J10
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5 | C4 | sing | 1.51Å | 1.50Å | |
| C3 | C4 | doub | 1.33Å | 1.32Å | |
| C3 | C2 | sing | 1.47Å | 1.46Å | |
| O1 | C2 | sing | 1.35Å | 1.33Å | |
| O1 | C1 | sing | 1.45Å | 1.44Å | |
| C4 | C6 | sing | 1.51Å | 1.51Å | |
| C2 | O2 | doub | 1.22Å | 1.21Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C7 | C8 | sing | 1.51Å | 1.49Å | |
| C8 | C9 | doub | 1.31Å | 1.33Å | |
| C10 | C9 | sing | 1.51Å | 1.48Å | |
| C9 | C11 | sing | 1.51Å | 1.50Å | |
| C13 | C12 | sing | 1.51Å | 1.48Å | |
| C13 | C14 | doub | 1.31Å | 1.32Å | |
| C15 | C14 | sing | 1.51Å | 1.47Å | |
| C12 | C11 | sing | 1.53Å | 1.50Å | |
| C14 | C16 | sing | 1.51Å | 1.50Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.08Å | 1.08Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.08Å | 1.08Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C3 | 125.7° | 120.0° |
| C5 | C4 | C6 | 114.5° | 120.0° |
| C4 | C5 | H7 | 109.5° | 109.4° |
| C4 | C5 | H5 | 109.5° | 109.4° |
| C4 | C5 | H6 | 109.5° | 109.5° |
| C4 | C3 | C2 | 125.7° | 120.0° |
| C3 | C4 | C6 | 119.8° | 120.0° |
| C4 | C3 | H4 | 117.2° | 120.0° |
| C3 | C2 | O1 | 112.3° | 120.0° |
| C3 | C2 | O2 | 125.9° | 120.1° |
| C2 | C3 | H4 | 117.2° | 120.0° |
| C2 | O1 | C1 | 113.7° | 117.0° |
| O1 | C2 | O2 | 121.9° | 119.9° |
| O1 | C1 | H3 | 109.5° | 109.4° |
| O1 | C1 | H1 | 109.5° | 109.4° |
| O1 | C1 | H2 | 109.5° | 109.5° |
| C4 | C6 | C7 | 113.2° | 109.5° |
| C4 | C6 | H8 | 108.5° | 109.5° |
| C4 | C6 | H9 | 108.5° | 109.5° |
| C6 | C7 | C8 | 113.4° | 109.5° |
| C7 | C6 | H8 | 108.5° | 109.5° |
| C7 | C6 | H9 | 108.5° | 109.4° |
| C6 | C7 | H10 | 108.5° | 109.5° |
| C6 | C7 | H11 | 108.5° | 109.5° |
| C7 | C8 | C9 | 127.8° | 120.0° |
| C8 | C7 | H10 | 108.5° | 109.5° |
| C8 | C7 | H11 | 108.5° | 109.5° |
| C7 | C8 | H12 | 116.1° | 120.0° |
| C8 | C9 | C10 | 123.6° | 120.0° |
| C8 | C9 | C11 | 121.0° | 120.0° |
| C9 | C8 | H12 | 116.1° | 120.0° |
| C10 | C9 | C11 | 115.2° | 120.0° |
| C9 | C10 | H15 | 109.5° | 109.4° |
| C9 | C10 | H13 | 109.4° | 109.4° |
| C9 | C10 | H14 | 109.5° | 109.5° |
| C9 | C11 | C12 | 112.3° | 109.5° |
| C9 | C11 | H16 | 108.8° | 109.5° |
| C9 | C11 | H17 | 108.7° | 109.5° |
| C12 | C13 | C14 | 126.9° | 120.0° |
