A1EV3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O27 | C28 | sing | 1.44Å | 1.39Å | |
| O27 | C26 | sing | 1.36Å | 1.40Å | |
| C30 | C26 | doub | 1.39Å | 1.42Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | O29 | sing | 1.44Å | 1.39Å | |
| C26 | C25 | sing | 1.39Å | 1.36Å | Aromatic |
| C31 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| O29 | C25 | sing | 1.37Å | 1.40Å | |
| C25 | C24 | doub | 1.38Å | 1.41Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | C03 | sing | 1.51Å | 1.54Å | |
| C03 | C02 | sing | 1.51Å | 1.54Å | |
| C03 | C01 | sing | 1.52Å | 1.57Å | |
| C03 | C04 | sing | 1.53Å | 1.61Å | |
| C02 | C01 | sing | 1.52Å | 1.57Å | |
| C01 | C07 | sing | 1.52Å | 1.43Å | |
| C04 | C05 | sing | 1.53Å | 1.43Å | |
| C07 | C06 | sing | 1.52Å | 1.60Å | |
| C05 | C06 | sing | 1.53Å | 1.55Å | |
| C06 | N08 | sing | 1.47Å | 1.33Å | |
| N08 | C09 | sing | 1.47Å | 1.35Å | |
| N08 | C22 | sing | 1.47Å | 1.35Å | |
| C09 | C10 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.53Å | |
| C10 | N11 | sing | 1.47Å | 1.35Å | |
| C21 | N11 | sing | 1.47Å | 1.36Å | |
| N11 | C12 | sing | 1.47Å | 1.29Å | |
| C12 | C13 | sing | 1.51Å | 1.56Å | |
| C20 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C18 | sing | 1.38Å | 1.40Å | Aromatic |
| CL19 | C18 | sing | 1.74Å | 1.78Å | |
| C13 | C14 | sing | 1.38Å | 1.37Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | BR15 | sing | 1.89Å | 1.92Å | |
| C14 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.08Å | 1.08Å | |
| C20 | H4 | sing | 1.08Å | 1.08Å | |
| C21 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.08Å | 1.08Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C02 | H12 | sing | 1.09Å | 1.10Å | |
| C02 | H13 | sing | 1.09Å | 1.10Å | |
| C04 | H14 | sing | 1.09Å | 1.10Å | |
| C04 | H15 | sing | 1.09Å | 1.10Å | |
| C05 | H16 | sing | 1.09Å | 1.10Å | |
| C05 | H17 | sing | 1.09Å | 1.10Å | |
| C06 | H18 | sing | 1.09Å | 1.10Å | |
| C07 | H19 | sing | 1.09Å | 1.10Å | |
| C07 | H20 | sing | 1.09Å | 1.10Å | |
| C09 | H21 | sing | 1.09Å | 1.10Å | |
| C09 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C12 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.08Å | 1.08Å | |
| C30 | H26 | sing | 1.08Å | 1.08Å | |
| C31 | H27 | sing | 1.08Å | 1.08Å | |
| C28 | H29 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C28 | O27 | C26 | 108.2° | 105.5° |
| O27 | C28 | O29 | 107.0° | 103.8° |
| O27 | C28 | H10 | 110.1° | 110.7° |
| O27 | C28 | H29 | 110.1° | 110.6° |
