C58
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | N | sing | 1.47Å | 1.47Å | |
| C | C1 | sing | 1.53Å | 1.57Å | |
| C | C17 | sing | 1.53Å | 1.55Å | |
| C | H | sing | 1.09Å | 1.10Å | |
| N | HN | sing | 1.01Å | 1.00Å | |
| N | HNA | sing | 1.01Å | 1.00Å | |
| S | C4 | sing | 1.76Å | 1.74Å | Aromatic |
| S | C7 | sing | 1.76Å | 1.74Å | Aromatic |
| C1 | N1 | sing | 1.47Å | 1.46Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| N1 | C2 | sing | 1.38Å | 1.34Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| C2 | N2 | doub | 1.32Å | 1.34Å | Aromatic |
| C2 | C5 | sing | 1.42Å | 1.43Å | Aromatic |
| N2 | C3 | sing | 1.33Å | 1.34Å | Aromatic |
| C3 | N3 | doub | 1.32Å | 1.34Å | Aromatic |
| C3 | C12 | sing | 1.48Å | 1.49Å | |
| N3 | C4 | sing | 1.34Å | 1.33Å | Aromatic |
| C4 | C5 | doub | 1.39Å | 1.40Å | Aromatic |
| N4 | C14 | doub | 1.32Å | 1.33Å | Aromatic |
| N4 | C15 | sing | 1.32Å | 1.34Å | Aromatic |
| C5 | C6 | sing | 1.46Å | 1.46Å | Aromatic |
| C6 | C7 | doub | 1.33Å | 1.35Å | Aromatic |
| C6 | C11 | sing | 1.52Å | 1.50Å | |
| C7 | C8 | sing | 1.52Å | 1.50Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C9 | C10 | sing | 1.53Å | 1.51Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | C13 | doub | 1.40Å | 1.39Å | Aromatic |
| C12 | C16 | sing | 1.40Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | C18 | sing | 1.51Å | 1.51Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C22 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | C | C1 | 109.6° | 109.5° |
| N | C | C17 | 112.6° | 109.5° |
| N | C | H | 109.6° | 109.5° |
| C | N | HN | 109.5° | 111.0° |
| C | N | HNA | 109.4° | 111.0° |
| C1 | C | C17 | 108.0° | 109.5° |
| C1 | C | H | 108.4° | 109.5° |
| C | C1 | N1 | 111.5° | 109.5° |
| C | C1 | H1 | 108.9° | 109.5° |
| C | C1 | H1A | 109.0° | 109.5° |
| C17 | C | H | 108.6° | 109.4° |
| C | C17 | C18 | 111.4° | 109.5° |
| C | C17 | H17 | 109.0° | 109.4° |
| C | C17 | H17A | 109.0° | 109.4° |
| HN | N | HNA | 109.5° | 111.1° |
| C4 | S | C7 | 90.6° | 92.5° |
| S | C4 | N3 | 121.0° | 131.2° |
| S | C4 | C5 | 112.2° | 109.6° |
| S | C7 | C6 | 113.7° | 111.4° |
| S | C7 | C8 | 120.3° | 124.3° |
| N1 | C1 | H1 | 109.0° | 109.5° |
| N1 | C1 | H1A | 108.9° | 109.5° |
| C1 | N1 | C2 | 121.3° | 120.0° |
| C1 | N1 | HN1 | 106.5° | 120.0° |
| H1 | C1 | H1A | 109.5° | 109.4° |
| C2 | N1 | HN1 | 106.4° | 120.0° |
| N1 | C2 | N2 | 118.5° | 120.5° |
| N1 | C2 | C5 | 122.0° | 120.5° |
| N2 | C2 | C5 | 119.4° | 119.0° |
| C2 | N2 | C3 | 119.7° | 121.1° |
| C2 | C5 | C4 | 114.3° | 117.8° |
| C2 | C5 | C6 | 134.2° | 129.6° |
| N2 | C3 | N3 | 125.9° | 122.0° |
| N2 | C3 | C12 | 117.0° | 119.0° |
| N3 | C3 | C12 | 117.1° | 118.9° |
