XB8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C20 | sing | 1.54Å | 1.60Å | |
| C23 | C22 | sing | 1.54Å | 1.57Å | |
| C08 | C07 | sing | 1.51Å | 1.60Å | |
| C08 | N09 | sing | 1.47Å | 1.55Å | |
| C26 | C27 | sing | 1.51Å | 1.53Å | |
| C26 | O25 | sing | 1.43Å | 1.44Å | |
| C06 | C07 | doub | 1.38Å | 1.43Å | Aromatic |
| C06 | C05 | sing | 1.38Å | 1.43Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.43Å | Aromatic |
| C27 | C32 | sing | 1.38Å | 1.42Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | N09 | sing | 1.47Å | 1.50Å | |
| C20 | C21 | sing | 1.54Å | 1.59Å | |
| C32 | C31 | doub | 1.38Å | 1.41Å | Aromatic |
| C07 | C24 | sing | 1.39Å | 1.45Å | Aromatic |
| C22 | C21 | sing | 1.54Å | 1.58Å | |
| C29 | C30 | doub | 1.38Å | 1.41Å | Aromatic |
| C31 | C30 | sing | 1.38Å | 1.41Å | Aromatic |
| C05 | C04 | doub | 1.38Å | 1.42Å | Aromatic |
| N09 | C10 | sing | 1.47Å | 1.49Å | |
| C24 | O25 | sing | 1.36Å | 1.43Å | |
| C24 | C03 | doub | 1.39Å | 1.43Å | Aromatic |
| C04 | C03 | sing | 1.39Å | 1.41Å | Aromatic |
| C10 | C11 | sing | 1.53Å | 1.49Å | |
| C03 | O02 | sing | 1.36Å | 1.42Å | |
| C11 | C12 | sing | 1.53Å | 1.55Å | |
| O02 | C01 | sing | 1.43Å | 1.42Å | |
| F19 | C18 | sing | 1.35Å | 1.39Å | |
| C18 | C17 | doub | 1.38Å | 1.42Å | Aromatic |
| C18 | C13 | sing | 1.39Å | 1.44Å | Aromatic |
| C12 | C13 | sing | 1.51Å | 1.54Å | |
| C17 | C16 | sing | 1.38Å | 1.41Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.42Å | Aromatic |
| C16 | C15 | doub | 1.38Å | 1.44Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.43Å | Aromatic |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C04 | H4 | sing | 1.08Å | 1.08Å | |
| C05 | H5 | sing | 1.08Å | 1.08Å | |
| C06 | H6 | sing | 1.08Å | 1.08Å | |
| C08 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C15 | H16 | sing | 1.08Å | 1.08Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| C17 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C23 | C22 | 89.5° | 87.1° |
| C23 | C20 | N09 | 113.6° | 113.6° |
| C23 | C20 | C21 | 88.9° | 87.1° |
| C23 | C20 | H19 | 112.1° | 113.7° |
| C20 | C23 | H24 | 114.2° | 113.6° |
| C20 | C23 | H25 | 114.2° | 113.6° |
| C23 | C22 | C21 | 90.2° | 87.0° |
| C23 | C22 | H22 | 114.0° | 113.6° |
| C23 | C22 | H23 | 114.1° | 113.7° |
| C22 | C23 | H24 | 114.2° | 113.6° |