| O27 | C26 | C30 | 131.9° | 131.5° |
| O27 | C26 | C25 | 107.2° | 108.7° |
| C26 | C30 | C31 | 119.9° | 120.0° |
| C30 | C26 | C25 | 120.9° | 119.8° |
| C26 | C30 | H26 | 120.0° | 120.0° |
| C30 | C31 | C23 | 118.1° | 120.1° |
| C31 | C30 | H26 | 120.0° | 120.0° |
| C30 | C31 | H27 | 120.9° | 119.9° |
| C28 | O29 | C25 | 107.1° | 105.5° |
| O29 | C28 | H10 | 110.1° | 110.6° |
| O29 | C28 | H29 | 110.1° | 110.6° |
| C26 | C25 | O29 | 109.4° | 108.6° |
| C26 | C25 | C24 | 119.8° | 119.9° |
| C31 | C23 | C24 | 122.0° | 120.1° |
| C31 | C23 | C03 | 123.5° | 119.9° |
| C23 | C31 | H27 | 120.9° | 120.0° |
| O29 | C25 | C24 | 130.8° | 131.5° |
| C25 | C24 | C23 | 119.2° | 120.0° |
| C25 | C24 | H9 | 120.4° | 120.0° |
| C24 | C23 | C03 | 114.4° | 120.0° |
| C23 | C24 | H9 | 120.4° | 120.0° |
| C23 | C03 | C02 | 93.2° | 117.2° |
| C23 | C03 | C01 | 135.8° | 117.1° |
| C23 | C03 | C04 | 106.5° | 114.9° |
| C02 | C03 | C01 | 60.4° | 60.3° |
| C02 | C03 | C04 | 97.1° | 116.0° |
| C03 | C02 | C01 | 60.6° | 60.1° |
| C03 | C02 | H12 | 119.9° | 117.1° |
| C03 | C02 | H13 | 119.9° | 117.8° |
| C01 | C03 | C04 | 111.1° | 120.4° |
| C03 | C01 | C02 | 59.1° | 59.7° |
| C03 | C01 | C07 | 113.6° | 120.0° |
| C03 | C01 | H11 | 110.1° | 116.0° |
| C03 | C04 | C05 | 114.9° | 110.2° |
| C03 | C04 | H14 | 108.1° | 109.4° |
| C03 | C04 | H15 | 108.1° | 109.4° |
| C02 | C01 | C07 | 136.5° | 119.8° |
| C02 | C01 | H11 | 110.1° | 115.9° |
| C01 | C02 | H12 | 119.9° | 117.6° |
| C01 | C02 | H13 | 119.9° | 117.6° |
| C01 | C07 | C06 | 109.1° | 110.6° |
| C07 | C01 | H11 | 112.1° | 114.6° |
| C01 | C07 | H19 | 109.6° | 109.3° |
| C01 | C07 | H20 | 109.6° | 109.2° |
| C04 | C05 | C06 | 107.2° | 108.6° |
| C05 | C04 | H14 | 108.1° | 109.3° |
| C05 | C04 | H15 | 108.1° | 109.4° |
| C04 | C05 | H16 | 110.0° | 109.7° |
| C04 | C05 | H17 | 110.0° | 109.6° |
| C07 | C06 | C05 | 108.6° | 108.3° |
| C07 | C06 | N08 | 109.1° | 109.5° |
| C07 | C06 | H18 | 107.5° | 110.2° |
| C06 | C07 | H19 | 109.6° | 110.1° |
| C06 | C07 | H20 | 109.6° | 108.4° |
| C05 | C06 | N08 | 112.3° | 109.6° |
| C06 | C05 | H16 | 110.1° | 109.7° |
| C06 | C05 | H17 | 110.1° | 109.6° |
| C05 | C06 | H18 | 108.0° | 109.6° |
| C06 | N08 | C09 | 103.9° | 111.0° |
| C06 | N08 | C22 | 110.0° | 111.0° |
| N08 | C06 | H18 | 111.1° | 109.6° |
| C09 | N08 | C22 | 111.5° | 110.9° |
| N08 | C09 | C10 | 112.7° | 109.4° |
| N08 | C09 | H21 | 108.6° | 109.4° |
| N08 | C09 | H22 | 108.6° | 109.5° |
| N08 | C22 | C21 | 108.7° | 109.4° |
| N08 | C22 | H7 | 109.7° | 109.5° |
