A1AK6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.53Å | 1.51Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C1 | C3 | sing | 1.53Å | 1.55Å | |
| N | C3 | sing | 1.46Å | 1.45Å | |
| C4 | N | sing | 1.38Å | 1.36Å | |
| C4 | N1 | doub | 1.33Å | 1.36Å | Aromatic |
| N1 | C5 | sing | 1.32Å | 1.34Å | Aromatic |
| C5 | N2 | doub | 1.32Å | 1.33Å | Aromatic |
| N2 | C6 | sing | 1.33Å | 1.35Å | Aromatic |
| C6 | N3 | sing | 1.37Å | 1.37Å | Aromatic |
| N3 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C7 | sing | 1.48Å | 1.46Å | |
| C8 | C9 | sing | 1.41Å | 1.41Å | Aromatic |
| C9 | N4 | doub | 1.31Å | 1.33Å | Aromatic |
| N4 | N5 | sing | 1.40Å | 1.36Å | Aromatic |
| C10 | N5 | sing | 1.47Å | 1.46Å | |
| N5 | C11 | sing | 1.37Å | 1.36Å | Aromatic |
| C11 | C8 | doub | 1.40Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.43Å | 1.41Å | |
| N6 | C12 | trip | 1.14Å | 1.14Å | |
| C7 | C13 | doub | 1.36Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.46Å | 1.43Å | Aromatic |
| C14 | C4 | sing | 1.41Å | 1.41Å | Aromatic |
| C6 | C14 | doub | 1.41Å | 1.39Å | Aromatic |
| C3 | C15 | sing | 1.51Å | 1.52Å | |
| C15 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | S | sing | 1.77Å | 1.77Å | |
| O | S | doub | 1.42Å | 1.43Å | |
| S | O1 | doub | 1.42Å | 1.45Å | |
| C21 | S | sing | 1.82Å | 1.75Å | |
| C22 | C21 | sing | 1.54Å | 1.53Å | |
| C23 | C22 | sing | 1.52Å | 1.52Å | |
| C18 | C23 | sing | 1.50Å | 1.52Å | |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| C5 | H10 | sing | 1.08Å | 1.08Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C20 | H18 | sing | 1.08Å | 1.08Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C3 | H | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| N | H9 | sing | 0.97Å | 1.00Å | |
| C9 | H11 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | C2 | 109.9° | 109.5° |
| C | C1 | C3 | 112.3° | 109.5° |
| C | C1 | H5 | 108.1° | 109.5° |
| C1 | C | H2 | 109.5° | 109.4° |
| C1 | C | H3 | 109.5° | 109.4° |
| C1 | C | H4 | 109.4° | 109.5° |
| C2 | C1 | C3 | 111.0° | 109.5° |
| C2 | C1 | H5 | 107.8° | 109.4° |
| C1 | C2 | H6 | 109.5° | 109.4° |
| C1 | C2 | H8 | 109.4° | 109.5° |
| C1 | C2 | H7 | 109.5° | 109.4° |
| C1 | C3 | N | 110.8° | 109.5° |
| C1 | C3 | C15 | 113.2° | 109.5° |
| C1 | C3 | H | 106.8° | 109.5° |
| C3 | C1 | H5 | 107.6° | 109.5° |
| C3 | N | C4 | 125.3° | 120.0° |
| N | C3 | C15 | 110.7° | 109.5° |
| N | C3 | H | 108.0° | 109.5° |