| C13 | C12 | C11 | 112.2° | 109.5° |
| C13 | C12 | H19 | 108.8° | 109.5° |
| C13 | C12 | H18 | 108.8° | 109.4° |
| C12 | C13 | H20 | 116.5° | 120.0° |
| C13 | C14 | C15 | 121.1° | 120.0° |
| C13 | C14 | C16 | 124.0° | 119.9° |
| C14 | C13 | H20 | 116.6° | 119.9° |
| C15 | C14 | C16 | 114.9° | 120.0° |
| C14 | C15 | H23 | 109.5° | 109.5° |
| C14 | C15 | H21 | 109.5° | 109.5° |
| C14 | C15 | H22 | 109.5° | 109.5° |
| C12 | C11 | H16 | 108.7° | 109.5° |
| C12 | C11 | H17 | 108.7° | 109.4° |
| C11 | C12 | H19 | 108.8° | 109.6° |
| C11 | C12 | H18 | 108.8° | 109.5° |
| C14 | C16 | H25 | 109.5° | 109.4° |
| C14 | C16 | H26 | 109.4° | 109.4° |
| C14 | C16 | H24 | 109.5° | 109.5° |
| H3 | C1 | H1 | 109.4° | 109.5° |
| H3 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H7 | C5 | H5 | 109.5° | 109.5° |
| H7 | C5 | H6 | 109.4° | 109.5° |
| H5 | C5 | H6 | 109.5° | 109.5° |
| H8 | C6 | H9 | 109.5° | 109.5° |
| H10 | C7 | H11 | 109.5° | 109.4° |
| H15 | C10 | H13 | 109.4° | 109.5° |
| H15 | C10 | H14 | 109.5° | 109.5° |
| H13 | C10 | H14 | 109.5° | 109.5° |
| H16 | C11 | H17 | 109.5° | 109.5° |
| H19 | C12 | H18 | 109.5° | 109.4° |
| H23 | C15 | H21 | 109.5° | 109.5° |
| H23 | C15 | H22 | 109.5° | 109.5° |
| H21 | C15 | H22 | 109.5° | 109.4° |
| H25 | C16 | H26 | 109.5° | 109.5° |
| H25 | C16 | H24 | 109.4° | 109.5° |
| H26 | C16 | H24 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C3 | C6 | 179.4° | 179.9° |
| C5 | C4 | C3 | C2 | 139.5° | 172.0° |
| C5 | C4 | C6 | C7 | 145.4° | 92.0° |
| C5 | C4 | C3 | H4 | 40.5° | 8.0° |
| C4 | C5 | H7 | H5 | 120.0° | 120.0° |
| C4 | C5 | H7 | H6 | 120.0° | 120.0° |
| C4 | C5 | H5 | H6 | 120.0° | 120.0° |
| C5 | C4 | C6 | H8 | 94.0° | 28.0° |
| C5 | C4 | C6 | H9 | 24.8° | 148.0° |
| C4 | C3 | C2 | H4 | 180.0° | 179.9° |
| C4 | C3 | C2 | O1 | 130.6° | 177.3° |
| C4 | C3 | C2 | O2 | 48.3° | 2.7° |
| C3 | C4 | C6 | C7 | 34.1° | 87.9° |
| C3 | C4 | C5 | H7 | 180.0° | 90.0° |
| C3 | C4 | C5 | H5 | 60.0° | 149.9° |
| C3 | C4 | C5 | H6 | 60.0° | 29.9° |
| C3 | C4 | C6 | H8 | 86.5° | 152.1° |
| C3 | C4 | C6 | H9 | 154.6° | 32.1° |
| C3 | C2 | O1 | O2 | 178.9° | 179.9° |
| C3 | C2 | O1 | C1 | 162.2° | 180.0° |
| C2 | C3 | C4 | C6 | 41.1° | 7.9° |
| C2 | O1 | C1 | H3 | 180.0° | 60.0° |