| N08 | C22 | H8 | 109.7° | 109.5° |
| C09 | C10 | N11 | 110.0° | 109.4° |
| C09 | C10 | H1 | 109.4° | 109.5° |
| C09 | C10 | H2 | 109.4° | 109.5° |
| C10 | C09 | H21 | 108.6° | 109.5° |
| C10 | C09 | H22 | 108.7° | 109.5° |
| C22 | C21 | N11 | 112.3° | 109.4° |
| C22 | C21 | H5 | 108.8° | 109.5° |
| C22 | C21 | H6 | 108.7° | 109.5° |
| C21 | C22 | H7 | 109.6° | 109.5° |
| C21 | C22 | H8 | 109.7° | 109.5° |
| C10 | N11 | C21 | 109.1° | 110.9° |
| C10 | N11 | C12 | 106.4° | 111.0° |
| N11 | C10 | H1 | 109.3° | 109.5° |
| N11 | C10 | H2 | 109.4° | 109.5° |
| C21 | N11 | C12 | 107.1° | 111.0° |
| N11 | C21 | H5 | 108.7° | 109.4° |
| N11 | C21 | H6 | 108.8° | 109.4° |
| N11 | C12 | C13 | 114.4° | 109.5° |
| N11 | C12 | H23 | 108.2° | 109.5° |
| N11 | C12 | H24 | 108.2° | 109.4° |
| C12 | C13 | C20 | 126.8° | 120.0° |
| C12 | C13 | C14 | 113.5° | 120.0° |
| C13 | C12 | H23 | 108.2° | 109.5° |
| C13 | C12 | H24 | 108.2° | 109.5° |
| C13 | C20 | C18 | 118.8° | 120.0° |
| C20 | C13 | C14 | 119.6° | 120.0° |
| C13 | C20 | H4 | 120.6° | 120.0° |
| C20 | C18 | CL19 | 120.5° | 120.0° |
| C20 | C18 | C17 | 120.8° | 120.0° |
| C18 | C20 | H4 | 120.6° | 120.0° |
| CL19 | C18 | C17 | 118.8° | 120.0° |
| C13 | C14 | BR15 | 114.3° | 120.0° |
| C13 | C14 | C16 | 122.4° | 120.0° |
| C18 | C17 | C16 | 119.9° | 120.0° |
| C18 | C17 | H3 | 120.0° | 120.0° |
| BR15 | C14 | C16 | 123.4° | 120.0° |
| C14 | C16 | C17 | 118.6° | 120.0° |
| C14 | C16 | H25 | 120.7° | 120.0° |
| C16 | C17 | H3 | 120.1° | 120.0° |
| C17 | C16 | H25 | 120.7° | 120.0° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H5 | C21 | H6 | 109.5° | 109.6° |
| H7 | C22 | H8 | 109.5° | 109.4° |
| H10 | C28 | H29 | 109.5° | 110.5° |
| H12 | C02 | H13 | 109.5° | 115.6° |
| H14 | C04 | H15 | 109.5° | 109.2° |
| H16 | C05 | H17 | 109.5° | 109.7° |
| H19 | C07 | H20 | 109.4° | 109.2° |
| H21 | C09 | H22 | 109.5° | 109.5° |
| H23 | C12 | H24 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C28 | O27 | C26 | C30 | 173.9° | 162.8° |
| O27 | C28 | O29 | H10 | 119.6° | 118.7° |
| O27 | C28 | O29 | H29 | 119.6° | 118.6° |
| C28 | O27 | C26 | C25 | 6.6° | 17.2° |
| O27 | C28 | O29 | C25 | 10.6° | 27.0° |
| O27 | C28 | H10 | H29 | 121.2° | 122.8° |
| O27 | C26 | C30 | C25 | 179.5° | 180.0° |
| O27 | C26 | C30 | C31 | 179.3° | 179.7° |
| C26 | O27 | C28 | O29 | 10.7° | 27.0° |
| O27 | C26 | C25 | O29 | 0.1° | 0.1° |
| O27 | C26 | C25 | C24 | 180.0° | 180.0° |
| C26 | O27 | C28 | H10 | 130.3° | 145.7° |