| C3 | N | H9 | 105.4° | 120.0° |
| N | C4 | N1 | 119.3° | 120.8° |
| N | C4 | C14 | 121.7° | 120.8° |
| C4 | N | H9 | 105.4° | 120.0° |
| C4 | N1 | C5 | 118.6° | 121.0° |
| N1 | C4 | C14 | 118.9° | 118.3° |
| N1 | C5 | N2 | 127.8° | 122.7° |
| N1 | C5 | H10 | 116.1° | 118.6° |
| C5 | N2 | C6 | 112.4° | 120.8° |
| N2 | C5 | H10 | 116.1° | 118.6° |
| N2 | C6 | N3 | 125.2° | 134.0° |
| N2 | C6 | C14 | 126.3° | 118.5° |
| C6 | N3 | C7 | 108.4° | 109.9° |
| N3 | C6 | C14 | 108.5° | 107.4° |
| C6 | N3 | H1 | 125.8° | 125.1° |
| N3 | C7 | C8 | 120.8° | 125.3° |
| N3 | C7 | C13 | 109.0° | 109.4° |
| C7 | N3 | H1 | 125.8° | 125.0° |
| C7 | C8 | C9 | 129.1° | 126.4° |
| C7 | C8 | C11 | 126.6° | 126.4° |
| C8 | C7 | C13 | 130.1° | 125.3° |
| C8 | C9 | N4 | 111.9° | 108.7° |
| C9 | C8 | C11 | 104.3° | 107.2° |
| C8 | C9 | H11 | 124.0° | 125.7° |
| C9 | N4 | N5 | 105.3° | 109.3° |
| N4 | C9 | H11 | 124.1° | 125.6° |
| N4 | N5 | C10 | 119.5° | 126.0° |
| N4 | N5 | C11 | 111.8° | 108.0° |
| C10 | N5 | C11 | 128.4° | 126.0° |
| N5 | C10 | H13 | 109.5° | 109.5° |
| N5 | C10 | H14 | 109.5° | 109.5° |
| N5 | C10 | H12 | 109.4° | 109.4° |
| N5 | C11 | C8 | 106.6° | 106.8° |
| N5 | C11 | C12 | 123.0° | 126.6° |
| C8 | C11 | C12 | 130.1° | 126.6° |
| C11 | C12 | N6 | 178.2° | 180.0° |
| C7 | C13 | C14 | 106.6° | 106.8° |
| C7 | C13 | H15 | 126.7° | 126.6° |
| C13 | C14 | C4 | 136.6° | 134.9° |
| C13 | C14 | C6 | 107.4° | 106.5° |
| C14 | C13 | H15 | 126.7° | 126.7° |
| C4 | C14 | C6 | 115.8° | 118.6° |
| C3 | C15 | C16 | 121.7° | 120.2° |
| C3 | C15 | C20 | 120.1° | 120.3° |
| C15 | C3 | H | 107.1° | 109.5° |
| C15 | C16 | C17 | 120.7° | 119.9° |
| C16 | C15 | C20 | 118.2° | 119.5° |
| C15 | C16 | H16 | 119.6° | 120.1° |
| C16 | C17 | C18 | 122.4° | 121.0° |
| C16 | C17 | H17 | 118.8° | 119.5° |
| C17 | C16 | H16 | 119.6° | 120.0° |
| C17 | C18 | C19 | 116.0° | 118.8° |
| C17 | C18 | C23 | 120.0° | 116.6° |
| C18 | C17 | H17 | 118.8° | 119.5° |
| C18 | C19 | C20 | 122.3° | 120.3° |
| C18 | C19 | S | 121.2° | 121.9° |
| C19 | C18 | C23 | 124.0° | 124.6° |
| C19 | C20 | C15 | 120.2° | 120.6° |
| C20 | C19 | S | 116.4° | 117.8° |
| C19 | C20 | H18 | 119.9° | 119.7° |
| C15 | C20 | H18 | 119.9° | 119.7° |
| C19 | S | O | 107.1° | 104.4° |
| C19 | S | O1 | 108.6° | 104.4° |
| C19 | S | C21 | 104.8° | 103.7° |
| O | S | O1 | 116.5° | 121.2° |
| O | S | C21 | 108.7° | 110.6° |
| O1 | S | C21 | 110.5° | 110.6° |
| S | C21 | C22 | 110.3° | 107.0° |