| C2 | O1 | C1 | H1 | 60.0° | 59.9° |
| C2 | O1 | C1 | H2 | 60.0° | 180.0° |
| O1 | C2 | C3 | H4 | 49.4° | 2.6° |
| C1 | O1 | C2 | O2 | 16.7° | 0.0° |
| O1 | C1 | H3 | H1 | 120.0° | 119.9° |
| O1 | C1 | H3 | H2 | 120.0° | 120.0° |
| O1 | C1 | H1 | H2 | 120.0° | 120.0° |
| C4 | C6 | C7 | H8 | 120.6° | 120.0° |
| C4 | C6 | C7 | H9 | 120.5° | 120.0° |
| C4 | C6 | C7 | C8 | 151.1° | 180.0° |
| C6 | C4 | C3 | H4 | 138.9° | 172.0° |
| C6 | C4 | C5 | H7 | 0.6° | 90.0° |
| C6 | C4 | C5 | H5 | 120.6° | 30.0° |
| C6 | C4 | C5 | H6 | 119.4° | 150.0° |
| C4 | C6 | H8 | H9 | 118.3° | 120.0° |
| C4 | C6 | C7 | H10 | 88.3° | 60.0° |
| C4 | C6 | C7 | H11 | 30.5° | 60.0° |
| O2 | C2 | C3 | H4 | 131.7° | 177.3° |
| C6 | C7 | C8 | H10 | 120.6° | 120.0° |
| C6 | C7 | C8 | H11 | 120.6° | 120.0° |
| C6 | C7 | C8 | C9 | 22.6° | 125.9° |
| C7 | C6 | H8 | H9 | 118.3° | 120.0° |
| C6 | C7 | H10 | H11 | 118.2° | 120.0° |
| C6 | C7 | C8 | H12 | 157.4° | 54.2° |
| C7 | C8 | C9 | H12 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 68.2° | 5.9° |
| C7 | C8 | C9 | C11 | 107.1° | 174.1° |
| C8 | C7 | C6 | H8 | 30.6° | 60.0° |
| C8 | C7 | C6 | H9 | 88.4° | 60.0° |
| C8 | C7 | H10 | H11 | 118.2° | 120.0° |
| C8 | C9 | C10 | C11 | 175.5° | 180.0° |
| C8 | C9 | C11 | C12 | 2.4° | 95.0° |
| C9 | C8 | C7 | H10 | 143.2° | 114.1° |
| C9 | C8 | C7 | H11 | 98.0° | 5.9° |
| C8 | C9 | C10 | H15 | 180.0° | 84.6° |
| C8 | C9 | C10 | H13 | 60.0° | 155.4° |
| C8 | C9 | C10 | H14 | 60.0° | 35.4° |
| C8 | C9 | C11 | H16 | 122.8° | 145.0° |
| C8 | C9 | C11 | H17 | 118.0° | 24.9° |
| C10 | C9 | C11 | C12 | 178.0° | 85.0° |
| C10 | C9 | C8 | H12 | 111.8° | 174.1° |
| C9 | C10 | H15 | H13 | 120.0° | 120.0° |
| C9 | C10 | H15 | H14 | 120.0° | 120.0° |
| C9 | C10 | H13 | H14 | 120.0° | 120.0° |
| C10 | C9 | C11 | H16 | 61.6° | 35.0° |
| C10 | C9 | C11 | H17 | 57.6° | 155.0° |
| C9 | C11 | C12 | C13 | 103.9° | 180.0° |
| C9 | C11 | C12 | H16 | 120.4° | 120.0° |
| C9 | C11 | C12 | H17 | 120.4° | 120.0° |
| C11 | C9 | C8 | H12 | 73.0° | 6.0° |
| C11 | C9 | C10 | H15 | 4.5° | 95.4° |
| C11 | C9 | C10 | H13 | 124.5° | 24.6° |
| C11 | C9 | C10 | H14 | 115.5° | 144.6° |
| C9 | C11 | H16 | H17 | 118.7° | 120.0° |
| C9 | C11 | C12 | H19 | 135.7° | 60.0° |
