A1EQ7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O7 | C6 | sing | 1.43Å | 1.42Å | |
| C6 | C5 | sing | 1.53Å | 1.51Å | |
| C5 | N3 | sing | 1.47Å | 1.46Å | |
| C4 | N3 | sing | 1.46Å | 1.46Å | |
| N3 | C2 | sing | 1.35Å | 1.38Å | |
| O35 | C34 | doub | 1.22Å | 1.23Å | |
| C2 | O1 | doub | 1.22Å | 1.23Å | |
| C2 | C8 | sing | 1.48Å | 1.49Å | |
| C22 | C8 | doub | 1.38Å | 1.36Å | |
| C22 | N23 | sing | 1.36Å | 1.38Å | |
| C8 | C9 | sing | 1.41Å | 1.43Å | |
| C34 | N23 | sing | 1.35Å | 1.44Å | |
| C34 | C33 | sing | 1.39Å | 1.43Å | |
| N23 | C24 | sing | 1.37Å | 1.40Å | |
| C33 | C26 | doub | 1.39Å | 1.38Å | |
| C9 | C10 | doub | 1.36Å | 1.35Å | |
| C21 | C11 | sing | 1.53Å | 1.52Å | |
| C24 | C10 | sing | 1.41Å | 1.44Å | |
| C24 | N25 | doub | 1.33Å | 1.32Å | |
| C10 | C11 | sing | 1.51Å | 1.51Å | |
| C26 | N27 | sing | 1.38Å | 1.37Å | |
| C11 | N12 | sing | 1.47Å | 1.44Å | |
| N27 | C28 | sing | 1.47Å | 1.47Å | |
| N27 | C32 | sing | 1.47Å | 1.47Å | |
| C28 | C29 | sing | 1.53Å | 1.51Å | |
| N12 | C13 | sing | 1.40Å | 1.39Å | |
| C32 | C31 | sing | 1.53Å | 1.51Å | |
| C29 | O30 | sing | 1.43Å | 1.43Å | |
| C13 | C14 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C31 | O30 | sing | 1.43Å | 1.43Å | |
| C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | CL16 | sing | 1.74Å | 1.74Å | |
| C18 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | CL19 | sing | 1.74Å | 1.74Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| O7 | H8 | sing | 0.97Å | 0.95Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| N12 | H11 | sing | 0.97Å | 1.00Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C17 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | H14 | sing | 1.08Å | 1.08Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C21 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.08Å | 1.08Å | |
| C28 | H19 | sing | 1.09Å | 1.10Å | |
| C28 | H20 | sing | 1.09Å | 1.10Å | |
| C29 | H21 | sing | 1.09Å | 1.10Å | |
| C29 | H22 | sing | 1.09Å | 1.10Å | |
| C31 | H23 | sing | 1.09Å | 1.10Å | |
| C31 | H24 | sing | 1.09Å | 1.10Å | |
| C32 | H25 | sing | 1.09Å | 1.10Å | |
| C32 | H26 | sing | 1.09Å | 1.10Å | |
| C33 | H27 | sing | 1.08Å | 1.08Å | |
| C26 | N25 | sing | 1.33Å | 1.36Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O7 | C6 | C5 | 110.8° | 109.5° |
| O7 | C6 | H6 | 109.2° | 109.5° |
| O7 | C6 | H7 | 109.1° | 109.5° |
| C6 | O7 | H8 | 109.5° | 114.0° |
| C6 | C5 | N3 | 112.3° | 109.4° |
| C6 | C5 | H4 | 108.8° | 109.5° |
| C6 | C5 | H5 | 108.7° | 109.5° |
| C5 | C6 | H6 | 109.1° | 109.4° |
| C5 | C6 | H7 | 109.1° | 109.5° |