| S | C21 | H20 | 109.2° | 109.9° |
| S | C21 | H19 | 109.3° | 110.0° |
| C21 | C22 | C23 | 111.5° | 109.1° |
| C22 | C21 | H20 | 109.3° | 109.9° |
| C22 | C21 | H19 | 109.3° | 110.0° |
| C21 | C22 | H21 | 109.0° | 109.6° |
| C21 | C22 | H22 | 109.0° | 109.5° |
| C22 | C23 | C18 | 113.8° | 113.8° |
| C23 | C22 | H21 | 109.0° | 109.5° |
| C23 | C22 | H22 | 109.0° | 109.6° |
| C22 | C23 | H23 | 108.4° | 108.6° |
| C22 | C23 | H24 | 108.4° | 108.7° |
| C18 | C23 | H23 | 108.4° | 108.6° |
| C18 | C23 | H24 | 108.4° | 108.5° |
| H13 | C10 | H14 | 109.4° | 109.5° |
| H13 | C10 | H12 | 109.5° | 109.5° |
| H14 | C10 | H12 | 109.5° | 109.4° |
| H20 | C21 | H19 | 109.5° | 109.9° |
| H21 | C22 | H22 | 109.5° | 109.5° |
| H23 | C23 | H24 | 109.4° | 108.5° |
| H6 | C2 | H8 | 109.5° | 109.5° |
| H6 | C2 | H7 | 109.5° | 109.5° |
| H8 | C2 | H7 | 109.5° | 109.5° |
| H2 | C | H3 | 109.5° | 109.5° |
| H2 | C | H4 | 109.5° | 109.5° |
| H3 | C | H4 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | C2 | C3 | 124.8° | 120.0° |
| C | C1 | C2 | H5 | 117.6° | 120.0° |
| C | C1 | C3 | H5 | 118.8° | 120.0° |
| C | C1 | C3 | N | 177.9° | 60.0° |
| C | C1 | C3 | C15 | 52.9° | 180.0° |
| C | C1 | C3 | H | 64.7° | 60.0° |
| C | C1 | C2 | H6 | 180.0° | 60.0° |
| C | C1 | C2 | H8 | 60.0° | 60.0° |
| C | C1 | C2 | H7 | 60.0° | 180.0° |
| C1 | C | H2 | H3 | 120.0° | 120.0° |
| C1 | C | H2 | H4 | 120.0° | 120.0° |
| C1 | C | H3 | H4 | 120.0° | 120.0° |
| C2 | C1 | C3 | H5 | 117.7° | 120.0° |
| C2 | C1 | C3 | N | 58.7° | 180.0° |
| C2 | C1 | C3 | C15 | 176.3° | 60.0° |
| C2 | C1 | C3 | H | 58.7° | 60.0° |
| C1 | C2 | H6 | H8 | 120.0° | 120.0° |
| C1 | C2 | H6 | H7 | 120.0° | 120.0° |
| C1 | C2 | H8 | H7 | 120.0° | 120.0° |
| C2 | C1 | C | H2 | 180.0° | 180.0° |
| C2 | C1 | C | H3 | 60.0° | 60.0° |
| C2 | C1 | C | H4 | 60.0° | 60.0° |
| C1 | C3 | N | C15 | 126.4° | 120.0° |
| C1 | C3 | N | H | 116.7° | 120.0° |
| C1 | C3 | N | C4 | 144.2° | 85.0° |
| C1 | C3 | C15 | H | 117.5° | 120.0° |
| C1 | C3 | C15 | C16 | 111.3° | 80.0° |
| C1 | C3 | C15 | C20 | 68.7° | 99.7° |
| C3 | C1 | C2 | H6 | 55.1° | 60.0° |
| C3 | C1 | C2 | H8 | 175.2° | 180.0° |
| C3 | C1 | C2 | H7 | 64.9° | 60.0° |
| C3 | C1 | C | H2 | 56.0° | 60.0° |
| C3 | C1 | C | H3 | 64.1° | 180.0° |
| C3 | C1 | C | H4 | 175.9° | 60.0° |
| C1 | C3 | N | H9 | 93.7° | 95.0° |
| C3 | N | C4 | H9 | 122.1° | 180.0° |
| C3 | N | C4 | N1 | 17.0° | 0.0° |
| C3 | N | C4 | C14 | 167.4° | 180.0° |
