2RY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | N2 | sing | 1.31Å | 1.34Å | Aromatic |
| C2 | N1 | doub | 1.32Å | 1.34Å | Aromatic |
| N2 | C4 | doub | 1.34Å | 1.36Å | Aromatic |
| N1 | C1 | sing | 1.33Å | 1.36Å | Aromatic |
| C4 | S1 | sing | 1.75Å | 1.70Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.41Å | Aromatic |
| C1 | C3 | doub | 1.42Å | 1.39Å | Aromatic |
| C1 | N3 | sing | 1.38Å | 1.41Å | |
| S1 | C11 | sing | 1.76Å | 1.73Å | Aromatic |
| C7 | N3 | sing | 1.47Å | 1.47Å | |
| C7 | C15 | sing | 1.53Å | 1.53Å | |
| C3 | C10 | sing | 1.47Å | 1.40Å | Aromatic |
| F1 | C22 | sing | 1.40Å | 1.32Å | |
| N3 | C5 | sing | 1.46Å | 1.47Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| F2 | C22 | sing | 1.40Å | 1.32Å | |
| C15 | N4 | sing | 1.47Å | 1.47Å | |
| C11 | C10 | doub | 1.33Å | 1.44Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.49Å | |
| C22 | F3 | sing | 1.40Å | 1.32Å | |
| C22 | C21 | sing | 1.51Å | 1.51Å | |
| C10 | C14 | sing | 1.53Å | 1.50Å | |
| N4 | C6 | sing | 1.47Å | 1.47Å | |
| N4 | C8 | sing | 1.35Å | 1.35Å | |
| O1 | C8 | doub | 1.21Å | 1.22Å | |
| C8 | C9 | sing | 1.51Å | 1.52Å | |
| C12 | C13 | sing | 1.54Å | 1.55Å | |
| C21 | C20 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.55Å | 1.55Å | |
| C9 | C16 | sing | 1.51Å | 1.52Å | |
| C20 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | H1 | sing | 1.08Å | 1.08Å | |
| C19 | H2 | sing | 1.08Å | 1.08Å | |
| C18 | H3 | sing | 1.08Å | 1.08Å | |
| C17 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| C6 | H12 | sing | 1.09Å | 1.10Å | |
| C5 | H13 | sing | 1.09Å | 1.10Å | |
| C5 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.08Å | 1.08Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C2 | N1 | 121.2° | 122.3° |
| C2 | N2 | C4 | 120.3° | 120.8° |
| N2 | C2 | H15 | 119.4° | 118.8° |
| C2 | N1 | C1 | 121.5° | 121.1° |
| N1 | C2 | H15 | 119.4° | 118.8° |
| N2 | C4 | S1 | 120.9° | 131.2° |
| N2 | C4 | C3 | 119.6° | 119.2° |
| N1 | C1 | C3 | 118.6° | 118.8° |
| N1 | C1 | N3 | 121.5° | 120.6° |
| S1 | C4 | C3 | 119.4° | 109.6° |
| C4 | S1 | C11 | 86.9° | 92.5° |
| C4 | C3 | C1 | 118.8° | 117.8° |
| C4 | C3 | C10 | 107.6° | 112.7° |
| C3 | C1 | N3 | 119.9° | 120.6° |
| C1 | C3 | C10 | 133.6° | 129.4° |
| C1 | N3 | C7 | 113.0° | 111.0° |
