BZ9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C9 | sing | 1.37Å | 1.33Å | Aromatic |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| C4 | N2 | sing | 1.36Å | 1.34Å | Aromatic |
| C5 | C4 | doub | 1.40Å | 1.42Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | C6 | doub | 1.39Å | 1.43Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C10 | C17 | sing | 1.41Å | 1.39Å | Aromatic |
| C13 | C14 | doub | 1.39Å | 1.37Å | Aromatic |
| C13 | C12 | sing | 1.36Å | 1.39Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C15 | C10 | doub | 1.40Å | 1.39Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C17 | O33 | sing | 1.36Å | 1.37Å | |
| C17 | C18 | doub | 1.37Å | 1.39Å | Aromatic |
| C20 | N16 | sing | 1.40Å | 1.33Å | |
| C20 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | doub | 1.40Å | 1.41Å | Aromatic |
| C21 | C26 | sing | 1.40Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.39Å | 1.40Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C26 | N25 | doub | 1.32Å | 1.29Å | Aromatic |
| C28 | C21 | sing | 1.48Å | 1.38Å | Aromatic |
| C28 | N27 | sing | 1.33Å | 1.35Å | Aromatic |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| N34 | C35 | sing | 1.47Å | 1.48Å | |
| C32 | N34 | sing | 1.38Å | 1.35Å | |
| C32 | N27 | doub | 1.32Å | 1.33Å | Aromatic |
| N31 | C32 | sing | 1.33Å | 1.33Å | Aromatic |
| C30 | N31 | doub | 1.32Å | 1.30Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C29 | C28 | doub | 1.40Å | 1.42Å | Aromatic |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| N25 | C24 | sing | 1.32Å | 1.34Å | Aromatic |
| O33 | C26 | sing | 1.36Å | 1.31Å | |
| C18 | C36 | sing | 1.51Å | 1.54Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C36 | H36B | sing | 1.09Å | 1.10Å | |
| C19 | C18 | sing | 1.39Å | 1.39Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C14 | C15 | sing | 1.36Å | 1.41Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C12 | C11 | doub | 1.40Å | 1.40Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C11 | C10 | sing | 1.42Å | 1.40Å | Aromatic |
| C11 | C20 | sing | 1.41Å | 1.42Å | Aromatic |
| N16 | HN16 | sing | 0.97Å | 1.00Å | |
| C9 | N16 | sing | 1.38Å | 1.31Å | |
| N2 | C9 | doub | 1.31Å | 1.35Å | Aromatic |
| C3 | N1 | sing | 1.38Å | 1.32Å | Aromatic |
| C3 | C4 | sing | 1.40Å | 1.41Å | Aromatic |
| C35 | H221 | sing | 1.09Å | 1.10Å | |
