C16 | C11 | C14 | C12 | 0.8° | 0.1° |
| C11 | C16 | C15 | C13 | 0.5° | 0.0° |
| C16 | C11 | C14 | H14 | 179.2° | 180.0° |
| C11 | C16 | C15 | H15 | 179.6° | 179.9° |
| C12 | C13 | C15 | H13 | 180.0° | 180.0° |
| C12 | C13 | C15 | C16 | 1.2° | 0.1° |
| C13 | C12 | C14 | H14 | 180.0° | 180.0° |
| C12 | C13 | C15 | H15 | 178.8° | 179.9° |
| C14 | C12 | C13 | C15 | 1.0° | 0.0° |
| C12 | C14 | C11 | H11 | 179.3° | 179.7° |
| C14 | C12 | C13 | H13 | 179.0° | 180.0° |
| C13 | C15 | C16 | H15 | 180.0° | 179.9° |
| C15 | C16 | C11 | H11 | 179.5° | 179.7° |
| C16 | C15 | C13 | H13 | 178.8° | 180.0° |
| H1 | C1 | C2 | H2 | 179.1° | 177.6° |
| HN1 | N1 | O11 | HO11 | 178.7° | 0.0° |
| H2 | C2 | O4 | HO4 | 59.5° | 60.1° |
| H2 | C2 | C7 | H7 | 173.6° | 177.1° |
| H4 | C4 | C5 | H5 | 74.4° | 65.0° |
| H4 | C4 | O9 | HO9 | 60.0° | 60.0° |
| H4A | C4 | C5 | H5 | 45.6° | 175.0° |
| H4A | C4 | O9 | HO9 | 60.0° | 59.9° |
| H5 | C5 | C6 | H6 | 171.2° | 177.6° |
| HO5 | O5 | C7 | H7 | 60.4° | 60.2° |
| H6 | C6 | O6 | HO6 | 59.5° | 59.8° |
| H6 | C6 | C7 | H7 | 166.5° | 177.1° |
| H8 | C8 | C9 | H9 | 78.4° | 65.1° |
| H8 | C8 | C9 | H9A | 41.6° | 55.0° |
| H8A | C8 | C9 | H9 | 161.6° | 175.0° |
| H8A | C8 | C9 | H9A | 78.4° | 65.0° |
| H11 | C11 | C14 | H14 | 0.8° | 0.3° |
| H13 | C13 | C15 | H15 | 1.2° | 0.1° |
| H17 | C17 | H17A | H17B | 120.0° | 120.0° |