| O27 | C26 | C30 | H26 | 0.7° | 0.0° |
| C26 | O27 | C28 | H29 | 108.9° | 91.6° |
| C26 | C30 | C31 | H26 | 180.0° | 179.8° |
| C26 | C30 | C31 | C23 | 0.5° | 0.3° |
| C30 | C26 | C25 | O29 | 179.5° | 180.0° |
| C30 | C26 | C25 | C24 | 0.4° | 0.0° |
| C26 | C30 | C31 | H27 | 179.5° | 180.0° |
| C31 | C30 | C26 | C25 | 0.2° | 0.2° |
| C30 | C31 | C23 | H27 | 180.0° | 179.7° |
| C30 | C31 | C23 | C24 | 0.3° | 0.0° |
| C30 | C31 | C23 | C03 | 178.4° | 180.0° |
| C28 | O29 | C25 | C26 | 6.7° | 17.2° |
| C28 | O29 | C25 | C24 | 173.4° | 162.8° |
| O29 | C28 | H10 | H29 | 121.2° | 122.7° |
| C26 | C25 | O29 | C24 | 179.9° | 179.9° |
| C26 | C25 | C24 | C23 | 0.6° | 0.3° |
| C26 | C25 | C24 | H9 | 179.4° | 180.0° |
| C25 | C26 | C30 | H26 | 179.8° | 180.0° |
| C31 | C23 | C24 | C25 | 0.3° | 0.2° |
| C31 | C23 | C24 | C03 | 178.8° | 179.9° |
| C31 | C23 | C03 | C02 | 132.4° | 68.7° |
| C31 | C23 | C03 | C01 | 83.2° | 0.0° |
| C31 | C23 | C03 | C04 | 129.3° | 149.9° |
| C31 | C23 | C24 | H9 | 179.7° | 180.0° |
| C23 | C31 | C30 | H26 | 179.5° | 179.9° |
| O29 | C25 | C24 | C23 | 179.2° | 179.8° |
| O29 | C25 | C24 | H9 | 0.7° | 0.1° |
| C25 | O29 | C28 | H10 | 130.1° | 145.7° |
| C25 | O29 | C28 | H29 | 109.0° | 91.6° |
| C25 | C24 | C23 | H9 | 180.0° | 179.7° |
| C25 | C24 | C23 | C03 | 179.1° | 179.7° |
| C24 | C23 | C03 | C02 | 48.8° | 111.4° |
| C24 | C23 | C03 | C01 | 98.0° | 179.9° |
| C24 | C23 | C03 | C04 | 49.5° | 30.0° |
| C24 | C23 | C31 | H27 | 179.7° | 179.8° |
| C23 | C03 | C02 | C01 | 142.7° | 107.3° |
| C23 | C03 | C02 | C04 | 107.1° | 141.0° |
| C23 | C03 | C01 | C04 | 146.5° | 148.1° |
| C23 | C03 | C01 | C07 | 168.3° | 143.5° |
| C23 | C03 | C04 | C05 | 157.3° | 127.9° |
| C03 | C23 | C24 | H9 | 0.9° | 0.0° |
| C23 | C03 | C01 | H11 | 41.6° | 1.2° |
| C23 | C03 | C02 | H12 | 33.0° | 145.0° |
| C23 | C03 | C02 | H13 | 107.7° | 0.2° |
| C23 | C03 | C04 | H14 | 81.9° | 111.9° |
| C23 | C03 | C04 | H15 | 36.5° | 7.7° |
| C03 | C23 | C31 | H27 | 1.6° | 0.3° |
| C02 | C03 | C01 | C04 | 86.1° | 104.5° |
| C03 | C02 | C01 | H12 | 109.6° | 107.0° |
| C03 | C02 | C01 | H13 | 109.6° | 107.8° |
| C02 | C03 | C01 | C07 | 131.3° | 109.1° |
| C02 | C03 | C04 | C05 | 107.3° | 90.2° |
| C02 | C03 | C01 | H11 | 102.0° | 106.2° |
| C03 | C02 | H12 | H13 | 144.4° | 145.6° |
| C02 | C03 | C04 | H14 | 13.6° | 30.0° |
| C02 | C03 | C04 | H15 | 131.9° | 149.6° |
| C03 | C01 | C07 | H11 | 125.6° | 145.2° |
| C01 | C03 | C04 | C05 | 46.4° | 20.9° |
| C03 | C01 | C07 | C06 | 55.4° | 21.5° |