| N | C3 | C15 | H | 117.5° | 120.0° |
| N | C3 | C15 | C16 | 123.6° | 40.0° |
| N | C3 | C15 | C20 | 56.4° | 140.3° |
| N | C3 | C1 | H5 | 59.0° | 60.0° |
| N | C4 | N1 | C14 | 175.7° | 180.0° |
| N | C4 | N1 | C5 | 173.0° | 180.0° |
| N | C4 | C14 | C13 | 3.2° | 0.1° |
| N | C4 | C14 | C6 | 171.4° | 180.0° |
| C4 | N | C3 | C15 | 89.4° | 155.0° |
| C4 | N | C3 | H | 27.5° | 35.0° |
| C4 | N1 | C5 | N2 | 0.3° | 0.0° |
| N1 | C4 | C14 | C13 | 178.8° | 180.0° |
| N1 | C4 | C14 | C6 | 4.2° | 0.0° |
| C4 | N1 | C5 | H10 | 179.7° | 180.0° |
| N1 | C4 | N | H9 | 139.2° | 180.0° |
| N1 | C5 | N2 | H10 | 180.0° | 180.0° |
| N1 | C5 | N2 | C6 | 1.4° | 0.0° |
| C5 | N1 | C4 | C14 | 2.6° | 0.0° |
| C5 | N2 | C6 | N3 | 179.4° | 180.0° |
| C5 | N2 | C6 | C14 | 0.5° | 0.0° |
| N2 | C6 | N3 | C14 | 179.0° | 180.0° |
| N2 | C6 | N3 | C7 | 179.5° | 180.0° |
| N2 | C6 | C14 | C13 | 179.4° | 180.0° |
| N2 | C6 | C14 | C4 | 3.2° | 0.0° |
| N2 | C6 | N3 | H1 | 0.4° | 0.0° |
| C6 | N2 | C5 | H10 | 178.6° | 180.0° |
| C6 | N3 | C7 | H1 | 180.0° | 180.0° |
| C6 | N3 | C7 | C8 | 176.5° | 180.0° |
| C6 | N3 | C7 | C13 | 0.7° | 0.0° |
| N3 | C6 | C14 | C13 | 1.6° | 0.0° |
| N3 | C6 | C14 | C4 | 177.8° | 180.0° |
| N3 | C7 | C8 | C13 | 176.7° | 180.0° |
| N3 | C7 | C8 | C9 | 11.4° | 140.0° |
| N3 | C7 | C8 | C11 | 169.0° | 39.7° |
| N3 | C7 | C13 | C14 | 0.3° | 0.0° |
| C7 | N3 | C6 | C14 | 1.5° | 0.0° |
| N3 | C7 | C13 | H15 | 179.8° | 179.9° |
| C7 | C8 | C9 | C11 | 179.6° | 179.7° |
| C7 | C8 | C9 | N4 | 177.4° | 179.8° |
| C7 | C8 | C11 | N5 | 178.1° | 180.0° |
| C7 | C8 | C11 | C12 | 8.2° | 0.0° |
| C8 | C7 | C13 | C14 | 177.2° | 180.0° |
| C8 | C7 | N3 | H1 | 3.4° | 0.0° |
| C8 | C7 | C13 | H15 | 2.8° | 0.1° |
| C7 | C8 | C9 | H11 | 2.6° | 0.0° |
| C8 | C9 | N4 | H11 | 180.0° | 179.9° |
| C8 | C9 | N4 | N5 | 2.0° | 0.4° |
| C9 | C8 | C11 | N5 | 1.6° | 0.3° |
| C9 | C8 | C11 | C12 | 172.2° | 179.7° |
| C9 | C8 | C7 | C13 | 165.2° | 40.0° |
| C9 | N4 | N5 | C10 | 176.5° | 179.7° |
| C9 | N4 | N5 | C11 | 1.0° | 0.2° |
| N4 | C9 | C8 | C11 | 2.3° | 0.5° |
| N4 | N5 | C10 | C11 | 174.7° | 179.9° |
| N4 | N5 | C11 | C8 | 0.4° | 0.0° |
| N4 | N5 | C11 | C12 | 173.9° | 180.0° |
| N4 | N5 | C10 | H13 | 0.0° | 90.0° |
| N4 | N5 | C10 | H14 | 120.0° | 30.1° |
| N4 | N5 | C10 | H12 | 120.0° | 150.0° |
| N5 | N4 | C9 | H11 | 178.0° | 179.7° |
| C10 | N5 | C11 | C8 | 174.6° | 180.0° |
| C10 | N5 | C11 | C12 | 11.1° | 0.0° |
| N5 | C10 | H13 | H14 | 120.0° | 120.0° |