| C3 | N3 | C4 | 113.9° | 120.9° |
| C3 | C12 | C13 | 121.2° | 120.9° |
| C3 | C12 | C16 | 121.3° | 120.9° |
| N3 | C4 | C5 | 126.8° | 119.3° |
| C4 | C5 | C6 | 111.4° | 112.7° |
| C14 | N4 | C15 | 116.7° | 122.0° |
| N4 | C14 | C13 | 123.8° | 120.8° |
| N4 | C14 | H14 | 118.1° | 119.6° |
| N4 | C15 | C16 | 123.7° | 120.9° |
| N4 | C15 | H15 | 118.2° | 119.5° |
| C5 | C6 | C7 | 112.0° | 113.9° |
| C5 | C6 | C11 | 126.5° | 122.7° |
| C7 | C6 | C11 | 121.5° | 123.4° |
| C6 | C7 | C8 | 126.0° | 124.3° |
| C6 | C11 | C10 | 110.8° | 108.9° |
| C6 | C11 | H11 | 109.1° | 109.5° |
| C6 | C11 | H11A | 109.2° | 109.6° |
| C7 | C8 | C9 | 110.1° | 108.8° |
| C7 | C8 | H8 | 109.3° | 109.7° |
| C7 | C8 | H8A | 109.3° | 109.6° |
| C9 | C8 | H8 | 109.3° | 109.6° |
| C9 | C8 | H8A | 109.3° | 109.5° |
| C8 | C9 | C10 | 111.2° | 108.9° |
| C8 | C9 | H9 | 109.1° | 109.6° |
| C8 | C9 | H9A | 109.0° | 109.6° |
| H8 | C8 | H8A | 109.5° | 109.7° |
| C10 | C9 | H9 | 109.0° | 109.6° |
| C10 | C9 | H9A | 109.0° | 109.6° |
| C9 | C10 | C11 | 112.4° | 109.1° |
| C9 | C10 | H10 | 108.8° | 109.6° |
| C9 | C10 | H10A | 108.7° | 109.5° |
| H9 | C9 | H9A | 109.5° | 109.6° |
| C11 | C10 | H10 | 108.7° | 109.5° |
| C11 | C10 | H10A | 108.7° | 109.5° |
| C10 | C11 | H11 | 109.1° | 109.6° |
| C10 | C11 | H11A | 109.1° | 109.6° |
| H10 | C10 | H10A | 109.5° | 109.6° |
| H11 | C11 | H11A | 109.5° | 109.7° |
| C13 | C12 | C16 | 117.5° | 118.2° |
| C12 | C13 | C14 | 119.1° | 119.0° |
| C12 | C13 | H13 | 120.4° | 120.5° |
| C12 | C16 | C15 | 119.2° | 119.0° |
| C12 | C16 | H16 | 120.4° | 120.5° |
| C14 | C13 | H13 | 120.4° | 120.4° |
| C13 | C14 | H14 | 118.1° | 119.5° |
| C16 | C15 | H15 | 118.1° | 119.5° |
| C15 | C16 | H16 | 120.4° | 120.5° |
| C18 | C17 | H17 | 109.0° | 109.5° |
| C18 | C17 | H17A | 109.0° | 109.5° |
| C17 | C18 | C19 | 120.8° | 120.0° |
| C17 | C18 | C23 | 120.9° | 120.0° |
| H17 | C17 | H17A | 109.5° | 109.5° |
| C19 | C18 | C23 | 118.3° | 120.0° |
| C18 | C19 | C20 | 120.9° | 120.0° |
| C18 | C19 | H19 | 119.6° | 120.0° |
| C18 | C23 | C22 | 120.8° | 120.0° |
| C18 | C23 | H23 | 119.6° | 120.1° |
| C20 | C19 | H19 | 119.6° | 120.0° |
| C19 | C20 | C21 | 120.1° | 120.0° |
| C19 | C20 | H20 | 119.9° | 120.0° |
| C21 | C20 | H20 | 119.9° | 120.0° |
| C20 | C21 | C22 | 119.7° | 120.0° |
| C20 | C21 | H21 | 120.2° | 120.0° |
| C22 | C21 | H21 | 120.1° | 120.0° |
| C21 | C22 | C23 | 120.2° | 120.0° |
| C21 | C22 | H22 | 119.9° | 120.0° |
| C23 | C22 | H22 | 119.9° | 120.0° |
| C22 | C23 | H23 | 119.6° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | C | C1 | C17 | 123.0° | 120.0° |
| N | C | C1 | H | 119.6° | 120.0° |
| N | C | C17 | H | 121.6° | 120.0° |