| N34 | H231 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C9 | N1 | HN1 | 127.1° | 126.4° |
| N1 | C9 | N16 | 123.3° | 125.1° |
| N1 | C9 | N2 | 113.2° | 109.9° |
| C9 | N1 | C3 | 105.8° | 107.2° |
| HN1 | N1 | C3 | 127.1° | 126.4° |
| N2 | C4 | C5 | 131.4° | 133.4° |
| C4 | N2 | C9 | 104.9° | 109.6° |
| N2 | C4 | C3 | 107.8° | 107.1° |
| C4 | C5 | H5 | 120.2° | 120.1° |
| C4 | C5 | C6 | 119.7° | 119.8° |
| C5 | C4 | C3 | 120.8° | 119.5° |
| H5 | C5 | C6 | 120.1° | 120.1° |
| C5 | C6 | H6 | 121.4° | 119.8° |
| C5 | C6 | C7 | 117.2° | 120.5° |
| H6 | C6 | C7 | 121.4° | 119.7° |
| C6 | C7 | C8 | 123.2° | 120.5° |
| C6 | C7 | H7 | 118.4° | 119.8° |
| C8 | C7 | H7 | 118.4° | 119.8° |
| C7 | C8 | C3 | 118.6° | 119.8° |
| C7 | C8 | H8 | 120.7° | 120.1° |
| C3 | C8 | H8 | 120.7° | 120.1° |
| C8 | C3 | N1 | 131.3° | 133.9° |
| C8 | C3 | C4 | 120.4° | 120.0° |
| C17 | C10 | C15 | 119.3° | 121.2° |
| C10 | C17 | O33 | 118.4° | 120.1° |
| C10 | C17 | C18 | 121.4° | 119.9° |
| C17 | C10 | C11 | 119.7° | 119.5° |
| C14 | C13 | C12 | 122.7° | 121.0° |
| C14 | C13 | H13 | 118.6° | 119.5° |
| C13 | C14 | C15 | 116.9° | 120.9° |
| C13 | C14 | H14 | 121.6° | 119.6° |
| C12 | C13 | H13 | 118.7° | 119.5° |
| C13 | C12 | C11 | 120.3° | 119.6° |
| C13 | C12 | H12 | 119.8° | 120.2° |
| C10 | C15 | H15 | 119.4° | 120.2° |
| C10 | C15 | C14 | 121.3° | 119.7° |
| C15 | C10 | C11 | 120.9° | 119.4° |
| H15 | C15 | C14 | 119.3° | 120.1° |
| O33 | C17 | C18 | 119.9° | 120.1° |
| C17 | O33 | C26 | 129.9° | 118.0° |
| C17 | C18 | C36 | 121.1° | 119.5° |
| C17 | C18 | C19 | 119.0° | 121.0° |
| N16 | C20 | C19 | 113.3° | 120.3° |
| N16 | C20 | C11 | 125.8° | 120.2° |
| C20 | N16 | HN16 | 118.5° | 120.0° |
| C20 | N16 | C9 | 123.0° | 120.0° |
| C20 | C19 | C18 | 120.2° | 120.8° |
| C20 | C19 | H19 | 119.9° | 119.6° |
| C19 | C20 | C11 | 120.9° | 119.5° |
| C22 | C21 | C26 | 117.5° | 118.8° |
| C21 | C22 | C23 | 117.0° | 118.4° |
| C21 | C22 | H22 | 121.5° | 120.8° |
| C22 | C21 | C28 | 116.5° | 120.5° |
| C21 | C26 | N25 | 124.8° | 120.5° |
| C26 | C21 | C28 | 125.6° | 120.6° |
| C21 | C26 | O33 | 117.6° | 119.8° |
| C23 | C22 | H22 | 121.5° | 120.8° |
| C22 | C23 | C24 | 120.4° | 119.4° |
| C22 | C23 | H23 | 119.8° | 120.3° |
| H24 | C24 | C23 | 119.6° | 119.4° |
| H24 | C24 | N25 | 119.6° | 119.4° |
| C26 | N25 | C24 | 119.4° | 121.7° |