| C5 | N3 | C4 | 116.0° | 120.0° |
| C5 | N3 | C2 | 123.6° | 120.0° |
| N3 | C5 | H4 | 108.8° | 109.5° |
| N3 | C5 | H5 | 108.8° | 109.5° |
| C4 | N3 | C2 | 120.5° | 120.0° |
| N3 | C4 | H1 | 109.5° | 109.5° |
| N3 | C4 | H2 | 109.5° | 109.5° |
| N3 | C4 | H3 | 109.5° | 109.4° |
| N3 | C2 | O1 | 121.9° | 120.0° |
| N3 | C2 | C8 | 120.2° | 120.0° |
| O35 | C34 | N23 | 119.5° | 120.4° |
| O35 | C34 | C33 | 126.6° | 120.5° |
| O1 | C2 | C8 | 117.9° | 120.0° |
| C2 | C8 | C22 | 117.3° | 120.1° |
| C2 | C8 | C9 | 124.7° | 120.2° |
| C8 | C22 | N23 | 120.6° | 120.5° |
| C22 | C8 | C9 | 117.9° | 119.7° |
| C8 | C22 | H18 | 119.7° | 119.8° |
| C22 | N23 | C34 | 117.4° | 119.3° |
| C22 | N23 | C24 | 122.1° | 120.6° |
| N23 | C22 | H18 | 119.7° | 119.7° |
| C8 | C9 | C10 | 123.2° | 119.5° |
| C8 | C9 | H9 | 118.4° | 120.3° |
| N23 | C34 | C33 | 113.8° | 119.1° |
| C34 | N23 | C24 | 120.5° | 120.1° |
| C34 | C33 | C26 | 121.4° | 118.9° |
| C34 | C33 | H27 | 119.3° | 120.5° |
| N23 | C24 | C10 | 118.2° | 120.0° |
| N23 | C24 | N25 | 123.4° | 120.8° |
| C33 | C26 | N27 | 123.0° | 120.1° |
| C26 | C33 | H27 | 119.3° | 120.6° |
| C33 | C26 | N25 | 122.4° | 119.8° |
| C9 | C10 | C24 | 117.9° | 119.7° |
| C9 | C10 | C11 | 122.9° | 120.1° |
| C10 | C9 | H9 | 118.4° | 120.3° |
| C21 | C11 | C10 | 113.0° | 109.5° |
| C21 | C11 | N12 | 110.7° | 109.5° |
| C21 | C11 | H10 | 106.8° | 109.5° |
| C11 | C21 | H15 | 109.5° | 109.5° |
| C11 | C21 | H16 | 109.5° | 109.4° |
| C11 | C21 | H17 | 109.5° | 109.5° |
| C10 | C24 | N25 | 118.3° | 119.2° |
| C24 | C10 | C11 | 119.1° | 120.1° |
| C24 | N25 | C26 | 118.3° | 121.3° |
| C10 | C11 | N12 | 111.3° | 109.4° |
| C10 | C11 | H10 | 107.0° | 109.5° |
| C26 | N27 | C28 | 122.9° | 121.0° |
| C26 | N27 | C32 | 121.7° | 121.0° |
| N27 | C26 | N25 | 114.5° | 120.1° |
| C11 | N12 | C13 | 124.6° | 120.0° |
| N12 | C11 | H10 | 107.8° | 109.5° |
| C11 | N12 | H11 | 105.6° | 120.0° |
| C28 | N27 | C32 | 111.9° | 118.0° |
| N27 | C28 | C29 | 109.7° | 108.4° |
| N27 | C28 | H19 | 109.4° | 109.7° |
| N27 | C28 | H20 | 109.4° | 109.7° |
| N27 | C32 | C31 | 109.7° | 108.6° |
| N27 | C32 | H25 | 109.4° | 109.7° |
| N27 | C32 | H26 | 109.4° | 109.7° |
| C28 | C29 | O30 | 111.6° | 109.3° |
| C29 | C28 | H19 | 109.4° | 109.7° |
| C29 | C28 | H20 | 109.4° | 109.7° |
| C28 | C29 | H21 | 108.9° | 109.5° |
| C28 | C29 | H22 | 108.9° | 109.5° |
| N12 | C13 | C14 | 118.7° | 120.0° |
| N12 | C13 | C20 | 121.2° | 120.1° |
| C13 | N12 | H11 | 105.6° | 120.0° |
| C32 | C31 | O30 | 111.6° | 109.3° |
| C32 | C31 | H23 | 109.0° | 109.6° |
| C32 | C31 | H24 | 108.9° | 109.4° |
