ZRV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C21 | sing | 1.53Å | 1.48Å | |
| C22 | C20 | sing | 1.53Å | 1.48Å | |
| C21 | C20 | sing | 1.53Å | 1.48Å | |
| C20 | N2 | sing | 1.47Å | 1.46Å | |
| N2 | C19 | sing | 1.35Å | 1.34Å | |
| O1 | C19 | doub | 1.22Å | 1.23Å | |
| C19 | C18 | sing | 1.47Å | 1.50Å | |
| C28 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C18 | C17 | doub | 1.40Å | 1.40Å | Aromatic |
| C18 | C23 | sing | 1.40Å | 1.40Å | Aromatic |
| C17 | N1 | sing | 1.31Å | 1.31Å | Aromatic |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C24 | N3 | sing | 1.40Å | 1.43Å | |
| N3 | C23 | sing | 1.38Å | 1.37Å | |
| C23 | C13 | doub | 1.42Å | 1.42Å | Aromatic |
| N1 | C14 | doub | 1.34Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.42Å | 1.41Å | Aromatic |
| C13 | C12 | sing | 1.40Å | 1.41Å | Aromatic |
| C14 | C15 | sing | 1.40Å | 1.41Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.37Å | Aromatic |
| C15 | C16 | doub | 1.36Å | 1.35Å | Aromatic |
| C11 | C16 | sing | 1.41Å | 1.39Å | Aromatic |
| C11 | C8 | sing | 1.48Å | 1.49Å | |
| C16 | F1 | sing | 1.35Å | 1.35Å | |
| C9 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.37Å | Aromatic |
| F | C10 | sing | 1.35Å | 1.35Å | |
| C8 | C7 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C5 | doub | 1.40Å | 1.38Å | Aromatic |
| C7 | C6 | doub | 1.37Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.48Å | 1.49Å | |
| O | C4 | doub | 1.22Å | 1.23Å | |
| C4 | N | sing | 1.35Å | 1.33Å | |
| C1 | C2 | sing | 1.53Å | 1.51Å | |
| C1 | C | sing | 1.53Å | 1.50Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| N | C3 | sing | 1.47Å | 1.46Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| C15 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C27 | H16 | sing | 1.08Å | 1.08Å | |
| N2 | H17 | sing | 0.97Å | 1.00Å | |
| N3 | H18 | sing | 0.97Å | 1.00Å | |
| C29 | H19 | sing | 1.08Å | 1.08Å | |
| C28 | H20 | sing | 1.08Å | 1.08Å | |
| C26 | H21 | sing | 1.08Å | 1.08Å | |
| C25 | H22 | sing | 1.08Å | 1.08Å | |
| C17 | H23 | sing | 1.08Å | 1.08Å | |
| C6 | H24 | sing | 1.08Å | 1.08Å | |
| N | H25 | sing | 0.97Å | 1.00Å | |
| C | H26 | sing | 1.09Å | 1.10Å | |
| C | H27 | sing | 1.09Å | 1.10Å | |
| C | H28 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C22 | C20 | 59.9° | 60.0° |
| C22 | C21 | C20 | 59.8° | 60.0° |
| C22 | C21 | H12 | 120.1° | 117.5° |
| C22 | C21 | H13 | 120.0° | 117.6° |
| C21 | C22 | H14 | 120.0° | 117.5° |
| C21 | C22 | H15 | 120.0° | 117.5° |
| C22 | C20 | C21 | 60.3° | 60.1° |
| C22 | C20 | N2 | 117.9° | 117.5° |
| C22 | C20 | H11 | 116.0° | 117.5° |
| C20 | C22 | H14 | 120.0° | 117.5° |
| C20 | C22 | H15 | 120.0° | 117.5° |
| C21 | C20 | N2 | 118.7° | 117.5° |
| C21 | C20 | H11 | 116.0° | 117.5° |
| C20 | C21 | H12 | 120.0° | 117.5° |
| C20 | C21 | H13 | 120.1° | 117.6° |