| C1 | N3 | C5 | 112.5° | 111.1° |
| S1 | C11 | C10 | 114.3° | 111.3° |
| S1 | C11 | C12 | 129.5° | 138.1° |
| N3 | C7 | C15 | 109.3° | 109.4° |
| C7 | N3 | C5 | 105.6° | 111.4° |
| N3 | C7 | H9 | 109.5° | 109.5° |
| N3 | C7 | H10 | 109.5° | 109.5° |
| C7 | C15 | N4 | 112.2° | 108.5° |
| C7 | C15 | H7 | 108.8° | 109.6° |
| C7 | C15 | H8 | 108.8° | 109.8° |
| C15 | C7 | H9 | 109.5° | 109.5° |
| C15 | C7 | H10 | 109.5° | 109.5° |
| C3 | C10 | C11 | 111.7° | 113.9° |
| C3 | C10 | C14 | 139.3° | 136.0° |
| F1 | C22 | F2 | 108.7° | 109.5° |
| F1 | C22 | F3 | 109.5° | 109.5° |
| F1 | C22 | C21 | 109.7° | 109.5° |
| N3 | C5 | C6 | 107.1° | 109.7° |
| N3 | C5 | H13 | 110.1° | 109.1° |
| N3 | C5 | H14 | 110.1° | 109.7° |
| C5 | C6 | N4 | 109.7° | 108.5° |
| C5 | C6 | H11 | 109.4° | 109.6° |
| C5 | C6 | H12 | 109.4° | 109.7° |
| C6 | C5 | H13 | 110.0° | 109.5° |
| C6 | C5 | H14 | 110.1° | 109.5° |
| F2 | C22 | F3 | 108.3° | 109.4° |
| F2 | C22 | C21 | 111.0° | 109.5° |
| C15 | N4 | C6 | 118.1° | 118.2° |
| C15 | N4 | C8 | 119.4° | 120.9° |
| N4 | C15 | H7 | 108.8° | 109.6° |
| N4 | C15 | H8 | 108.8° | 109.6° |
| C10 | C11 | C12 | 116.2° | 110.6° |
| C11 | C10 | C14 | 109.0° | 110.2° |
| C11 | C12 | C13 | 99.2° | 104.8° |
| C11 | C12 | H16 | 112.0° | 110.4° |
| C11 | C12 | H19 | 112.0° | 110.4° |
| F3 | C22 | C21 | 109.7° | 109.4° |
| C22 | C21 | C20 | 119.0° | 120.0° |
| C22 | C21 | C16 | 121.9° | 120.0° |
| C10 | C14 | C13 | 102.7° | 104.6° |
| C10 | C14 | H18 | 111.2° | 110.3° |
| C10 | C14 | H21 | 111.1° | 110.4° |
| C6 | N4 | C8 | 122.4° | 120.9° |
| N4 | C6 | H11 | 109.4° | 109.7° |
| N4 | C6 | H12 | 109.4° | 109.7° |
| N4 | C8 | O1 | 121.8° | 120.0° |
| N4 | C8 | C9 | 119.3° | 120.0° |
| O1 | C8 | C9 | 118.9° | 120.0° |
| C8 | C9 | C16 | 111.1° | 109.5° |
| C8 | C9 | H5 | 109.1° | 109.5° |
| C8 | C9 | H6 | 109.1° | 109.5° |
| C12 | C13 | C14 | 112.9° | 101.0° |
| C13 | C12 | H16 | 112.0° | 110.3° |
| C12 | C13 | H17 | 108.6° | 111.1° |
| C13 | C12 | H19 | 112.0° | 110.4° |
| C12 | C13 | H20 | 108.6° | 111.0° |
| C20 | C21 | C16 | 119.1° | 120.0° |
| C21 | C20 | C19 | 120.8° | 120.0° |
| C21 | C20 | H1 | 119.6° | 120.0° |
| C21 | C16 | C9 | 123.5° | 120.0° |
| C21 | C16 | C17 | 119.6° | 120.0° |
| C14 | C13 | H17 | 108.6° | 110.2° |