| C31 | C32 | H25 | 109.4° | 109.6° |
| C31 | C32 | H26 | 109.4° | 109.5° |
| C29 | O30 | C31 | 110.0° | 114.1° |
| O30 | C29 | H21 | 108.9° | 109.5° |
| O30 | C29 | H22 | 108.9° | 109.5° |
| C14 | C13 | C20 | 120.1° | 119.9° |
| C13 | C14 | C15 | 118.9° | 119.9° |
| C13 | C14 | H12 | 120.6° | 120.1° |
| C13 | C20 | C18 | 118.9° | 119.9° |
| C13 | C20 | H14 | 120.6° | 120.0° |
| O30 | C31 | H23 | 108.9° | 109.5° |
| O30 | C31 | H24 | 109.0° | 109.5° |
| C14 | C15 | C17 | 122.1° | 120.0° |
| C14 | C15 | CL16 | 118.9° | 119.9° |
| C15 | C14 | H12 | 120.5° | 120.0° |
| C20 | C18 | C17 | 122.2° | 120.1° |
| C20 | C18 | CL19 | 118.9° | 119.9° |
| C18 | C20 | H14 | 120.5° | 120.1° |
| C17 | C15 | CL16 | 118.9° | 120.0° |
| C15 | C17 | C18 | 117.7° | 120.1° |
| C15 | C17 | H13 | 121.1° | 119.9° |
| C17 | C18 | CL19 | 119.0° | 120.0° |
| C18 | C17 | H13 | 121.1° | 119.9° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H1 | C4 | H3 | 109.4° | 109.5° |
| H2 | C4 | H3 | 109.5° | 109.5° |
| H4 | C5 | H5 | 109.5° | 109.5° |
| H6 | C6 | H7 | 109.5° | 109.5° |
| H15 | C21 | H16 | 109.5° | 109.5° |
| H15 | C21 | H17 | 109.5° | 109.4° |
| H16 | C21 | H17 | 109.5° | 109.5° |
| H19 | C28 | H20 | 109.5° | 109.7° |
| H21 | C29 | H22 | 109.5° | 109.5° |
| H23 | C31 | H24 | 109.5° | 109.5° |
| H25 | C32 | H26 | 109.4° | 109.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O7 | C6 | C5 | H6 | 120.2° | 120.0° |
| O7 | C6 | C5 | H7 | 120.2° | 120.1° |
| O7 | C6 | C5 | N3 | 58.8° | 65.0° |
| O7 | C6 | C5 | H4 | 61.6° | 55.0° |
| O7 | C6 | C5 | H5 | 179.2° | 175.0° |
| O7 | C6 | H6 | H7 | 119.4° | 120.1° |
| C6 | C5 | N3 | H4 | 120.4° | 120.0° |
| C6 | C5 | N3 | H5 | 120.4° | 120.0° |
| C6 | C5 | N3 | C4 | 78.5° | 90.0° |
| C6 | C5 | N3 | C2 | 100.2° | 90.0° |
| C6 | C5 | H4 | H5 | 118.7° | 120.0° |
| C5 | C6 | H6 | H7 | 119.4° | 120.0° |
| C5 | C6 | O7 | H8 | 180.0° | 180.0° |
| C5 | N3 | C4 | C2 | 178.8° | 180.0° |
| C5 | N3 | C2 | O1 | 164.0° | 4.9° |
| C5 | N3 | C2 | C8 | 15.3° | 174.9° |
| C5 | N3 | C4 | H1 | 180.0° | 88.0° |
| C5 | N3 | C4 | H2 | 60.0° | 32.0° |
| C5 | N3 | C4 | H3 | 60.0° | 152.0° |
| N3 | C5 | H4 | H5 | 118.7° | 120.0° |
| N3 | C5 | C6 | H6 | 179.0° | 175.0° |
| N3 | C5 | C6 | H7 | 61.4° | 55.0° |
| C4 | N3 | C2 | O1 | 14.7° | 175.1° |
| C4 | N3 | C2 | C8 | 166.0° | 5.1° |
| N3 | C4 | H1 | H2 | 120.0° | 120.0° |
| N3 | C4 | H1 | H3 | 120.0° | 120.0° |
| N3 | C4 | H2 | H3 | 120.0° | 119.9° |
| C4 | N3 | C5 | H4 | 161.0° | 30.0° |
| C4 | N3 | C5 | H5 | 41.9° | 150.0° |
| N3 | C2 | O1 | C8 | 179.3° | 179.8° |
| N3 | C2 | C8 | C22 | 128.2° | 79.7° |