| C22 | C23 | H25 | 114.2° | 113.6° |
| C07 | C08 | N09 | 114.8° | 109.5° |
| C08 | C07 | C06 | 119.3° | 120.0° |
| C08 | C07 | C24 | 122.3° | 120.0° |
| C07 | C08 | H7 | 108.1° | 109.5° |
| C07 | C08 | H8 | 108.1° | 109.5° |
| C08 | N09 | C20 | 112.2° | 111.0° |
| C08 | N09 | C10 | 111.1° | 111.0° |
| N09 | C08 | H7 | 108.1° | 109.5° |
| N09 | C08 | H8 | 108.1° | 109.5° |
| C27 | C26 | O25 | 111.7° | 109.4° |
| C26 | C27 | C28 | 120.1° | 120.0° |
| C26 | C27 | C32 | 121.1° | 120.0° |
| C27 | C26 | H26 | 108.9° | 109.5° |
| C27 | C26 | H27 | 108.9° | 109.4° |
| C26 | O25 | C24 | 114.9° | 117.0° |
| O25 | C26 | H26 | 108.9° | 109.5° |
| O25 | C26 | H27 | 108.9° | 109.5° |
| C07 | C06 | C05 | 120.9° | 120.2° |
| C06 | C07 | C24 | 118.4° | 120.0° |
| C07 | C06 | H6 | 119.6° | 119.9° |
| C06 | C05 | C04 | 120.1° | 120.1° |
| C06 | C05 | H5 | 119.9° | 120.0° |
| C05 | C06 | H6 | 119.5° | 119.9° |
| C28 | C27 | C32 | 118.8° | 120.0° |
| C27 | C28 | C29 | 120.2° | 120.0° |
| C27 | C28 | H28 | 119.9° | 120.0° |
| C27 | C32 | C31 | 120.8° | 120.0° |
| C27 | C32 | H32 | 119.6° | 120.1° |
| C28 | C29 | C30 | 119.9° | 120.0° |
| C29 | C28 | H28 | 119.9° | 120.0° |
| C28 | C29 | H29 | 120.1° | 120.0° |
| N09 | C20 | C21 | 114.1° | 113.6° |
| C20 | N09 | C10 | 110.6° | 111.0° |
| N09 | C20 | H19 | 113.6° | 112.9° |
| C20 | C21 | C22 | 89.8° | 87.1° |
| C21 | C20 | H19 | 112.2° | 113.6° |
| C20 | C21 | H20 | 114.2° | 113.6° |
| C20 | C21 | H21 | 114.1° | 113.6° |
| C32 | C31 | C30 | 119.7° | 120.0° |
| C32 | C31 | H31 | 120.1° | 120.0° |
| C31 | C32 | H32 | 119.6° | 120.0° |
| C07 | C24 | O25 | 118.1° | 120.1° |
| C07 | C24 | C03 | 119.9° | 119.8° |
| C22 | C21 | H20 | 114.2° | 113.6° |
| C22 | C21 | H21 | 114.1° | 113.7° |
| C21 | C22 | H22 | 114.1° | 113.6° |
| C21 | C22 | H23 | 114.1° | 113.6° |
| C29 | C30 | C31 | 120.5° | 120.0° |
| C30 | C29 | H29 | 120.0° | 120.1° |
| C29 | C30 | H30 | 119.8° | 120.0° |
| C31 | C30 | H30 | 119.7° | 120.0° |
| C30 | C31 | H31 | 120.1° | 120.0° |
| C05 | C04 | C03 | 119.9° | 120.0° |
| C05 | C04 | H4 | 120.0° | 120.0° |
| C04 | C05 | H5 | 120.0° | 119.9° |
| N09 | C10 | C11 | 109.2° | 109.5° |
| N09 | C10 | H9 | 109.6° | 109.4° |
| N09 | C10 | H10 | 109.5° | 109.5° |
| O25 | C24 | C03 | 121.9° | 120.1° |
| C24 | C03 | C04 | 120.8° | 119.8° |