| N5 | C10 | H13 | H12 | 120.0° | 120.0° |
| N5 | C10 | H14 | H12 | 120.0° | 119.9° |
| N5 | C11 | C8 | C12 | 173.7° | 180.0° |
| N5 | C11 | C12 | N6 | 155.8° | 93.4° |
| C11 | N5 | C10 | H13 | 174.7° | 90.0° |
| C11 | N5 | C10 | H14 | 65.3° | 150.0° |
| C11 | N5 | C10 | H12 | 54.7° | 30.1° |
| C8 | C11 | C12 | N6 | 31.3° | 86.6° |
| C11 | C8 | C7 | C13 | 14.3° | 140.3° |
| C11 | C8 | C9 | H11 | 177.7° | 179.7° |
| C7 | C13 | C14 | H15 | 180.0° | 179.9° |
| C7 | C13 | C14 | C4 | 176.1° | 180.0° |
| C7 | C13 | C14 | C6 | 1.1° | 0.0° |
| C13 | C7 | N3 | H1 | 179.3° | 180.0° |
| C13 | C14 | C4 | C6 | 174.7° | 180.0° |
| C4 | C14 | C13 | H15 | 3.9° | 0.1° |
| C14 | C4 | N | H9 | 45.3° | 0.0° |
| C14 | C6 | N3 | H1 | 178.6° | 180.0° |
| C6 | C14 | C13 | H15 | 178.9° | 180.0° |
| C3 | C15 | C16 | C20 | 180.0° | 179.7° |
| C3 | C15 | C16 | C17 | 178.7° | 179.3° |
| C3 | C15 | C20 | C19 | 178.2° | 179.7° |
| C3 | C15 | C20 | H18 | 1.7° | 0.3° |
| C3 | C15 | C16 | H16 | 1.3° | 0.7° |
| C15 | C3 | C1 | H5 | 65.9° | 60.0° |
| C15 | C3 | N | H9 | 32.7° | 25.0° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 1.7° | 0.0° |
| C16 | C15 | C20 | C19 | 1.8° | 0.0° |
| C15 | C16 | C17 | H17 | 178.3° | 180.0° |
| C16 | C15 | C20 | H18 | 178.2° | 180.0° |
| C16 | C15 | C3 | H | 6.2° | 160.0° |
| C16 | C17 | C18 | H17 | 180.0° | 179.9° |
| C16 | C17 | C18 | C19 | 2.5° | 0.8° |
| C17 | C16 | C15 | C20 | 1.3° | 0.4° |
| C16 | C17 | C18 | C23 | 177.0° | 178.1° |
| C17 | C18 | C19 | C23 | 179.5° | 178.9° |
| C17 | C18 | C19 | C20 | 3.0° | 1.3° |
| C17 | C18 | C19 | S | 174.7° | 178.0° |
| C17 | C18 | C23 | C22 | 155.1° | 155.7° |
| C17 | C18 | C23 | H23 | 84.2° | 34.6° |
| C17 | C18 | C23 | H24 | 34.5° | 83.2° |
| C18 | C17 | C16 | H16 | 178.3° | 180.0° |
| C18 | C19 | C20 | S | 177.8° | 179.3° |
| C18 | C19 | C20 | C15 | 2.8° | 0.9° |
| C18 | C19 | S | O | 101.3° | 128.9° |
| C18 | C19 | S | O1 | 132.2° | 102.9° |
| C18 | C19 | S | C21 | 14.1° | 13.0° |
| C19 | C18 | C23 | C22 | 25.4° | 25.4° |
| C19 | C18 | C17 | H17 | 177.5° | 179.1° |
| C18 | C19 | C20 | H18 | 177.3° | 179.2° |
| C19 | C18 | C23 | H23 | 95.3° | 146.5° |
| C19 | C18 | C23 | H24 | 146.1° | 95.7° |
| C19 | C20 | C15 | H18 | 180.0° | 180.0° |
| C20 | C19 | S | O | 76.6° | 51.9° |
| C20 | C19 | S | O1 | 50.0° | 76.3° |
| C20 | C19 | S | C21 | 168.0° | 167.8° |
| C20 | C19 | C18 | C23 | 176.5° | 177.6° |
| C15 | C20 | C19 | S | 175.1° | 178.4° |