| N3 | C2 | C8 | C9 | 55.4° | 100.6° |
| C2 | N3 | C4 | H1 | 1.2° | 92.0° |
| C2 | N3 | C4 | H2 | 121.2° | 148.0° |
| C2 | N3 | C4 | H3 | 118.8° | 28.0° |
| C2 | N3 | C5 | H4 | 20.2° | 150.0° |
| C2 | N3 | C5 | H5 | 139.4° | 30.0° |
| O35 | C34 | N23 | C22 | 6.9° | 0.0° |
| O35 | C34 | N23 | C33 | 178.4° | 180.0° |
| O35 | C34 | N23 | C24 | 175.5° | 180.0° |
| O35 | C34 | C33 | C26 | 177.3° | 180.0° |
| O35 | C34 | C33 | H27 | 2.7° | 0.0° |
| O1 | C2 | C8 | C22 | 51.1° | 100.5° |
| O1 | C2 | C8 | C9 | 125.3° | 79.2° |
| C2 | C8 | C22 | C9 | 176.7° | 179.7° |
| C2 | C8 | C22 | N23 | 175.6° | 180.0° |
| C2 | C8 | C9 | C10 | 176.2° | 180.0° |
| C2 | C8 | C9 | H9 | 3.8° | 0.0° |
| C2 | C8 | C22 | H18 | 4.4° | 0.0° |
| C8 | C22 | N23 | H18 | 180.0° | 180.0° |
| C8 | C22 | N23 | C34 | 177.3° | 180.0° |
| C8 | C22 | N23 | C24 | 0.2° | 0.1° |
| C22 | C8 | C9 | C10 | 0.2° | 0.3° |
| C22 | C8 | C9 | H9 | 179.8° | 179.7° |
| N23 | C22 | C8 | C9 | 1.0° | 0.2° |
| C22 | N23 | C34 | C24 | 177.5° | 180.0° |
| C22 | N23 | C34 | C33 | 174.7° | 180.0° |
| C22 | N23 | C24 | C10 | 1.4° | 0.3° |
| C22 | N23 | C24 | N25 | 175.1° | 180.0° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C8 | C9 | C10 | C24 | 1.5° | 0.0° |
| C8 | C9 | C10 | C11 | 173.8° | 180.0° |
| C9 | C8 | C22 | H18 | 179.0° | 179.7° |
| N23 | C34 | C33 | C26 | 0.9° | 0.0° |
| C34 | N23 | C24 | C10 | 178.8° | 179.7° |
| C34 | N23 | C24 | N25 | 2.4° | 0.0° |
| C34 | N23 | C22 | H18 | 2.7° | 0.0° |
| N23 | C34 | C33 | H27 | 179.1° | 180.0° |
| C33 | C34 | N23 | C24 | 2.9° | 0.0° |
| C34 | C33 | C26 | H27 | 180.0° | 180.0° |
| C34 | C33 | C26 | N27 | 176.5° | 180.0° |
| C34 | C33 | C26 | N25 | 1.7° | 0.0° |
| N23 | C24 | C10 | C9 | 2.2° | 0.3° |
| N23 | C24 | C10 | N25 | 176.7° | 179.7° |
| N23 | C24 | C10 | C11 | 173.2° | 179.7° |
| C24 | N23 | C22 | H18 | 179.8° | 180.0° |
| N23 | C24 | N25 | C26 | 0.4° | 0.0° |
| C33 | C26 | N25 | C24 | 2.4° | 0.0° |
| C33 | C26 | N27 | N25 | 178.3° | 180.0° |
| C33 | C26 | N27 | C28 | 0.5° | 32.2° |
| C33 | C26 | N27 | C32 | 157.6° | 148.0° |
| C9 | C10 | C11 | C21 | 84.6° | 115.0° |
| C9 | C10 | C24 | C11 | 175.4° | 179.9° |
| C9 | C10 | C24 | N25 | 174.5° | 180.0° |
| C9 | C10 | C11 | N12 | 40.6° | 125.0° |
| C9 | C10 | C11 | H10 | 158.1° | 5.0° |
| C21 | C11 | C10 | C24 | 90.5° | 65.0° |
| C21 | C11 | C10 | N12 | 125.2° | 120.0° |
| C21 | C11 | C10 | H10 | 117.3° | 120.0° |
| C21 | C11 | N12 | H10 | 116.4° | 120.0° |
| C21 | C11 | N12 | C13 | 155.9° | 155.0° |
| C21 | C11 | N12 | H11 | 33.9° | 24.9° |
| C11 | C21 | H15 | H16 | 120.0° | 120.0° |
| C11 | C21 | H15 | H17 | 120.0° | 120.0° |