| C | N | HN | HNA | 120.0° | 124.0° |
| N | C | C1 | N1 | 51.3° | 55.0° |
| N | C | C1 | H1 | 171.6° | 175.0° |
| N | C | C1 | H1A | 69.0° | 65.0° |
| N | C | C17 | C18 | 176.4° | 65.0° |
| N | C | C17 | H17 | 56.1° | 55.0° |
| N | C | C17 | H17A | 63.4° | 175.0° |
| C1 | C | C17 | H | 117.3° | 120.0° |
| C1 | C | N | HN | 180.0° | 64.0° |
| C1 | C | N | HNA | 60.0° | 60.1° |
| C | C1 | N1 | H1 | 120.3° | 120.0° |
| C | C1 | N1 | H1A | 120.3° | 120.0° |
| C | C1 | H1 | H1A | 119.1° | 120.0° |
| C | C1 | N1 | C2 | 71.8° | 180.0° |
| C | C1 | N1 | HN1 | 166.6° | 0.0° |
| C1 | C | C17 | C18 | 62.5° | 175.0° |
| C1 | C | C17 | H17 | 177.2° | 65.0° |
| C1 | C | C17 | H17A | 57.8° | 54.9° |
| C17 | C | N | HN | 59.8° | 176.0° |
| C17 | C | N | HNA | 179.8° | 59.9° |
| C17 | C | C1 | N1 | 174.3° | 175.0° |
| C17 | C | C1 | H1 | 65.4° | 65.0° |
| C17 | C | C1 | H1A | 54.0° | 55.0° |
| C | C17 | C18 | H17 | 120.3° | 120.0° |
| C | C17 | C18 | H17A | 120.3° | 120.0° |
| C | C17 | H17 | H17A | 119.1° | 119.9° |
| C | C17 | C18 | C19 | 93.7° | 90.0° |
| C | C17 | C18 | C23 | 86.4° | 90.3° |
| H | C | N | HN | 61.2° | 56.1° |
| H | C | N | HNA | 58.8° | 179.9° |
| H | C | C1 | N1 | 68.3° | 65.0° |
| H | C | C1 | H1 | 52.0° | 55.0° |
| H | C | C1 | H1A | 171.4° | 175.0° |
| H | C | C17 | C18 | 54.8° | 55.0° |
| H | C | C17 | H17 | 65.5° | 175.0° |
| H | C | C17 | H17A | 175.1° | 65.0° |
| S | C4 | C5 | C2 | 179.3° | 179.9° |
| S | C4 | N3 | C3 | 178.8° | 180.0° |
| S | C4 | N3 | C5 | 179.0° | 179.9° |
| S | C4 | C5 | C6 | 1.0° | 0.0° |
| C4 | S | C7 | C6 | 0.0° | 0.1° |
| C4 | S | C7 | C8 | 179.6° | 180.0° |
| C7 | S | C4 | N3 | 178.5° | 179.9° |
| C7 | S | C4 | C5 | 0.6° | 0.1° |
| S | C7 | C6 | C5 | 0.6° | 0.0° |
| S | C7 | C6 | C8 | 179.7° | 179.9° |
| S | C7 | C6 | C11 | 177.5° | 180.0° |
| S | C7 | C8 | C9 | 164.5° | 163.3° |
| S | C7 | C8 | H8 | 75.3° | 76.9° |
| S | C7 | C8 | H8A | 44.5° | 43.5° |
| N1 | C1 | H1 | H1A | 119.1° | 120.0° |
| C1 | N1 | C2 | HN1 | 121.7° | 179.9° |
| C1 | N1 | C2 | N2 | 3.5° | 5.5° |
| C1 | N1 | C2 | C5 | 174.5° | 174.5° |
| H1 | C1 | N1 | C2 | 48.5° | 60.0° |
| H1 | C1 | N1 | HN1 | 73.1° | 120.1° |
| H1A | C1 | N1 | C2 | 167.9° | 59.9° |
| H1A | C1 | N1 | HN1 | 46.3° | 120.0° |
| N1 | C2 | N2 | C5 | 178.0° | 180.0° |
| N1 | C2 | N2 | C3 | 177.8° | 179.9° |
| N1 | C2 | C5 | C4 | 176.1° | 179.9° |
| N1 | C2 | C5 | C6 | 4.2° | 0.1° |
| HN1 | N1 | C2 | N2 | 118.1° | 174.4° |
| HN1 | N1 | C2 | C5 | 63.9° | 5.6° |
| C2 | N2 | C3 | N3 | 2.0° | 0.0° |
| C2 | N2 | C3 | C12 | 174.6° | 180.0° |
| N2 | C2 | C5 | C4 | 1.8° | 0.1° |
| N2 | C2 | C5 | C6 | 177.8° | 179.9° |
| C5 | C2 | N2 | C3 | 0.2° | 0.1° |
| C2 | C5 | C4 | N3 | 1.7° | 0.1° |