| C13 | C14 | H18 | 111.1° | 109.2° |
| C14 | C13 | H20 | 108.6° | 112.3° |
| C13 | C14 | H21 | 111.2° | 111.8° |
| C9 | C16 | C17 | 116.9° | 120.0° |
| C16 | C9 | H5 | 109.0° | 109.5° |
| C16 | C9 | H6 | 109.1° | 109.4° |
| C20 | C19 | C18 | 120.0° | 120.0° |
| C19 | C20 | H1 | 119.6° | 120.0° |
| C20 | C19 | H2 | 120.0° | 120.0° |
| C16 | C17 | C18 | 120.9° | 120.0° |
| C16 | C17 | H4 | 119.6° | 120.0° |
| C19 | C18 | C17 | 119.6° | 120.0° |
| C18 | C19 | H2 | 120.0° | 120.0° |
| C19 | C18 | H3 | 120.2° | 120.0° |
| C17 | C18 | H3 | 120.2° | 120.0° |
| C18 | C17 | H4 | 119.6° | 120.0° |
| H5 | C9 | H6 | 109.5° | 109.4° |
| H7 | C15 | H8 | 109.4° | 109.6° |
| H9 | C7 | H10 | 109.4° | 109.5° |
| H11 | C6 | H12 | 109.5° | 109.6° |
| H13 | C5 | H14 | 109.5° | 109.4° |
| H16 | C12 | H19 | 109.5° | 110.4° |
| H17 | C13 | H20 | 109.5° | 110.9° |
| H18 | C14 | H21 | 109.4° | 110.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C2 | N1 | H15 | 180.0° | 179.8° |
| N2 | C2 | N1 | C1 | 0.2° | 0.0° |
| C2 | N2 | C4 | S1 | 179.9° | 180.0° |
| C2 | N2 | C4 | C3 | 0.1° | 0.5° |
| N1 | C2 | N2 | C4 | 0.1° | 0.3° |
| C2 | N1 | C1 | C3 | 0.5° | 0.0° |
| C2 | N1 | C1 | N3 | 179.5° | 179.7° |
| N2 | C4 | S1 | C3 | 180.0° | 179.5° |
| N2 | C4 | C3 | C1 | 0.3° | 0.5° |
| N2 | C4 | S1 | C11 | 180.0° | 179.9° |
| N2 | C4 | C3 | C10 | 179.9° | 179.5° |
| C4 | N2 | C2 | H15 | 179.9° | 179.9° |
| N1 | C1 | C3 | C4 | 0.5° | 0.2° |
| N1 | C1 | C3 | N3 | 179.0° | 179.7° |
| N1 | C1 | N3 | C7 | 14.5° | 62.4° |
| N1 | C1 | C3 | C10 | 180.0° | 179.8° |
| N1 | C1 | N3 | C5 | 105.0° | 62.1° |
| C1 | N1 | C2 | H15 | 179.8° | 179.8° |
| S1 | C4 | C3 | C1 | 179.7° | 179.9° |
| S1 | C4 | C3 | C10 | 0.1° | 0.1° |
| C4 | S1 | C11 | C10 | 0.1° | 1.1° |
| C4 | S1 | C11 | C12 | 180.0° | 180.0° |
| C4 | C3 | C1 | C10 | 179.5° | 180.0° |
| C4 | C3 | C1 | N3 | 179.5° | 179.9° |
| C3 | C4 | S1 | C11 | 0.0° | 0.5° |
| C4 | C3 | C10 | C11 | 0.2° | 1.0° |
| C4 | C3 | C10 | C14 | 179.7° | 180.0° |
| C3 | C1 | N3 | C7 | 164.4° | 117.3° |
| C3 | C1 | N3 | C5 | 76.1° | 118.2° |
| C1 | C3 | C10 | C11 | 179.7° | 179.1° |
| C1 | C3 | C10 | C14 | 0.7° | 0.0° |
| C1 | N3 | C7 | C5 | 123.4° | 124.3° |
| C1 | N3 | C7 | C15 | 168.5° | 172.8° |
| N3 | C1 | C3 | C10 | 1.0° | 0.1° |
| C1 | N3 | C5 | C6 | 162.7° | 172.9° |