| C20 | C15 | C16 | H16 | 178.7° | 179.6° |
| C20 | C15 | C3 | H | 173.8° | 20.3° |
| C19 | S | O | O1 | 121.7° | 117.1° |
| C19 | S | O | C21 | 112.7° | 111.0° |
| C19 | S | O1 | C21 | 114.4° | 111.0° |
| C19 | S | C21 | C22 | 43.0° | 44.9° |
| S | C19 | C18 | C23 | 5.8° | 3.2° |
| S | C19 | C20 | H18 | 4.9° | 1.6° |
| C19 | S | C21 | H20 | 77.1° | 74.5° |
| C19 | S | C21 | H19 | 163.2° | 164.4° |
| O | S | O1 | C21 | 124.7° | 131.9° |
| O | S | C21 | C22 | 71.2° | 156.3° |
| O | S | C21 | H20 | 168.7° | 37.0° |
| O | S | C21 | H19 | 49.0° | 84.2° |
| O1 | S | C21 | C22 | 159.8° | 66.5° |
| O1 | S | C21 | H20 | 39.7° | 174.2° |
| O1 | S | C21 | H19 | 80.1° | 53.0° |
| S | C21 | C22 | H20 | 120.1° | 119.3° |
| S | C21 | C22 | H19 | 120.1° | 119.5° |
| S | C21 | C22 | C23 | 67.6° | 71.3° |
| S | C21 | H20 | H19 | 119.6° | 121.2° |
| S | C21 | C22 | H21 | 172.1° | 48.6° |
| S | C21 | C22 | H22 | 52.8° | 168.8° |
| C21 | C22 | C23 | H21 | 120.3° | 119.9° |
| C21 | C22 | C23 | H22 | 120.3° | 119.9° |
| C21 | C22 | C23 | C18 | 57.5° | 61.8° |
| C22 | C21 | H20 | H19 | 119.6° | 121.2° |
| C21 | C22 | H21 | H22 | 119.1° | 120.1° |
| C21 | C22 | C23 | H23 | 63.2° | 177.1° |
| C21 | C22 | C23 | H24 | 178.1° | 59.2° |
| C22 | C23 | C18 | H23 | 120.7° | 121.1° |
| C22 | C23 | C18 | H24 | 120.7° | 121.1° |
| C23 | C22 | C21 | H20 | 52.5° | 48.1° |
| C23 | C22 | C21 | H19 | 172.3° | 169.3° |
| C23 | C22 | H21 | H22 | 119.1° | 120.2° |
| C22 | C23 | H23 | H24 | 118.0° | 118.0° |
| C23 | C18 | C17 | H17 | 3.0° | 1.9° |
| C18 | C23 | C22 | H21 | 177.8° | 58.1° |
| C18 | C23 | C22 | H22 | 62.8° | 178.3° |
| C18 | C23 | H23 | H24 | 118.0° | 117.8° |
| H13 | C10 | H14 | H12 | 120.0° | 120.0° |
| H17 | C17 | C16 | H16 | 1.7° | 0.1° |
| H20 | C21 | C22 | H21 | 67.8° | 168.0° |
| H20 | C21 | C22 | H22 | 172.9° | 71.9° |
| H19 | C21 | C22 | H21 | 52.0° | 70.8° |
| H19 | C21 | C22 | H22 | 67.4° | 49.3° |
| H21 | C22 | C23 | H23 | 57.1° | 63.0° |
| H21 | C22 | C23 | H24 | 61.6° | 179.1° |
| H22 | C22 | C23 | H23 | 176.5° | 57.2° |
| H22 | C22 | C23 | H24 | 57.8° | 60.7° |
| H | C3 | C1 | H5 | 176.4° | NaN° |
| H | C3 | N | H9 | 149.6° | 145.0° |
| H5 | C1 | C2 | H6 | 62.4° | 180.0° |
| H5 | C1 | C2 | H8 | 57.6° | 60.0° |
| H5 | C1 | C2 | H7 | 177.6° | 60.0° |
| H5 | C1 | C | H2 | 62.6° | 60.0° |
| H5 | C1 | C | H3 | 177.4° | 60.0° |
| H5 | C1 | C | H4 | 57.4° | 180.0° |
| H6 | C2 | H8 | H7 | 120.0° | 120.0° |
| H2 | C | H3 | H4 | 120.0° | 120.1° |