| C24 | C03 | O02 | 118.5° | 120.1° |
| C04 | C03 | O02 | 120.7° | 120.1° |
| C03 | C04 | H4 | 120.1° | 120.0° |
| C10 | C11 | C12 | 114.8° | 109.5° |
| C11 | C10 | H9 | 109.6° | 109.5° |
| C11 | C10 | H10 | 109.6° | 109.5° |
| C10 | C11 | H11 | 108.2° | 109.5° |
| C10 | C11 | H12 | 108.1° | 109.5° |
| C03 | O02 | C01 | 114.2° | 117.0° |
| C11 | C12 | C13 | 110.2° | 109.5° |
| C12 | C11 | H11 | 108.1° | 109.5° |
| C12 | C11 | H12 | 108.1° | 109.5° |
| C11 | C12 | H13 | 109.3° | 109.4° |
| C11 | C12 | H14 | 109.3° | 109.5° |
| O02 | C01 | H1 | 109.5° | 109.5° |
| O02 | C01 | H2 | 109.4° | 109.4° |
| O02 | C01 | H3 | 109.5° | 109.5° |
| F19 | C18 | C17 | 115.4° | 120.0° |
| F19 | C18 | C13 | 120.3° | 120.0° |
| C17 | C18 | C13 | 124.3° | 119.9° |
| C18 | C17 | C16 | 117.2° | 120.0° |
| C18 | C17 | H18 | 121.4° | 120.0° |
| C18 | C13 | C12 | 123.1° | 120.0° |
| C18 | C13 | C14 | 116.5° | 119.9° |
| C12 | C13 | C14 | 120.4° | 120.0° |
| C13 | C12 | H13 | 109.3° | 109.5° |
| C13 | C12 | H14 | 109.3° | 109.5° |
| C17 | C16 | C15 | 120.9° | 120.0° |
| C17 | C16 | H17 | 119.6° | 120.1° |
| C16 | C17 | H18 | 121.4° | 120.0° |
| C13 | C14 | C15 | 120.9° | 120.0° |
| C13 | C14 | H15 | 119.6° | 120.0° |
| C16 | C15 | C14 | 120.2° | 120.0° |
| C16 | C15 | H16 | 119.9° | 120.0° |
| C15 | C16 | H17 | 119.6° | 119.9° |
| C15 | C14 | H15 | 119.5° | 120.0° |
| C14 | C15 | H16 | 119.9° | 119.9° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H7 | C08 | H8 | 109.5° | 109.5° |
| H9 | C10 | H10 | 109.5° | 109.4° |
| H11 | C11 | H12 | 109.5° | 109.4° |
| H13 | C12 | H14 | 109.5° | 109.4° |
| H20 | C21 | H21 | 109.5° | 112.8° |
| H22 | C22 | H23 | 109.5° | 112.9° |
| H24 | C23 | H25 | 109.5° | 112.9° |
| H26 | C26 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C23 | C22 | H24 | 116.5° | 114.6° |
| C20 | C23 | C22 | H25 | 116.5° | 114.5° |
| C23 | C20 | N09 | C08 | 97.3° | 147.3° |
| C23 | C20 | N09 | C21 | 100.0° | 97.5° |
| C23 | C20 | N09 | H19 | 129.7° | 131.4° |
| C23 | C20 | C21 | H19 | 113.5° | 114.6° |
| C20 | C23 | C22 | C21 | 9.7° | 25.4° |
| C23 | C20 | N09 | C10 | 27.5° | 88.7° |
| C23 | C20 | C21 | H20 | 126.2° | 140.0° |
| C23 | C20 | C21 | H21 | 106.8° | 89.2° |
| C20 | C23 | C22 | H22 | 126.4° | 89.1° |
| C20 | C23 | C22 | H23 | 106.9° | 140.0° |