| N25 | C26 | O33 | 117.6° | 119.7° |
| C21 | C28 | N27 | 115.9° | 120.5° |
| C21 | C28 | C29 | 126.1° | 120.6° |
| C28 | N27 | C32 | 125.6° | 120.6° |
| N27 | C28 | C29 | 117.9° | 118.9° |
| H35 | C35 | H35A | 109.5° | 109.5° |
| H35 | C35 | N34 | 109.5° | 109.5° |
| H35 | C35 | H221 | 109.4° | 109.5° |
| H35A | C35 | N34 | 109.5° | 109.4° |
| H35A | C35 | H221 | 109.5° | 109.5° |
| C35 | N34 | C32 | 125.5° | 120.0° |
| N34 | C35 | H221 | 109.5° | 109.5° |
| C35 | N34 | H231 | 104.5° | 120.0° |
| N34 | C32 | N27 | 122.8° | 119.2° |
| N34 | C32 | N31 | 119.8° | 119.1° |
| C32 | N34 | H231 | 104.4° | 120.0° |
| N27 | C32 | N31 | 117.2° | 121.7° |
| C32 | N31 | C30 | 120.1° | 121.0° |
| N31 | C30 | C29 | 126.3° | 119.3° |
| N31 | C30 | H30 | 116.9° | 120.4° |
| C29 | C30 | H30 | 116.9° | 120.4° |
| C30 | C29 | C28 | 112.7° | 118.5° |
| C30 | C29 | H29 | 123.6° | 120.8° |
| C28 | C29 | H29 | 123.7° | 120.7° |
| C24 | C23 | H23 | 119.8° | 120.3° |
| C23 | C24 | N25 | 120.8° | 121.1° |
| C18 | C36 | H36 | 109.5° | 109.5° |
| C18 | C36 | H36A | 109.5° | 109.5° |
| C18 | C36 | H36B | 109.4° | 109.5° |
| C36 | C18 | C19 | 119.8° | 119.5° |
| H36 | C36 | H36A | 109.5° | 109.4° |
| H36 | C36 | H36B | 109.5° | 109.5° |
| H36A | C36 | H36B | 109.5° | 109.5° |
| C18 | C19 | H19 | 119.9° | 119.6° |
| C15 | C14 | H14 | 121.5° | 119.5° |
| C11 | C12 | H12 | 119.8° | 120.2° |
| C12 | C11 | C10 | 117.7° | 119.4° |
| C12 | C11 | C20 | 123.7° | 121.2° |
| C10 | C11 | C20 | 118.6° | 119.3° |
| HN16 | N16 | C9 | 118.5° | 120.0° |
| N16 | C9 | N2 | 123.5° | 125.1° |
| N1 | C3 | C4 | 108.3° | 106.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C9 | N1 | HN1 | C3 | 180.0° | 179.8° |
| N1 | C9 | N2 | C4 | 0.4° | 0.0° |
| C9 | N1 | C3 | C8 | 179.4° | 180.0° |
| N1 | C9 | N16 | C20 | 39.9° | 173.8° |
| N1 | C9 | N16 | HN16 | 140.1° | 6.2° |
| N1 | C9 | N16 | N2 | 179.1° | 180.0° |
| C9 | N1 | C3 | C4 | 1.2° | 0.3° |
| HN1 | N1 | C3 | C8 | 0.6° | 0.2° |
| HN1 | N1 | C9 | N16 | 1.8° | 0.0° |
| HN1 | N1 | C9 | N2 | 179.0° | 180.0° |
| HN1 | N1 | C3 | C4 | 178.9° | 179.9° |
| N2 | C4 | C5 | C3 | 178.3° | 179.7° |
| N2 | C4 | C5 | H5 | 0.6° | 0.1° |
| N2 | C4 | C5 | C6 | 179.4° | 180.0° |
| N2 | C4 | C3 | C8 | 179.4° | 179.9° |
| C4 | N2 | C9 | N16 | 178.8° | 180.0° |
| N2 | C4 | C3 | N1 | 1.0° | 0.3° |