| C01 | C03 | C04 | H14 | 74.5° | 99.3° |
| C01 | C03 | C04 | H15 | 167.2° | 141.1° |
| C03 | C01 | C07 | H19 | 64.5° | 99.8° |
| C03 | C01 | C07 | H20 | 175.4° | 140.8° |
| C04 | C03 | C01 | C07 | 45.2° | 4.6° |
| C03 | C04 | C05 | H14 | 120.8° | 120.3° |
| C03 | C04 | C05 | H15 | 120.8° | 120.2° |
| C03 | C04 | C05 | C06 | 56.5° | 54.5° |
| C04 | C03 | C01 | H11 | 171.9° | 149.3° |
| C04 | C03 | C02 | H12 | 140.1° | 4.0° |
| C04 | C03 | C02 | H13 | 0.7° | 140.8° |
| C03 | C04 | H14 | H15 | 117.5° | 119.7° |
| C03 | C04 | C05 | H16 | 176.1° | 174.3° |
| C03 | C04 | C05 | H17 | 63.2° | 65.2° |
| C02 | C01 | C07 | H11 | 165.2° | 144.8° |
| C02 | C01 | C07 | C06 | 13.8° | 48.5° |
| C01 | C02 | H12 | H13 | 144.4° | 145.9° |
| C02 | C01 | C07 | H19 | 133.7° | 169.8° |
| C02 | C01 | C07 | H20 | 106.1° | 70.7° |
| C01 | C07 | C06 | H19 | 119.9° | 120.8° |
| C01 | C07 | C06 | H20 | 120.0° | 119.7° |
| C01 | C07 | C06 | C05 | 65.6° | 55.1° |
| C01 | C07 | C06 | N08 | 171.6° | 174.6° |
| C07 | C01 | C02 | H12 | 157.7° | 2.4° |
| C07 | C01 | C02 | H13 | 16.9° | 142.7° |
| C01 | C07 | C06 | H18 | 51.0° | 64.8° |
| C01 | C07 | H19 | H20 | 120.2° | 119.5° |
| C04 | C05 | C06 | C07 | 64.9° | 74.8° |
| C04 | C05 | C06 | H16 | 119.7° | 119.8° |
| C04 | C05 | C06 | H17 | 119.6° | 119.7° |
| C04 | C05 | C06 | N08 | 174.3° | 165.9° |
| C05 | C04 | H14 | H15 | 117.5° | 119.6° |
| C04 | C05 | H16 | H17 | 121.0° | 120.4° |
| C04 | C05 | C06 | H18 | 51.4° | 45.5° |
| C07 | C06 | C05 | N08 | 120.8° | 119.4° |
| C07 | C06 | C05 | H18 | 116.3° | 120.3° |
| C07 | C06 | N08 | H18 | 118.4° | 121.0° |
| C07 | C06 | N08 | C09 | 67.3° | 176.3° |
| C07 | C06 | N08 | C22 | 173.3° | 59.8° |
| C06 | C07 | C01 | H11 | 179.0° | 166.7° |
| C07 | C06 | C05 | H16 | 175.4° | 165.4° |
| C07 | C06 | C05 | H17 | 54.7° | 44.9° |
| C06 | C07 | H19 | H20 | 120.2° | 118.9° |
| C05 | C06 | N08 | H18 | 121.1° | 120.4° |
| C05 | C06 | N08 | C09 | 172.2° | 65.0° |
| C05 | C06 | N08 | C22 | 52.7° | 58.8° |
| C06 | C05 | C04 | H14 | 64.3° | 65.8° |
| C06 | C05 | C04 | H15 | 177.3° | 174.7° |
| C06 | C05 | H16 | H17 | 121.1° | 120.5° |
| C05 | C06 | C07 | H19 | 54.3° | 65.7° |
| C05 | C06 | C07 | H20 | 174.4° | 174.9° |
| C06 | N08 | C09 | C22 | 118.4° | 123.9° |
| C06 | N08 | C09 | C10 | 177.0° | 176.8° |
| C06 | N08 | C22 | C21 | 141.6° | 176.8° |
| C06 | N08 | C22 | H7 | 21.7° | 56.8° |
| C06 | N08 | C22 | H8 | 98.5° | 63.2° |
| N08 | C06 | C05 | H16 | 54.6° | 46.1° |
| N08 | C06 | C05 | H17 | 66.1° | 74.5° |