| C9 | C11 | C12 | H18 | 16.5° | 60.0° |
| C12 | C13 | C14 | H20 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 132.4° | 179.9° |
| C13 | C12 | C11 | H19 | 120.4° | 120.0° |
| C13 | C12 | C11 | H18 | 120.4° | 120.0° |
| C12 | C13 | C14 | C16 | 46.8° | 0.0° |
| C13 | C12 | C11 | H16 | 135.7° | 60.0° |
| C13 | C12 | C11 | H17 | 16.5° | 60.1° |
| C13 | C12 | H19 | H18 | 118.7° | 119.9° |
| C13 | C14 | C15 | C16 | 179.3° | 180.0° |
| C14 | C13 | C12 | C11 | 104.4° | 125.0° |
| C14 | C13 | C12 | H19 | 16.0° | 4.9° |
| C14 | C13 | C12 | H18 | 135.2° | 115.0° |
| C13 | C14 | C15 | H23 | 180.0° | 90.0° |
| C13 | C14 | C15 | H21 | 60.0° | 150.0° |
| C13 | C14 | C15 | H22 | 60.0° | 30.1° |
| C13 | C14 | C16 | H25 | 180.0° | 60.1° |
| C13 | C14 | C16 | H26 | 60.0° | 180.0° |
| C13 | C14 | C16 | H24 | 60.0° | 60.0° |
| C15 | C14 | C13 | H20 | 47.6° | 0.0° |
| C14 | C15 | H23 | H21 | 120.0° | 120.0° |
| C14 | C15 | H23 | H22 | 120.0° | 120.0° |
| C14 | C15 | H21 | H22 | 120.0° | 120.0° |
| C15 | C14 | C16 | H25 | 0.7° | 120.0° |
| C15 | C14 | C16 | H26 | 119.3° | 0.1° |
| C15 | C14 | C16 | H24 | 120.7° | 120.0° |
| C12 | C11 | H16 | H17 | 118.7° | 120.0° |
| C11 | C12 | H19 | H18 | 118.8° | 120.0° |
| C11 | C12 | C13 | H20 | 75.6° | 55.0° |
| C16 | C14 | C13 | H20 | 133.2° | 180.0° |
| C16 | C14 | C15 | H23 | 0.7° | 90.0° |
| C16 | C14 | C15 | H21 | 120.7° | 30.1° |
| C16 | C14 | C15 | H22 | 119.3° | 150.0° |
| C14 | C16 | H25 | H26 | 120.0° | 119.9° |
| C14 | C16 | H25 | H24 | 120.0° | 120.0° |
| C14 | C16 | H26 | H24 | 120.0° | 120.0° |
| H3 | C1 | H1 | H2 | 120.0° | 120.1° |
| H7 | C5 | H5 | H6 | 119.9° | 120.1° |
| H8 | C6 | C7 | H10 | 151.1° | 180.0° |
| H8 | C6 | C7 | H11 | 90.0° | 60.0° |
| H9 | C6 | C7 | H10 | 32.2° | 60.0° |
| H9 | C6 | C7 | H11 | 151.1° | 180.0° |
| H10 | C7 | C8 | H12 | 36.9° | 65.8° |
| H11 | C7 | C8 | H12 | 82.0° | 174.2° |
| H15 | C10 | H13 | H14 | 120.0° | 120.1° |
| H16 | C11 | C12 | H19 | 15.3° | 180.0° |
| H16 | C11 | C12 | H18 | 103.9° | 60.0° |
| H17 | C11 | C12 | H19 | 103.9° | 60.0° |
| H17 | C11 | C12 | H18 | 136.9° | 180.0° |
| H19 | C12 | C13 | H20 | 164.0° | 175.1° |
| H18 | C12 | C13 | H20 | 44.8° | 65.1° |
| H23 | C15 | H21 | H22 | 120.0° | 120.0° |
| H25 | C16 | H26 | H24 | 120.0° | 120.1° |