| C2 | C5 | C4 | C6 | 179.7° | 180.0° |
| C2 | C5 | C6 | C7 | 179.3° | 180.0° |
| C2 | C5 | C6 | C11 | 2.6° | 0.1° |
| N2 | C3 | N3 | C12 | 176.6° | 180.0° |
| N2 | C3 | N3 | C4 | 2.1° | 0.0° |
| N2 | C3 | C12 | C13 | 0.2° | 180.0° |
| N2 | C3 | C12 | C16 | 177.5° | 0.0° |
| C3 | N3 | C4 | C5 | 0.1° | 0.1° |
| N3 | C3 | C12 | C13 | 177.1° | 0.0° |
| N3 | C3 | C12 | C16 | 0.5° | 180.0° |
| C12 | C3 | N3 | C4 | 174.5° | 180.0° |
| C3 | C12 | C13 | C16 | 177.8° | 180.0° |
| C3 | C12 | C13 | C14 | 177.4° | 180.0° |
| C3 | C12 | C13 | H13 | 2.6° | 0.0° |
| C3 | C12 | C16 | C15 | 177.3° | 180.0° |
| C3 | C12 | C16 | H16 | 2.8° | 0.0° |
| N3 | C4 | C5 | C6 | 178.0° | 179.9° |
| C4 | C5 | C6 | C7 | 1.0° | 0.0° |
| C4 | C5 | C6 | C11 | 177.0° | 179.9° |
| N4 | C14 | C13 | C12 | 0.1° | 0.0° |
| N4 | C14 | C13 | H14 | 180.0° | 179.9° |
| N4 | C14 | C13 | H13 | 179.9° | 180.0° |
| C14 | N4 | C15 | C16 | 0.1° | 0.1° |
| C14 | N4 | C15 | H15 | 180.0° | 179.9° |
| N4 | C15 | C16 | C12 | 0.3° | 0.0° |
| C15 | N4 | C14 | C13 | 0.2° | 0.1° |
| C15 | N4 | C14 | H14 | 179.9° | 180.0° |
| N4 | C15 | C16 | H15 | 180.0° | 180.0° |
| N4 | C15 | C16 | H16 | 179.7° | 180.0° |
| C5 | C6 | C7 | C11 | 178.2° | 179.9° |
| C5 | C6 | C7 | C8 | 179.0° | 180.0° |
| C5 | C6 | C11 | C10 | 164.3° | 162.9° |
| C5 | C6 | C11 | H11 | 75.5° | 77.3° |
| C5 | C6 | C11 | H11A | 44.1° | 43.0° |
| C6 | C7 | C8 | C9 | 15.8° | 16.8° |
| C6 | C7 | C8 | H8 | 104.3° | 103.0° |
| C6 | C7 | C8 | H8A | 135.9° | 136.6° |
| C7 | C6 | C11 | C10 | 17.8° | 17.2° |
| C7 | C6 | C11 | H11 | 102.4° | 102.6° |
| C7 | C6 | C11 | H11A | 138.0° | 137.1° |
| C11 | C6 | C7 | C8 | 2.8° | 0.1° |
| C6 | C11 | C10 | C9 | 46.8° | 50.7° |
| C6 | C11 | C10 | H11 | 120.2° | 119.7° |
| C6 | C11 | C10 | H11A | 120.2° | 119.8° |
| C6 | C11 | C10 | H10 | 73.7° | 69.2° |
| C6 | C11 | C10 | H10A | 167.2° | 170.6° |
| C6 | C11 | H11 | H11A | 119.4° | 120.3° |
| C7 | C8 | C9 | H8 | 120.1° | 119.9° |
| C7 | C8 | C9 | H8A | 120.1° | 119.7° |
| C7 | C8 | H8 | H8A | 119.7° | 120.4° |
| C7 | C8 | C9 | C10 | 43.7° | 50.2° |
| C7 | C8 | C9 | H9 | 164.0° | 170.0° |
| C7 | C8 | C9 | H9A | 76.5° | 69.7° |
| C9 | C8 | H8 | H8A | 119.7° | 120.3° |
| C8 | C9 | C10 | H9 | 120.3° | 119.9° |
| C8 | C9 | C10 | H9A | 120.3° | 119.8° |
| C8 | C9 | H9 | H9A | 119.2° | 120.3° |
| C8 | C9 | C10 | C11 | 62.1° | 70.4° |
| C8 | C9 | C10 | H10 | 58.3° | 49.5° |
| C8 | C9 | C10 | H10A | 177.5° | 169.7° |
| H8 | C8 | C9 | C10 | 76.4° | 69.7° |
| H8 | C8 | C9 | H9 | 43.9° | 50.1° |
| H8 | C8 | C9 | H9A | 163.4° | 170.4° |
| H8A | C8 | C9 | C10 | 163.8° | 169.9° |
| H8A | C8 | C9 | H9 | 75.9° | 70.3° |
| H8A | C8 | C9 | H9A | 43.5° | 50.1° |