| C4 | C5 | H5 | C6 | 180.0° | 180.0° |
| C4 | C5 | C6 | H6 | 179.1° | 179.9° |
| C4 | C5 | C6 | C7 | 0.9° | 0.0° |
| C5 | C4 | C3 | C8 | 0.8° | 0.1° |
| C5 | C4 | N2 | C9 | 178.1° | 180.0° |
| C5 | C4 | C3 | N1 | 177.7° | 179.9° |
| H5 | C5 | C6 | H6 | 0.9° | 0.0° |
| H5 | C5 | C6 | C7 | 179.1° | 179.9° |
| H5 | C5 | C4 | C3 | 177.7° | 179.8° |
| C5 | C6 | H6 | C7 | 180.0° | 179.9° |
| C5 | C6 | C7 | C8 | 2.0° | 0.5° |
| C5 | C6 | C7 | H7 | 177.9° | 180.0° |
| C6 | C5 | C4 | C3 | 2.3° | 0.3° |
| H6 | C6 | C7 | C8 | 178.0° | 179.6° |
| H6 | C6 | C7 | H7 | 2.1° | 0.0° |
| C6 | C7 | C8 | H7 | 180.0° | 179.6° |
| C6 | C7 | C8 | C3 | 3.6° | 0.6° |
| C6 | C7 | C8 | H8 | 176.4° | 179.9° |
| C7 | C8 | C3 | H8 | 180.0° | 179.5° |
| C7 | C8 | C3 | N1 | 179.9° | 179.4° |
| C7 | C8 | C3 | C4 | 2.1° | 0.3° |
| H7 | C7 | C8 | C3 | 176.4° | 179.8° |
| H7 | C7 | C8 | H8 | 3.6° | 0.3° |
| C8 | C3 | N1 | C4 | 178.2° | 179.7° |
| H8 | C8 | C3 | N1 | 0.2° | 0.1° |
| H8 | C8 | C3 | C4 | 177.9° | 179.8° |
| C17 | C10 | C15 | C11 | 179.9° | 179.7° |
| C17 | C10 | C15 | H15 | 0.8° | 0.1° |
| C10 | C17 | O33 | C18 | 174.2° | 180.0° |
| C10 | C17 | O33 | C26 | 114.3° | 90.0° |
| C10 | C17 | C18 | C36 | 179.9° | 180.0° |
| C10 | C17 | C18 | C19 | 1.7° | 0.0° |
| C17 | C10 | C15 | C14 | 179.2° | 179.9° |
| C17 | C10 | C11 | C12 | 179.6° | 180.0° |
| C17 | C10 | C11 | C20 | 1.8° | 0.5° |
| C14 | C13 | C12 | H13 | 180.0° | 179.8° |
| C13 | C14 | C15 | C10 | 2.9° | 0.0° |
| C13 | C14 | C15 | H15 | 177.1° | 180.0° |
| C13 | C14 | C15 | H14 | 180.0° | 179.9° |
| C14 | C13 | C12 | C11 | 4.3° | 0.3° |
| C14 | C13 | C12 | H12 | 175.7° | 180.0° |
| C12 | C13 | C14 | C15 | 4.6° | 0.3° |
| C12 | C13 | C14 | H14 | 175.4° | 179.8° |
| C13 | C12 | C11 | H12 | 180.0° | 179.7° |
| C13 | C12 | C11 | C10 | 2.1° | 0.0° |
| C13 | C12 | C11 | C20 | 176.4° | 179.5° |
| H13 | C13 | C14 | C15 | 175.4° | 179.9° |
| H13 | C13 | C14 | H14 | 4.6° | 0.0° |
| H13 | C13 | C12 | C11 | 175.7° | 179.9° |
| H13 | C13 | C12 | H12 | 4.3° | 0.2° |
| C10 | C15 | H15 | C14 | 180.0° | 180.0° |
| C15 | C10 | C17 | O33 | 7.1° | 0.1° |
| C15 | C10 | C17 | C18 | 178.8° | 179.9° |
| C10 | C15 | C14 | H14 | 177.2° | 180.0° |
| C15 | C10 | C11 | C12 | 0.5° | 0.3° |
| C15 | C10 | C11 | C20 | 178.1° | 179.8° |
| H15 | C15 | C14 | H14 | 2.9° | 0.0° |
| H15 | C15 | C10 | C11 | 179.1° | 179.8° |