| C1 | N3 | C7 | H9 | 71.5° | 52.8° |
| C1 | N3 | C7 | H10 | 48.5° | 67.3° |
| C1 | N3 | C5 | H13 | 43.1° | 67.2° |
| C1 | N3 | C5 | H14 | 77.6° | 52.7° |
| S1 | C11 | C10 | C3 | 0.2° | 1.3° |
| S1 | C11 | C10 | C12 | 179.9° | 179.2° |
| S1 | C11 | C10 | C14 | 179.9° | 179.4° |
| S1 | C11 | C12 | C13 | 179.8° | 162.5° |
| S1 | C11 | C12 | H16 | 61.9° | 78.7° |
| S1 | C11 | C12 | H19 | 61.4° | 43.6° |
| N3 | C7 | C15 | H9 | 120.0° | 120.0° |
| N3 | C7 | C15 | H10 | 120.0° | 119.9° |
| C7 | N3 | C5 | C6 | 73.5° | 62.8° |
| N3 | C7 | C15 | N4 | 49.0° | 53.8° |
| N3 | C7 | C15 | H7 | 169.4° | 65.9° |
| N3 | C7 | C15 | H8 | 71.5° | 173.6° |
| N3 | C7 | H9 | H10 | 120.1° | 120.1° |
| C7 | N3 | C5 | H13 | 166.8° | 57.1° |
| C7 | N3 | C5 | H14 | 46.1° | 176.9° |
| C15 | C7 | N3 | C5 | 68.1° | 62.9° |
| C7 | C15 | N4 | H7 | 120.4° | 119.6° |
| C7 | C15 | N4 | H8 | 120.4° | 120.0° |
| C7 | C15 | N4 | C6 | 37.2° | 51.1° |
| C7 | C15 | N4 | C8 | 144.8° | 128.5° |
| C7 | C15 | H7 | H8 | 118.8° | 120.6° |
| C15 | C7 | H9 | H10 | 120.1° | 120.0° |
| C3 | C10 | C11 | C14 | 179.7° | 179.3° |
| C3 | C10 | C11 | C12 | 179.9° | 179.4° |
| C3 | C10 | C14 | C13 | 180.0° | 160.9° |
| C3 | C10 | C14 | H18 | 61.1° | 43.5° |
| C3 | C10 | C14 | H21 | 61.1° | 78.8° |
| F1 | C22 | F2 | F3 | 118.8° | 120.0° |
| F1 | C22 | F2 | C21 | 120.7° | 120.0° |
| F1 | C22 | F3 | C21 | 120.4° | 120.0° |
| F1 | C22 | C21 | C20 | 124.3° | 0.0° |
| F1 | C22 | C21 | C16 | 55.8° | 179.8° |
| N3 | C5 | C6 | H13 | 119.6° | 119.7° |
| N3 | C5 | C6 | H14 | 119.6° | 120.3° |
| N3 | C5 | C6 | N4 | 59.1° | 53.5° |
| C5 | N3 | C7 | H9 | 51.9° | 177.1° |
| C5 | N3 | C7 | H10 | 171.9° | 57.0° |
| N3 | C5 | C6 | H11 | 60.9° | 173.3° |
| N3 | C5 | C6 | H12 | 179.1° | 66.3° |
| N3 | C5 | H13 | H14 | 121.1° | 120.0° |
| C5 | C6 | N4 | C15 | 42.1° | 50.9° |
| C5 | C6 | N4 | H11 | 120.0° | 119.7° |
| C5 | C6 | N4 | H12 | 120.0° | 119.9° |
| C5 | C6 | N4 | C8 | 140.0° | 128.8° |
| C5 | C6 | H11 | H12 | 119.9° | 120.5° |
| C6 | C5 | H13 | H14 | 121.1° | 120.0° |
| F2 | C22 | F3 | C21 | 121.2° | 119.9° |
| F2 | C22 | C21 | C20 | 4.2° | 120.1° |
| F2 | C22 | C21 | C16 | 175.9° | 59.7° |
| C15 | N4 | C6 | C8 | 177.9° | 179.7° |
| C15 | N4 | C8 | O1 | 1.3° | 179.7° |
| C15 | N4 | C8 | C9 | 178.8° | 0.4° |