| N08 | C06 | C07 | H19 | 68.4° | 53.7° |
| N08 | C06 | C07 | H20 | 51.7° | 65.7° |
| C06 | N08 | C09 | H21 | 56.5° | 63.2° |
| C06 | N08 | C09 | H22 | 62.6° | 56.8° |
| N08 | C09 | C10 | H21 | 120.5° | 120.0° |
| N08 | C09 | C10 | H22 | 120.5° | 120.0° |
| C09 | N08 | C22 | C21 | 26.9° | 59.3° |
| N08 | C09 | C10 | N11 | 34.2° | 58.4° |
| N08 | C09 | C10 | H1 | 85.9° | 61.6° |
| N08 | C09 | C10 | H2 | 154.3° | 178.3° |
| C09 | N08 | C22 | H7 | 92.9° | 179.3° |
| C09 | N08 | C22 | H8 | 146.8° | 60.8° |
| C09 | N08 | C06 | H18 | 51.0° | 55.4° |
| N08 | C09 | H21 | H22 | 118.5° | 120.0° |
| C22 | N08 | C09 | C10 | 64.7° | 59.3° |
| N08 | C22 | C21 | H7 | 119.9° | 120.0° |
| N08 | C22 | C21 | H8 | 119.9° | 120.0° |
| N08 | C22 | C21 | N11 | 38.4° | 58.4° |
| N08 | C22 | C21 | H5 | 82.0° | 178.3° |
| N08 | C22 | C21 | H6 | 158.8° | 61.6° |
| N08 | C22 | H7 | H8 | 120.4° | 120.0° |
| C22 | N08 | C06 | H18 | 68.4° | 179.2° |
| C22 | N08 | C09 | H21 | 174.9° | 60.7° |
| C22 | N08 | C09 | H22 | 55.8° | 179.3° |
| C09 | C10 | N11 | H1 | 120.1° | 120.0° |
| C09 | C10 | N11 | H2 | 120.1° | 120.0° |
| C09 | C10 | N11 | C21 | 30.1° | 59.3° |
| C09 | C10 | N11 | C12 | 145.3° | 64.5° |
| C09 | C10 | H1 | H2 | 119.8° | 120.1° |
| C10 | C09 | H21 | H22 | 118.5° | 120.1° |
| C22 | C21 | N11 | C10 | 68.3° | 59.3° |
| C22 | C21 | N11 | H5 | 120.4° | 120.0° |
| C22 | C21 | N11 | H6 | 120.4° | 120.0° |
| C22 | C21 | N11 | C12 | 177.0° | 64.5° |
| C22 | C21 | H5 | H6 | 118.7° | 120.1° |
| C21 | C22 | H7 | H8 | 120.4° | 120.0° |
| C10 | N11 | C21 | C12 | 114.7° | 123.8° |
| C10 | N11 | C12 | C13 | 91.7° | 170.0° |
| N11 | C10 | H1 | H2 | 119.8° | 120.0° |
| C10 | N11 | C21 | H5 | 52.1° | 179.2° |
| C10 | N11 | C21 | H6 | 171.3° | 60.7° |
| N11 | C10 | C09 | H21 | 154.6° | 61.6° |
| N11 | C10 | C09 | H22 | 86.3° | 178.4° |
| C10 | N11 | C12 | H23 | 29.1° | 69.9° |
| C10 | N11 | C12 | H24 | 147.6° | 50.0° |
| C21 | N11 | C12 | C13 | 151.8° | 66.3° |
| C21 | N11 | C10 | H1 | 150.1° | 60.7° |
| C21 | N11 | C10 | H2 | 90.0° | 179.3° |
| N11 | C21 | H5 | H6 | 118.7° | 120.0° |
| N11 | C21 | C22 | H7 | 158.2° | 178.4° |
| N11 | C21 | C22 | H8 | 81.5° | 61.6° |
| C21 | N11 | C12 | H23 | 87.4° | 53.8° |
| C21 | N11 | C12 | H24 | 31.1° | 173.8° |
| N11 | C12 | C13 | H23 | 120.7° | 120.1° |
| N11 | C12 | C13 | H24 | 120.8° | 119.9° |
| N11 | C12 | C13 | C20 | 11.3° | 100.3° |
| N11 | C12 | C13 | C14 | 168.9° | 80.0° |
| C12 | N11 | C10 | H1 | 94.6° | 175.5° |
| C12 | N11 | C10 | H2 | 25.2° | 55.5° |