| C11 | C21 | H16 | H17 | 120.0° | 120.0° |
| C24 | C10 | C11 | N12 | 144.2° | 55.0° |
| C24 | C10 | C9 | H9 | 178.5° | 180.0° |
| C24 | C10 | C11 | H10 | 26.7° | 175.0° |
| C10 | C24 | N25 | C26 | 176.1° | 179.7° |
| N25 | C24 | C10 | C11 | 10.1° | 0.1° |
| C24 | N25 | C26 | N27 | 175.9° | 179.9° |
| C10 | C11 | N12 | H10 | 117.1° | 120.0° |
| C10 | C11 | N12 | C13 | 77.6° | 85.0° |
| C11 | C10 | C9 | H9 | 6.2° | 0.1° |
| C10 | C11 | N12 | H11 | 160.4° | 95.1° |
| C10 | C11 | C21 | H15 | 180.0° | 60.0° |
| C10 | C11 | C21 | H16 | 60.0° | 180.0° |
| C10 | C11 | C21 | H17 | 60.0° | 60.0° |
| C26 | N27 | C28 | C32 | 159.1° | 179.7° |
| C26 | N27 | C28 | C29 | 105.4° | 129.4° |
| C26 | N27 | C32 | C31 | 105.4° | 129.5° |
| C26 | N27 | C28 | H19 | 14.6° | 110.8° |
| C26 | N27 | C28 | H20 | 134.6° | 9.7° |
| C26 | N27 | C32 | H25 | 134.5° | 9.7° |
| C26 | N27 | C32 | H26 | 14.6° | 110.8° |
| N27 | C26 | C33 | H27 | 3.5° | 0.1° |
| C11 | N12 | C13 | H11 | 122.1° | 179.9° |
| C11 | N12 | C13 | C14 | 169.9° | 180.0° |
| C11 | N12 | C13 | C20 | 11.0° | 0.3° |
| N12 | C11 | C21 | H15 | 54.4° | 60.0° |
| N12 | C11 | C21 | H16 | 174.4° | 60.1° |
| N12 | C11 | C21 | H17 | 65.6° | 180.0° |
| N27 | C28 | C29 | H19 | 120.1° | 119.7° |
| N27 | C28 | C29 | H20 | 120.0° | 119.7° |
| C28 | N27 | C32 | C31 | 54.0° | 50.3° |
| N27 | C28 | C29 | O30 | 56.2° | 52.3° |
| N27 | C28 | H19 | H20 | 119.9° | 120.5° |
| N27 | C28 | C29 | H21 | 64.0° | 172.2° |
| N27 | C28 | C29 | H22 | 176.6° | 67.7° |
| C28 | N27 | C32 | H25 | 66.1° | 170.0° |
| C28 | N27 | C32 | H26 | 174.0° | 69.4° |
| C28 | N27 | C26 | N25 | 177.8° | 147.8° |
| C32 | N27 | C28 | C29 | 53.7° | 50.3° |
| N27 | C32 | C31 | H25 | 120.0° | 119.8° |
| N27 | C32 | C31 | H26 | 120.0° | 119.8° |
| N27 | C32 | C31 | O30 | 56.8° | 52.1° |
| C32 | N27 | C28 | H19 | 173.7° | 69.4° |
| C32 | N27 | C28 | H20 | 66.3° | 170.0° |
| N27 | C32 | C31 | H23 | 177.2° | 172.2° |
| N27 | C32 | C31 | H24 | 63.5° | 67.8° |
| N27 | C32 | H25 | H26 | 119.9° | 120.6° |
| C32 | N27 | C26 | N25 | 20.7° | 31.9° |
| C28 | C29 | O30 | H21 | 120.3° | 119.9° |
| C28 | C29 | O30 | H22 | 120.3° | 120.0° |
| C28 | C29 | O30 | C31 | 59.4° | 62.6° |
| C29 | C28 | H19 | H20 | 119.9° | 120.6° |
| C28 | C29 | H21 | H22 | 119.0° | 120.1° |
| N12 | C13 | C14 | C20 | 179.1° | 179.7° |
| N12 | C13 | C14 | C15 | 179.0° | 180.0° |
| N12 | C13 | C20 | C18 | 179.0° | 179.7° |
| C13 | N12 | C11 | H10 | 39.5° | 34.9° |
| N12 | C13 | C14 | H12 | 1.0° | 0.1° |
| N12 | C13 | C20 | H14 | 1.0° | 0.0° |
| C32 | C31 | O30 | C29 | 59.7° | 62.4° |
| C32 | C31 | O30 | H23 | 120.3° | 120.1° |