| C20 | C23 | H24 | H25 | 129.5° | 131.2° |
| C22 | C23 | C20 | N09 | 125.6° | 140.0° |
| C23 | C22 | C21 | H22 | 116.6° | 114.5° |
| C23 | C22 | C21 | H23 | 116.6° | 114.6° |
| C22 | C23 | C20 | H19 | 103.9° | 89.1° |
| C23 | C22 | C21 | H20 | 126.4° | 140.0° |
| C23 | C22 | C21 | H21 | 106.7° | 89.1° |
| C23 | C22 | H22 | H23 | 129.1° | 131.3° |
| C22 | C23 | H24 | H25 | 129.5° | 131.3° |
| C07 | C08 | N09 | H7 | 120.8° | 120.0° |
| C07 | C08 | N09 | H8 | 120.8° | 120.1° |
| C08 | C07 | C06 | C24 | 179.2° | 179.7° |
| C08 | C07 | C06 | C05 | 179.8° | 180.0° |
| C07 | C08 | N09 | C20 | 97.0° | 170.1° |
| C07 | C08 | N09 | C10 | 138.6° | 65.8° |
| C08 | C07 | C24 | O25 | 1.4° | 0.3° |
| C08 | C07 | C24 | C03 | 179.9° | 179.8° |
| C08 | C07 | C06 | H6 | 0.2° | 0.3° |
| C07 | C08 | H7 | H8 | 117.6° | 120.0° |
| N09 | C08 | C07 | C06 | 70.2° | 101.7° |
| C08 | N09 | C20 | C10 | 124.7° | 124.0° |
| C08 | N09 | C20 | C21 | 162.8° | 49.8° |
| N09 | C08 | C07 | C24 | 109.0° | 78.6° |
| C08 | N09 | C10 | C11 | 55.0° | 170.0° |
| N09 | C08 | H7 | H8 | 117.6° | 120.0° |
| C08 | N09 | C10 | H9 | 64.9° | 70.0° |
| C08 | N09 | C10 | H10 | 175.0° | 49.9° |
| C08 | N09 | C20 | H19 | 32.4° | 81.3° |
| C27 | C26 | O25 | H26 | 120.4° | 120.0° |
| C27 | C26 | O25 | H27 | 120.3° | 120.0° |
| C26 | C27 | C28 | C32 | 179.8° | 179.7° |
| C26 | C27 | C28 | C29 | 179.7° | 180.0° |
| C26 | C27 | C32 | C31 | 179.4° | 179.8° |
| C27 | C26 | O25 | C24 | 178.3° | 174.5° |
| C27 | C26 | H26 | H27 | 119.0° | 119.9° |
| C26 | C27 | C28 | H28 | 0.3° | 0.0° |
| C26 | C27 | C32 | H32 | 0.5° | 0.0° |
| O25 | C26 | C27 | C28 | 63.7° | 97.4° |
| O25 | C26 | C27 | C32 | 116.1° | 82.8° |
| C26 | O25 | C24 | C07 | 92.8° | 96.0° |
| C26 | O25 | C24 | C03 | 85.7° | 84.5° |
| O25 | C26 | H26 | H27 | 119.0° | 120.1° |
| C07 | C06 | C05 | H6 | 180.0° | 179.7° |
| C07 | C06 | C05 | C04 | 0.2° | 0.1° |
| C06 | C07 | C24 | O25 | 179.4° | 180.0° |
| C06 | C07 | C24 | C03 | 0.9° | 0.5° |
| C07 | C06 | C05 | H5 | 179.8° | 180.0° |
| C06 | C07 | C08 | H7 | 169.0° | 18.3° |
| C06 | C07 | C08 | H8 | 50.6° | 138.3° |
| C05 | C06 | C07 | C24 | 0.6° | 0.2° |
| C06 | C05 | C04 | H5 | 180.0° | 179.9° |
| C06 | C05 | C04 | C03 | 0.1° | 0.1° |
| C06 | C05 | C04 | H4 | 179.9° | 180.0° |
| C27 | C28 | C29 | H28 | 180.0° | 180.0° |