| N4 | C15 | H7 | H8 | 118.7° | 120.4° |
| N4 | C15 | C7 | H9 | 71.0° | 173.8° |
| N4 | C15 | C7 | H10 | 168.9° | 66.2° |
| C15 | N4 | C6 | H11 | 78.0° | 170.6° |
| C15 | N4 | C6 | H12 | 162.1° | 69.0° |
| C10 | C11 | C12 | C13 | 0.1° | 18.6° |
| C11 | C10 | C14 | C13 | 0.4° | 18.2° |
| C10 | C11 | C12 | H16 | 118.2° | 100.2° |
| C11 | C10 | C14 | H18 | 119.4° | 135.6° |
| C10 | C11 | C12 | H19 | 118.5° | 137.4° |
| C11 | C10 | C14 | H21 | 118.5° | 102.2° |
| C12 | C11 | C10 | C14 | 0.2° | 0.1° |
| C11 | C12 | C13 | H16 | 118.3° | 118.8° |
| C11 | C12 | C13 | H19 | 118.3° | 118.9° |
| C11 | C12 | C13 | C14 | 0.4° | 27.7° |
| C11 | C12 | H16 | H19 | 124.8° | 122.4° |
| C11 | C12 | C13 | H17 | 120.9° | 144.6° |
| C11 | C12 | C13 | H20 | 120.1° | 91.6° |
| F3 | C22 | C21 | C20 | 115.4° | 120.0° |
| F3 | C22 | C21 | C16 | 64.5° | 60.2° |
| C22 | C21 | C20 | C16 | 179.9° | 179.8° |
| C22 | C21 | C16 | C9 | 0.1° | 0.0° |
| C22 | C21 | C20 | C19 | 179.9° | 180.0° |
| C22 | C21 | C16 | C17 | 179.8° | 179.8° |
| C22 | C21 | C20 | H1 | 0.1° | 0.0° |
| C10 | C14 | C13 | C12 | 0.5° | 27.7° |
| C10 | C14 | C13 | H18 | 118.9° | 118.1° |
| C10 | C14 | C13 | H21 | 118.9° | 119.4° |
| C10 | C14 | C13 | H17 | 121.1° | 145.2° |
| C10 | C14 | H18 | H21 | 123.1° | 122.3° |
| C10 | C14 | C13 | H20 | 120.0° | 90.7° |
| C6 | N4 | C8 | O1 | 179.2° | 0.0° |
| C6 | N4 | C8 | C9 | 0.9° | 180.0° |
| C6 | N4 | C15 | H7 | 157.6° | 68.5° |
| C6 | N4 | C15 | H8 | 83.2° | 171.1° |
| N4 | C6 | H11 | H12 | 119.9° | 120.4° |
| N4 | C6 | C5 | H13 | 178.8° | 66.2° |
| N4 | C6 | C5 | H14 | 60.5° | 173.9° |
| N4 | C8 | O1 | C9 | 179.8° | 179.9° |
| N4 | C8 | C9 | C16 | 180.0° | 180.0° |
| N4 | C8 | C9 | H5 | 59.7° | 60.0° |
| N4 | C8 | C9 | H6 | 59.8° | 60.1° |
| C8 | N4 | C15 | H7 | 24.4° | 111.8° |
| C8 | N4 | C15 | H8 | 94.7° | 8.6° |
| C8 | N4 | C6 | H11 | 100.0° | 9.1° |
| C8 | N4 | C6 | H12 | 20.0° | 111.3° |
| O1 | C8 | C9 | C16 | 0.2° | 0.0° |
| O1 | C8 | C9 | H5 | 120.4° | 120.0° |
| O1 | C8 | C9 | H6 | 120.1° | 120.0° |
| C8 | C9 | C16 | C21 | 104.4° | 85.0° |
| C8 | C9 | C16 | H5 | 120.2° | 120.0° |
| C8 | C9 | C16 | H6 | 120.2° | 120.0° |
| C8 | C9 | C16 | C17 | 75.6° | 94.8° |
| C8 | C9 | H5 | H6 | 119.2° | 120.1° |
| C12 | C13 | C14 | H17 | 120.5° | 117.5° |