| C32 | C31 | O30 | H24 | 120.3° | 119.9° |
| C32 | C31 | H23 | H24 | 119.0° | 120.0° |
| C31 | C32 | H25 | H26 | 119.9° | 120.3° |
| O30 | C29 | C28 | H19 | 176.3° | 67.4° |
| O30 | C29 | C28 | H20 | 63.8° | 172.0° |
| O30 | C29 | H21 | H22 | 119.0° | 120.1° |
| C29 | O30 | C31 | H23 | 179.9° | 177.5° |
| C29 | O30 | C31 | H24 | 60.6° | 57.4° |
| C13 | C14 | C15 | H12 | 180.0° | 180.0° |
| C14 | C13 | C20 | C18 | 0.1° | 0.6° |
| C13 | C14 | C15 | C17 | 0.0° | 0.0° |
| C13 | C14 | C15 | CL16 | 178.8° | 180.0° |
| C14 | C13 | N12 | H11 | 68.0° | 0.1° |
| C14 | C13 | C20 | H14 | 179.9° | 179.7° |
| C20 | C13 | C14 | C15 | 0.0° | 0.3° |
| C13 | C20 | C18 | H14 | 180.0° | 179.7° |
| C13 | C20 | C18 | C17 | 0.0° | 0.6° |
| C13 | C20 | C18 | CL19 | 179.6° | 179.7° |
| C20 | C13 | N12 | H11 | 111.1° | 179.8° |
| C20 | C13 | C14 | H12 | 180.0° | 179.7° |
| C31 | O30 | C29 | H21 | 60.9° | 177.5° |
| C31 | O30 | C29 | H22 | 179.8° | 57.4° |
| O30 | C31 | H23 | H24 | 119.0° | 120.1° |
| O30 | C31 | C32 | H25 | 63.2° | 171.9° |
| O30 | C31 | C32 | H26 | 176.9° | 67.7° |
| C14 | C15 | C17 | CL16 | 178.8° | 180.0° |
| C14 | C15 | C17 | C18 | 0.0° | 0.0° |
| C14 | C15 | C17 | H13 | 180.0° | 180.0° |
| C20 | C18 | C17 | C15 | 0.0° | 0.3° |
| C20 | C18 | C17 | CL19 | 179.6° | 179.7° |
| C20 | C18 | C17 | H13 | 180.0° | 179.7° |
| C15 | C17 | C18 | H13 | 180.0° | 180.0° |
| C15 | C17 | C18 | CL19 | 179.6° | 180.0° |
| C17 | C15 | C14 | H12 | 180.0° | 180.0° |
| CL16 | C15 | C17 | C18 | 178.8° | 180.0° |
| CL16 | C15 | C14 | H12 | 1.2° | 0.0° |
| CL16 | C15 | C17 | H13 | 1.2° | 0.0° |
| C17 | C18 | C20 | H14 | 179.9° | 179.7° |
| CL19 | C18 | C17 | H13 | 0.4° | 0.0° |
| CL19 | C18 | C20 | H14 | 0.4° | 0.0° |
| H1 | C4 | H2 | H3 | 120.0° | 120.0° |
| H4 | C5 | C6 | H6 | 58.6° | 65.0° |
| H4 | C5 | C6 | H7 | 178.2° | 175.0° |
| H5 | C5 | C6 | H6 | 60.6° | 55.0° |
| H5 | C5 | C6 | H7 | 59.1° | 64.9° |
| H6 | C6 | O7 | H8 | 59.9° | 60.1° |
| H7 | C6 | O7 | H8 | 59.8° | 60.0° |
| H10 | C11 | N12 | H11 | 82.6° | 145.0° |
| H10 | C11 | C21 | H15 | 62.6° | NaN° |
| H10 | C11 | C21 | H16 | 57.4° | 60.0° |
| H10 | C11 | C21 | H17 | 177.4° | 60.0° |
| H15 | C21 | H16 | H17 | 120.0° | 120.0° |
| H19 | C28 | C29 | H21 | 56.0° | 52.5° |
| H19 | C28 | C29 | H22 | 63.4° | 172.6° |
| H20 | C28 | C29 | H21 | 175.9° | 68.1° |
| H20 | C28 | C29 | H22 | 56.5° | 52.1° |
| H23 | C31 | C32 | H25 | 57.1° | 68.1° |
| H23 | C31 | C32 | H26 | 62.8° | 52.3° |
| H24 | C31 | C32 | H25 | 176.5° | 52.0° |
| H24 | C31 | C32 | H26 | 56.5° | 172.4° |
| H27 | C33 | C26 | N25 | 178.3° | 180.0° |