| C28 | C27 | C32 | C31 | 0.3° | 0.5° |
| C27 | C28 | C29 | C30 | 0.4° | 0.0° |
| C28 | C27 | C26 | H26 | 56.6° | 142.5° |
| C28 | C27 | C26 | H27 | 176.0° | 22.6° |
| C27 | C28 | C29 | H29 | 179.6° | 179.9° |
| C28 | C27 | C32 | H32 | 179.7° | 179.7° |
| C32 | C27 | C28 | C29 | 0.1° | 0.3° |
| C27 | C32 | C31 | H32 | 180.0° | 179.7° |
| C27 | C32 | C31 | C30 | 0.1° | 0.5° |
| C32 | C27 | C26 | H26 | 123.6° | 37.2° |
| C32 | C27 | C26 | H27 | 4.3° | 157.1° |
| C32 | C27 | C28 | H28 | 179.9° | 179.7° |
| C27 | C32 | C31 | H31 | 179.9° | 179.7° |
| C28 | C29 | C30 | H29 | 180.0° | 179.9° |
| C28 | C29 | C30 | C31 | 0.6° | 0.0° |
| C28 | C29 | C30 | H30 | 179.4° | 180.0° |
| N09 | C20 | C21 | H19 | 131.0° | 130.8° |
| N09 | C20 | C21 | C22 | 125.2° | 140.0° |
| C20 | N09 | C10 | C11 | 179.6° | 66.0° |
| C20 | N09 | C08 | H7 | 142.3° | 69.9° |
| C20 | N09 | C08 | H8 | 23.8° | 50.1° |
| C20 | N09 | C10 | H9 | 60.4° | 54.0° |
| C20 | N09 | C10 | H10 | 59.6° | 174.0° |
| N09 | C20 | C21 | H20 | 118.3° | 105.5° |
| N09 | C20 | C21 | H21 | 8.7° | 25.3° |
| N09 | C20 | C23 | H24 | 9.2° | 25.4° |
| N09 | C20 | C23 | H25 | 117.9° | 105.5° |
| C20 | C21 | C22 | H20 | 116.5° | 114.6° |
| C20 | C21 | C22 | H21 | 116.5° | 114.6° |
| C21 | C20 | N09 | C10 | 72.5° | 173.9° |
| C20 | C21 | H20 | H21 | 129.3° | 131.2° |
| C20 | C21 | C22 | H22 | 126.4° | 89.1° |
| C20 | C21 | C22 | H23 | 106.8° | 140.0° |
| C21 | C20 | C23 | H24 | 106.8° | 89.1° |
| C21 | C20 | C23 | H25 | 126.2° | 140.0° |
| C32 | C31 | C30 | C29 | 0.4° | 0.2° |
| C32 | C31 | C30 | H31 | 180.0° | 179.8° |
| C32 | C31 | C30 | H30 | 179.6° | 179.8° |
| C07 | C24 | O25 | C03 | 178.5° | 179.5° |
| C07 | C24 | C03 | C04 | 0.8° | 0.5° |
| C07 | C24 | C03 | O02 | 179.5° | 179.8° |
| C24 | C07 | C06 | H6 | 179.4° | 180.0° |
| C24 | C07 | C08 | H7 | 11.8° | 161.4° |
| C24 | C07 | C08 | H8 | 130.2° | 41.4° |
| C22 | C21 | C20 | H19 | 103.8° | 89.2° |
| C22 | C21 | H20 | H21 | 129.4° | 131.3° |
| C21 | C22 | H22 | H23 | 129.2° | 131.2° |
| C21 | C22 | C23 | H24 | 106.7° | 89.1° |
| C21 | C22 | C23 | H25 | 126.2° | 139.9° |
| C29 | C30 | C31 | H30 | 180.0° | 180.0° |
| C30 | C29 | C28 | H28 | 179.6° | 180.0° |
| C29 | C30 | C31 | H31 | 179.6° | 180.0° |
| C31 | C30 | C29 | H29 | 179.4° | 179.9° |
| C30 | C31 | C32 | H32 | 180.0° | 179.8° |