| C12 | C13 | C14 | H20 | 120.5° | 118.3° |
| C13 | C12 | H16 | H19 | 124.8° | 122.3° |
| C12 | C13 | H17 | H20 | 118.5° | 123.9° |
| C12 | C13 | C14 | H18 | 119.5° | 145.8° |
| C12 | C13 | C14 | H21 | 118.4° | 91.8° |
| C20 | C21 | C16 | C9 | 180.0° | 179.7° |
| C21 | C20 | C19 | H1 | 180.0° | 180.0° |
| C20 | C21 | C16 | C17 | 0.1° | 0.5° |
| C21 | C20 | C19 | C18 | 0.0° | 0.1° |
| C21 | C20 | C19 | H2 | 180.0° | 180.0° |
| C21 | C16 | C9 | C17 | 180.0° | 179.8° |
| C16 | C21 | C20 | C19 | 0.0° | 0.3° |
| C21 | C16 | C17 | C18 | 0.1° | 0.5° |
| C16 | C21 | C20 | H1 | 180.0° | 179.8° |
| C21 | C16 | C17 | H4 | 179.9° | 179.8° |
| C21 | C16 | C9 | H5 | 135.3° | 154.9° |
| C21 | C16 | C9 | H6 | 15.8° | 35.0° |
| C14 | C13 | C12 | H16 | 117.9° | 91.1° |
| C14 | C13 | H17 | H20 | 118.4° | 125.0° |
| C13 | C14 | H18 | H21 | 123.1° | 123.3° |
| C14 | C13 | C12 | H19 | 118.7° | 146.6° |
| C9 | C16 | C17 | C18 | 179.9° | 179.7° |
| C9 | C16 | C17 | H4 | 0.1° | 0.0° |
| C16 | C9 | H5 | H6 | 119.2° | 119.9° |
| C20 | C19 | C18 | H2 | 180.0° | 179.9° |
| C20 | C19 | C18 | C17 | 0.0° | 0.1° |
| C20 | C19 | C18 | H3 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 0.1° | 0.3° |
| C16 | C17 | C18 | H4 | 180.0° | 179.8° |
| C16 | C17 | C18 | H3 | 179.9° | 179.8° |
| C17 | C16 | C9 | H5 | 44.6° | 25.2° |
| C17 | C16 | C9 | H6 | 164.1° | 145.2° |
| C19 | C18 | C17 | H3 | 180.0° | 179.9° |
| C18 | C19 | C20 | H1 | 180.0° | 180.0° |
| C19 | C18 | C17 | H4 | 179.9° | 180.0° |
| C17 | C18 | C19 | H2 | 180.0° | 180.0° |
| H1 | C20 | C19 | H2 | 0.0° | 0.0° |
| H2 | C19 | C18 | H3 | 0.1° | 0.1° |
| H3 | C18 | C17 | H4 | 0.1° | 0.1° |
| H7 | C15 | C7 | H9 | 49.4° | 54.2° |
| H7 | C15 | C7 | H10 | 70.6° | 174.2° |
| H8 | C15 | C7 | H9 | 168.6° | 66.3° |
| H8 | C15 | C7 | H10 | 48.5° | 53.7° |
| H11 | C6 | C5 | H13 | 58.7° | 53.6° |
| H11 | C6 | C5 | H14 | 179.4° | 66.4° |
| H12 | C6 | C5 | H13 | 61.2° | 174.0° |
| H12 | C6 | C5 | H14 | 59.5° | 54.1° |
| H16 | C12 | C13 | H17 | 2.6° | 25.8° |
| H16 | C12 | C13 | H20 | 121.6° | 149.6° |
| H17 | C13 | C14 | H18 | 120.0° | 96.7° |
| H17 | C13 | C12 | H19 | 120.8° | 96.5° |
| H17 | C13 | C14 | H21 | 2.1° | 25.8° |
| H18 | C14 | C13 | H20 | 1.0° | 27.5° |
| H19 | C12 | C13 | H20 | 1.8° | 27.3° |
| H20 | C13 | C14 | H21 | 121.1° | 149.9° |