| C10 | C9 | H9 | H9A | 119.2° | 120.3° |
| C9 | C10 | C11 | H10 | 120.5° | 119.9° |
| C9 | C10 | C11 | H10A | 120.4° | 119.9° |
| C9 | C10 | H10 | H10A | 118.7° | 120.2° |
| C9 | C10 | C11 | H11 | 73.4° | 69.0° |
| C9 | C10 | C11 | H11A | 167.0° | 170.6° |
| H9 | C9 | C10 | C11 | 177.6° | 169.7° |
| H9 | C9 | C10 | H10 | 62.0° | 70.4° |
| H9 | C9 | C10 | H10A | 57.2° | 49.9° |
| H9A | C9 | C10 | C11 | 58.2° | 49.4° |
| H9A | C9 | C10 | H10 | 178.6° | 169.3° |
| H9A | C9 | C10 | H10A | 62.3° | 70.4° |
| C11 | C10 | H10 | H10A | 118.7° | 120.1° |
| C10 | C11 | H11 | H11A | 119.4° | 120.4° |
| H10 | C10 | C11 | H11 | 166.2° | 171.1° |
| H10 | C10 | C11 | H11A | 46.6° | 50.6° |
| H10A | C10 | C11 | H11 | 47.0° | 50.9° |
| H10A | C10 | C11 | H11A | 72.6° | 69.6° |
| C12 | C13 | C14 | H13 | 180.0° | 179.9° |
| C12 | C13 | C14 | H14 | 179.9° | 180.0° |
| C13 | C12 | C16 | C15 | 0.5° | 0.0° |
| C13 | C12 | C16 | H16 | 179.5° | 180.0° |
| C16 | C12 | C13 | C14 | 0.4° | 0.0° |
| C16 | C12 | C13 | H13 | 179.6° | 180.0° |
| C12 | C16 | C15 | H16 | 180.0° | 180.0° |
| C12 | C16 | C15 | H15 | 179.7° | 180.0° |
| H13 | C13 | C14 | H14 | 0.1° | 0.1° |
| H15 | C15 | C16 | H16 | 0.3° | 0.0° |
| C18 | C17 | H17 | H17A | 119.1° | 120.1° |
| C17 | C18 | C19 | C23 | 179.9° | 179.7° |
| C17 | C18 | C19 | C20 | 180.0° | 180.0° |
| C17 | C18 | C19 | H19 | 0.0° | 0.1° |
| C17 | C18 | C23 | C22 | 180.0° | 179.8° |
| C17 | C18 | C23 | H23 | 0.0° | 0.0° |
| H17 | C17 | C18 | C19 | 26.6° | 29.9° |
| H17 | C17 | C18 | C23 | 153.3° | 149.7° |
| H17A | C17 | C18 | C19 | 146.0° | 150.0° |
| H17A | C17 | C18 | C23 | 33.9° | 29.7° |
| C18 | C19 | C20 | H19 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.1° | 0.1° |
| C18 | C19 | C20 | H20 | 179.9° | 180.0° |
| C19 | C18 | C23 | C22 | 0.1° | 0.5° |
| C19 | C18 | C23 | H23 | 179.9° | 179.7° |
| C23 | C18 | C19 | C20 | 0.1° | 0.3° |
| C23 | C18 | C19 | H19 | 179.9° | 179.7° |
| C18 | C23 | C22 | C21 | 0.0° | 0.5° |
| C18 | C23 | C22 | H23 | 180.0° | 179.7° |
| C18 | C23 | C22 | H22 | 180.0° | 179.7° |
| C19 | C20 | C21 | H20 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 0.0° | 0.0° |
| C19 | C20 | C21 | H21 | 180.0° | 179.9° |
| H19 | C19 | C20 | C21 | 179.9° | 180.0° |
| H19 | C19 | C20 | H20 | 0.1° | 0.1° |
| C20 | C21 | C22 | H21 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.0° | 0.2° |
| C20 | C21 | C22 | H22 | 180.0° | 180.0° |
| H20 | C20 | C21 | C22 | 180.0° | 180.0° |
| H20 | C20 | C21 | H21 | 0.0° | 0.1° |
| C21 | C22 | C23 | H22 | 180.0° | 179.8° |
| C21 | C22 | C23 | H23 | 180.0° | 179.8° |
| H21 | C21 | C22 | C23 | 180.0° | 179.9° |
| H21 | C21 | C22 | H22 | 0.0° | 0.1° |
| H22 | C22 | C23 | H23 | 0.0° | 0.0° |