| C05 | C04 | C03 | C24 | 0.4° | 0.2° |
| C05 | C04 | C03 | H4 | 180.0° | 180.0° |
| C05 | C04 | C03 | O02 | 179.9° | 180.0° |
| C04 | C05 | C06 | H6 | 179.8° | 179.7° |
| N09 | C10 | C11 | H9 | 120.0° | 120.0° |
| N09 | C10 | C11 | H10 | 119.9° | 120.1° |
| N09 | C10 | C11 | C12 | 124.1° | 180.0° |
| C10 | N09 | C08 | H7 | 17.8° | 54.1° |
| C10 | N09 | C08 | H8 | 100.7° | 174.1° |
| N09 | C10 | H9 | H10 | 120.1° | 120.0° |
| N09 | C10 | C11 | H11 | 3.3° | 59.9° |
| N09 | C10 | C11 | H12 | 115.1° | 60.0° |
| C10 | N09 | C20 | H19 | 157.2° | 42.7° |
| O25 | C24 | C03 | C04 | 179.2° | 180.0° |
| O25 | C24 | C03 | O02 | 1.0° | 0.3° |
| C24 | O25 | C26 | H26 | 58.0° | 54.5° |
| C24 | O25 | C26 | H27 | 61.4° | 65.5° |
| C24 | C03 | C04 | O02 | 179.7° | 179.7° |
| C24 | C03 | O02 | C01 | 156.2° | 179.8° |
| C24 | C03 | C04 | H4 | 179.6° | 179.7° |
| C04 | C03 | O02 | C01 | 23.6° | 0.0° |
| C03 | C04 | C05 | H5 | 179.9° | 180.0° |
| C10 | C11 | C12 | H11 | 120.8° | 120.0° |
| C10 | C11 | C12 | H12 | 120.8° | 120.0° |
| C10 | C11 | C12 | C13 | 158.0° | 180.0° |
| C11 | C10 | H9 | H10 | 120.2° | 120.0° |
| C10 | C11 | H11 | H12 | 117.6° | 120.0° |
| C10 | C11 | C12 | H13 | 37.9° | 60.0° |
| C10 | C11 | C12 | H14 | 81.9° | 60.0° |
| C03 | O02 | C01 | H1 | 180.0° | 60.0° |
| C03 | O02 | C01 | H2 | 60.0° | 180.0° |
| C03 | O02 | C01 | H3 | 60.0° | 60.0° |
| O02 | C03 | C04 | H4 | 0.1° | 0.0° |
| C11 | C12 | C13 | C18 | 92.4° | 80.2° |
| C11 | C12 | C13 | H13 | 120.1° | 120.0° |
| C11 | C12 | C13 | H14 | 120.1° | 120.0° |
| C11 | C12 | C13 | C14 | 85.2° | 100.0° |
| C12 | C11 | C10 | H9 | 116.0° | 60.0° |
| C12 | C11 | C10 | H10 | 4.1° | 60.0° |
| C12 | C11 | H11 | H12 | 117.6° | 120.0° |
| C11 | C12 | H13 | H14 | 119.6° | 119.9° |
| O02 | C01 | H1 | H2 | 120.0° | 120.0° |
| O02 | C01 | H1 | H3 | 120.0° | 120.0° |
| O02 | C01 | H2 | H3 | 120.0° | 120.0° |
| F19 | C18 | C17 | C13 | 179.0° | 179.6° |
| F19 | C18 | C13 | C12 | 1.7° | 0.2° |
| F19 | C18 | C17 | C16 | 179.8° | 180.0° |
| F19 | C18 | C13 | C14 | 179.4° | 179.9° |
| F19 | C18 | C17 | H18 | 0.2° | 0.1° |
| C17 | C18 | C13 | C12 | 179.3° | 179.7° |
| C18 | C17 | C16 | H18 | 180.0° | 179.8° |
| C17 | C18 | C13 | C14 | 1.6° | 0.5° |
| C18 | C17 | C16 | C15 | 0.7° | 0.2° |
| C18 | C17 | C16 | H17 | 179.3° | 179.8° |