| C17 | O33 | C26 | C21 | 177.6° | 180.0° |
| C17 | O33 | C26 | N25 | 0.2° | 0.0° |
| O33 | C17 | C18 | C36 | 5.9° | 0.0° |
| O33 | C17 | C18 | C19 | 175.7° | 180.0° |
| O33 | C17 | C10 | C11 | 173.0° | 179.7° |
| C17 | C18 | C19 | C20 | 3.8° | 0.0° |
| C18 | C17 | O33 | C26 | 71.5° | 90.0° |
| C17 | C18 | C36 | C19 | 178.4° | 180.0° |
| C17 | C18 | C36 | H36 | 123.8° | 90.0° |
| C17 | C18 | C36 | H36A | 116.2° | 150.0° |
| C17 | C18 | C36 | H36B | 3.8° | 30.0° |
| C17 | C18 | C19 | H19 | 176.2° | 179.7° |
| C18 | C17 | C10 | C11 | 1.1° | 0.3° |
| N16 | C20 | C19 | C11 | 179.4° | 179.8° |
| N16 | C20 | C19 | C18 | 176.2° | 180.0° |
| N16 | C20 | C19 | H19 | 3.8° | 0.2° |
| N16 | C20 | C11 | C12 | 2.6° | 0.2° |
| N16 | C20 | C11 | C10 | 178.9° | 179.7° |
| C20 | N16 | HN16 | C9 | 180.0° | 180.0° |
| C20 | N16 | C9 | N2 | 141.0° | 6.2° |
| C20 | C19 | C18 | C36 | 177.7° | 180.0° |
| C20 | C19 | C18 | H19 | 180.0° | 179.7° |
| C19 | C20 | C11 | C12 | 178.1° | 180.0° |
| C19 | C20 | C11 | C10 | 0.4° | 0.5° |
| C19 | C20 | N16 | HN16 | 51.9° | 171.3° |
| C19 | C20 | N16 | C9 | 128.1° | 8.7° |
| C22 | C21 | C26 | C28 | 173.2° | 179.7° |
| C21 | C22 | C23 | H22 | 180.0° | 179.9° |
| C22 | C21 | C26 | N25 | 2.1° | 0.0° |
| C22 | C21 | C28 | N27 | 23.0° | 180.0° |
| C22 | C21 | C28 | C29 | 152.5° | 0.2° |
| C21 | C22 | C23 | C24 | 1.8° | 0.0° |
| C21 | C22 | C23 | H23 | 178.2° | 179.9° |
| C22 | C21 | C26 | O33 | 175.5° | 180.0° |
| C26 | C21 | C22 | C23 | 3.2° | 0.0° |
| C26 | C21 | C22 | H22 | 176.8° | 180.0° |
| C21 | C26 | N25 | O33 | 177.6° | 180.0° |
| C26 | C21 | C28 | N27 | 163.7° | 0.3° |
| C26 | C21 | C28 | C29 | 20.8° | 179.4° |
| C21 | C26 | N25 | C24 | 0.7° | 0.0° |
| C22 | C23 | C24 | H24 | 179.1° | 179.9° |
| C23 | C22 | C21 | C28 | 177.0° | 179.7° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | N25 | 0.9° | 0.0° |
| H22 | C22 | C21 | C28 | 2.9° | 0.4° |
| H22 | C22 | C23 | C24 | 178.2° | 179.9° |
| H22 | C22 | C23 | H23 | 1.8° | 0.0° |
| H24 | C24 | N25 | C26 | 177.8° | 180.0° |
| H24 | C24 | C23 | N25 | 180.0° | 180.0° |
| H24 | C24 | C23 | H23 | 0.9° | 0.1° |
| N25 | C26 | C21 | C28 | 175.3° | 179.7° |
| C26 | N25 | C24 | C23 | 2.2° | 0.0° |
| C21 | C28 | N27 | C29 | 175.8° | 179.8° |
| C21 | C28 | N27 | C32 | 175.8° | 180.0° |
| C21 | C28 | C29 | C30 | 174.1° | 180.0° |