| C12 | N11 | C21 | H5 | 62.6° | 55.4° |
| C12 | N11 | C21 | H6 | 56.6° | 175.5° |
| N11 | C12 | H23 | H24 | 117.8° | 120.0° |
| C12 | C13 | C20 | C14 | 179.7° | 179.7° |
| C12 | C13 | C20 | C18 | 179.5° | 179.7° |
| C12 | C13 | C14 | BR15 | 0.2° | 0.3° |
| C12 | C13 | C14 | C16 | 179.7° | 179.8° |
| C12 | C13 | C20 | H4 | 0.5° | 0.3° |
| C13 | C12 | H23 | H24 | 117.7° | 120.0° |
| C13 | C20 | C18 | H4 | 180.0° | 180.0° |
| C13 | C20 | C18 | CL19 | 179.7° | 180.0° |
| C13 | C20 | C18 | C17 | 0.3° | 0.0° |
| C20 | C13 | C14 | BR15 | 179.9° | 180.0° |
| C20 | C13 | C14 | C16 | 0.1° | 0.0° |
| C20 | C13 | C12 | H23 | 132.1° | 19.8° |
| C20 | C13 | C12 | H24 | 109.4° | 139.7° |
| C20 | C18 | CL19 | C17 | 180.0° | 180.0° |
| C18 | C20 | C13 | C14 | 0.2° | 0.0° |
| C20 | C18 | C17 | C16 | 0.2° | 0.0° |
| C20 | C18 | C17 | H3 | 179.8° | 180.0° |
| CL19 | C18 | C17 | C16 | 179.8° | 180.0° |
| CL19 | C18 | C17 | H3 | 0.2° | 0.0° |
| CL19 | C18 | C20 | H4 | 0.3° | 0.0° |
| C13 | C14 | BR15 | C16 | 179.9° | 180.0° |
| C13 | C14 | C16 | C17 | 0.0° | 0.1° |
| C14 | C13 | C20 | H4 | 179.8° | 180.0° |
| C14 | C13 | C12 | H23 | 48.2° | 160.0° |
| C14 | C13 | C12 | H24 | 70.3° | 40.0° |
| C13 | C14 | C16 | H25 | 179.9° | 180.0° |
| C18 | C17 | C16 | C14 | 0.1° | 0.1° |
| C18 | C17 | C16 | H3 | 180.0° | 179.9° |
| C17 | C18 | C20 | H4 | 179.7° | 180.0° |
| C18 | C17 | C16 | H25 | 180.0° | 180.0° |
| BR15 | C14 | C16 | C17 | 179.8° | 180.0° |
| BR15 | C14 | C16 | H25 | 0.2° | 0.0° |
| C14 | C16 | C17 | H25 | 180.0° | 179.9° |
| C14 | C16 | C17 | H3 | 179.9° | 180.0° |
| H1 | C10 | C09 | H21 | 34.6° | 178.5° |
| H1 | C10 | C09 | H22 | 153.6° | 58.4° |
| H2 | C10 | C09 | H21 | 85.3° | 58.4° |
| H2 | C10 | C09 | H22 | 33.8° | 61.7° |
| H3 | C17 | C16 | H25 | 0.0° | 0.1° |
| H5 | C21 | C22 | H7 | 37.9° | 61.7° |
| H5 | C21 | C22 | H8 | 158.1° | 58.3° |
| H6 | C21 | C22 | H7 | 81.4° | 58.5° |
| H6 | C21 | C22 | H8 | 38.9° | 178.5° |
| H11 | C01 | C02 | H12 | 7.7° | 146.8° |
| H11 | C01 | C02 | H13 | 148.5° | 1.6° |
| H11 | C01 | C07 | H19 | 61.1° | 45.4° |
| H11 | C01 | C07 | H20 | 59.0° | 74.1° |
| H14 | C04 | C05 | H16 | 55.3° | 54.0° |
| H14 | C04 | C05 | H17 | 176.0° | 174.5° |
| H15 | C04 | C05 | H16 | 63.1° | 65.5° |
| H15 | C04 | C05 | H17 | 57.6° | 55.0° |
| H16 | C05 | C06 | H18 | 68.3° | 74.3° |
| H17 | C05 | C06 | H18 | 171.0° | 165.2° |
| H18 | C06 | C07 | H19 | 170.9° | 174.3° |
| H18 | C06 | C07 | H20 | 69.0° | 54.9° |
| H26 | C30 | C31 | H27 | 0.5° | 0.2° |