| C18 | C13 | C12 | C14 | 177.7° | 179.8° |
| C13 | C18 | C17 | C16 | 1.2° | 0.5° |
| C18 | C13 | C14 | C15 | 1.5° | 0.3° |
| C18 | C13 | C12 | H13 | 27.7° | 159.8° |
| C18 | C13 | C12 | H14 | 147.5° | 39.8° |
| C18 | C13 | C14 | H15 | 178.5° | 179.8° |
| C13 | C18 | C17 | H18 | 178.8° | 179.7° |
| C12 | C13 | C14 | C15 | 179.3° | 180.0° |
| C13 | C12 | C11 | H11 | 81.2° | 60.0° |
| C13 | C12 | C11 | H12 | 37.2° | 60.0° |
| C13 | C12 | H13 | H14 | 119.7° | 120.0° |
| C12 | C13 | C14 | H15 | 0.7° | 0.0° |
| C17 | C16 | C15 | H17 | 180.0° | 179.9° |
| C17 | C16 | C15 | C14 | 0.7° | 0.0° |
| C17 | C16 | C15 | H16 | 179.3° | 180.0° |
| C13 | C14 | C15 | C16 | 1.2° | 0.0° |
| C13 | C14 | C15 | H15 | 180.0° | 180.0° |
| C14 | C13 | C12 | H13 | 154.6° | 20.0° |
| C14 | C13 | C12 | H14 | 34.9° | 140.0° |
| C13 | C14 | C15 | H16 | 178.9° | 180.0° |
| C16 | C15 | C14 | H16 | 180.0° | 180.0° |
| C16 | C15 | C14 | H15 | 178.9° | 180.0° |
| C15 | C16 | C17 | H18 | 179.3° | 179.9° |
| C14 | C15 | C16 | H17 | 179.3° | 180.0° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H4 | C04 | C05 | H5 | 0.1° | 0.1° |
| H5 | C05 | C06 | H6 | 0.2° | 0.2° |
| H9 | C10 | C11 | H11 | 123.3° | 60.0° |
| H9 | C10 | C11 | H12 | 4.8° | 180.0° |
| H10 | C10 | C11 | H11 | 116.6° | 180.0° |
| H10 | C10 | C11 | H12 | 124.9° | 60.0° |
| H11 | C11 | C12 | H13 | 158.7° | 180.0° |
| H11 | C11 | C12 | H14 | 38.9° | 60.1° |
| H12 | C11 | C12 | H13 | 82.9° | 60.1° |
| H12 | C11 | C12 | H14 | 157.3° | 180.0° |
| H15 | C14 | C15 | H16 | 1.1° | 0.0° |
| H16 | C15 | C16 | H17 | 0.7° | 0.1° |
| H17 | C16 | C17 | H18 | 0.7° | 0.0° |
| H19 | C20 | C21 | H20 | 12.7° | 25.3° |
| H19 | C20 | C21 | H21 | 139.7° | 156.2° |
| H19 | C20 | C23 | H24 | 139.6° | 156.4° |
| H19 | C20 | C23 | H25 | 12.6° | 25.5° |
| H20 | C21 | C22 | H22 | 117.1° | 25.5° |
| H20 | C21 | C22 | H23 | 9.7° | 105.4° |
| H21 | C21 | C22 | H22 | 9.9° | 156.3° |
| H21 | C21 | C22 | H23 | 136.7° | 25.5° |
| H22 | C22 | C23 | H24 | 9.9° | 156.3° |
| H22 | C22 | C23 | H25 | 117.2° | 25.4° |
| H23 | C22 | C23 | H24 | 136.7° | 25.4° |
| H23 | C22 | C23 | H25 | 9.6° | 105.5° |
| H28 | C28 | C29 | H29 | 0.4° | 0.1° |
| H29 | C29 | C30 | H30 | 0.6° | 0.1° |
| H30 | C30 | C31 | H31 | 0.4° | 0.0° |
| H31 | C31 | C32 | H32 | 0.1° | 0.0° |