| C21 | C28 | C29 | H29 | 5.8° | 0.0° |
| C28 | C21 | C26 | O33 | 2.3° | 0.3° |
| C28 | N27 | C32 | N34 | 179.1° | 179.9° |
| C28 | N27 | C32 | N31 | 3.7° | 0.1° |
| N27 | C28 | C29 | C30 | 1.2° | 0.2° |
| N27 | C28 | C29 | H29 | 178.8° | 179.8° |
| H35 | C35 | H35A | N34 | 120.0° | 120.0° |
| H35 | C35 | H35A | H221 | 120.0° | 120.0° |
| H35 | C35 | N34 | H221 | 120.0° | 120.0° |
| H35 | C35 | N34 | C32 | 92.1° | 180.0° |
| H35 | C35 | N34 | H231 | 27.9° | 0.1° |
| H35A | C35 | N34 | H221 | 120.0° | 120.0° |
| H35A | C35 | N34 | C32 | 27.9° | 60.0° |
| H35A | C35 | N34 | H231 | 147.9° | 120.0° |
| C35 | N34 | C32 | H231 | 120.0° | 179.9° |
| C35 | N34 | C32 | N27 | 4.1° | 180.0° |
| C35 | N34 | C32 | N31 | 179.3° | 0.0° |
| N34 | C32 | N27 | N31 | 175.4° | 180.0° |
| N34 | C32 | N31 | C30 | 178.3° | 179.6° |
| C32 | N34 | C35 | H221 | 147.9° | 60.0° |
| N27 | C32 | N31 | C30 | 6.2° | 0.4° |
| C32 | N27 | C28 | C29 | 0.0° | 0.2° |
| N27 | C32 | N34 | H231 | 124.1° | 0.0° |
| C32 | N31 | C30 | C29 | 5.4° | 0.4° |
| C32 | N31 | C30 | H30 | 174.6° | 180.0° |
| N31 | C32 | N34 | H231 | 60.7° | 180.0° |
| N31 | C30 | C29 | H30 | 180.0° | 179.6° |
| N31 | C30 | C29 | C28 | 1.5° | 0.1° |
| N31 | C30 | C29 | H29 | 178.5° | 180.0° |
| C30 | C29 | C28 | H29 | 180.0° | 180.0° |
| H30 | C30 | C29 | C28 | 178.5° | 179.7° |
| H30 | C30 | C29 | H29 | 1.5° | 0.3° |
| H23 | C23 | C24 | N25 | 179.1° | 180.0° |
| C24 | N25 | C26 | O33 | 178.3° | 180.0° |
| C18 | C36 | H36 | H36A | 120.0° | 120.0° |
| C18 | C36 | H36 | H36B | 120.0° | 120.0° |
| C18 | C36 | H36A | H36B | 120.0° | 120.0° |
| C36 | C18 | C19 | H19 | 2.3° | 0.3° |
| H36 | C36 | H36A | H36B | 120.0° | 120.0° |
| H36 | C36 | C18 | C19 | 57.8° | 90.0° |
| H36A | C36 | C18 | C19 | 62.2° | 30.0° |
| H36B | C36 | C18 | C19 | 177.8° | 150.0° |
| C18 | C19 | C20 | C11 | 3.2° | 0.2° |
| H19 | C19 | C20 | C11 | 176.8° | 180.0° |
| C14 | C15 | C10 | C11 | 0.9° | 0.3° |
| C12 | C11 | C10 | C20 | 178.6° | 179.5° |
| H12 | C12 | C11 | C10 | 177.9° | 179.7° |
| H12 | C12 | C11 | C20 | 3.6° | 0.2° |
| C11 | C20 | N16 | HN16 | 127.4° | 8.5° |
| C11 | C20 | N16 | C9 | 52.6° | 171.5° |
| HN16 | N16 | C9 | N2 | 39.0° | 173.8° |
| N16 | C9 | N1 | C3 | 178.2° | 179.8° |
| N2 | C9 | N1 | C3 | 1.0° | 0.2° |
| C9 | N2 | C4 | C3 | 0.3° | 0.2° |
| H221 | C35 | N34 | H231 | 92.1° | 120.0° |