| C20 | N2 | C19 | 122.0° | 120.0° |
| N2 | C20 | H11 | 116.3° | 115.6° |
| C20 | N2 | H17 | 119.0° | 120.0° |
| N2 | C19 | O1 | 122.0° | 120.0° |
| N2 | C19 | C18 | 116.7° | 120.0° |
| C19 | N2 | H17 | 119.0° | 120.0° |
| O1 | C19 | C18 | 120.9° | 120.0° |
| C19 | C18 | C17 | 121.2° | 120.4° |
| C19 | C18 | C23 | 120.8° | 120.4° |
| C27 | C28 | C29 | 120.4° | 120.1° |
| C28 | C27 | C26 | 119.7° | 120.2° |
| C28 | C27 | H16 | 120.1° | 119.9° |
| C27 | C28 | H20 | 119.8° | 119.9° |
| C28 | C29 | C24 | 120.2° | 119.9° |
| C28 | C29 | H19 | 119.9° | 120.0° |
| C29 | C28 | H20 | 119.8° | 120.0° |
| C27 | C26 | C25 | 120.4° | 120.1° |
| C26 | C27 | H16 | 120.1° | 119.9° |
| C27 | C26 | H21 | 119.8° | 120.0° |
| C29 | C24 | C25 | 119.1° | 119.8° |
| C29 | C24 | N3 | 122.3° | 120.1° |
| C24 | C29 | H19 | 119.9° | 120.0° |
| C17 | C18 | C23 | 118.0° | 119.2° |
| C18 | C17 | N1 | 125.1° | 121.7° |
| C18 | C17 | H23 | 117.4° | 119.2° |
| C18 | C23 | N3 | 120.0° | 121.1° |
| C18 | C23 | C13 | 119.1° | 117.8° |
| C17 | N1 | C14 | 117.4° | 122.1° |
| N1 | C17 | H23 | 117.4° | 119.2° |
| C26 | C25 | C24 | 120.1° | 119.9° |
| C25 | C26 | H21 | 119.8° | 119.9° |
| C26 | C25 | H22 | 119.9° | 120.0° |
| C25 | C24 | N3 | 118.6° | 120.1° |
| C24 | C25 | H22 | 119.9° | 120.1° |
| C24 | N3 | C23 | 126.7° | 120.0° |
| C24 | N3 | H18 | 116.7° | 120.0° |
| N3 | C23 | C13 | 120.7° | 121.1° |
| C23 | N3 | H18 | 116.6° | 120.0° |
| C23 | C13 | C14 | 117.4° | 119.0° |
| C23 | C13 | C12 | 123.4° | 121.1° |
| N1 | C14 | C13 | 122.9° | 120.2° |
| N1 | C14 | C15 | 118.0° | 120.5° |
| C14 | C13 | C12 | 119.1° | 119.9° |
| C13 | C14 | C15 | 119.1° | 119.3° |
| C13 | C12 | C11 | 120.6° | 119.5° |
| C13 | C12 | H9 | 119.7° | 120.3° |
| C14 | C15 | C16 | 119.3° | 120.1° |
| C14 | C15 | H10 | 120.4° | 119.9° |
| C12 | C11 | C16 | 118.7° | 120.3° |
| C12 | C11 | C8 | 118.1° | 119.8° |
| C11 | C12 | H9 | 119.7° | 120.3° |
| C15 | C16 | C11 | 123.1° | 120.8° |
| C15 | C16 | F1 | 119.1° | 119.6° |
| C16 | C15 | H10 | 120.4° | 119.9° |
| C16 | C11 | C8 | 123.1° | 119.8° |
| C11 | C16 | F1 | 117.8° | 119.6° |
| C11 | C8 | C9 | 120.5° | 120.0° |
| C11 | C8 | C7 | 121.1° | 120.0° |
| C8 | C9 | C10 | 119.6° | 119.9° |
| C9 | C8 | C7 | 118.0° | 120.1° |
| C8 | C9 | H8 | 120.2° | 120.0° |
| C9 | C10 | F | 118.5° | 120.1° |
| C9 | C10 | C5 | 123.5° | 119.8° |
| C10 | C9 | H8 | 120.2° | 120.1° |
| F | C10 | C5 | 118.1° | 120.1° |
| C8 | C7 | C6 | 121.3° | 120.3° |
| C8 | C7 | H7 | 119.3° | 119.9° |
| C10 | C5 | C6 | 116.8° | 119.9° |
| C10 | C5 | C4 | 119.5° | 120.1° |
| C7 | C6 | C5 | 120.7° | 120.1° |
| C6 | C7 | H7 | 119.4° | 119.8° |
| C7 | C6 | H24 | 119.7° | 119.9° |
| C6 | C5 | C4 | 123.7° | 120.0° |
| C5 | C6 | H24 | 119.7° | 120.0° |
| C5 | C4 | O | 119.9° | 120.0° |
| C5 | C4 | N | 118.2° | 120.0° |
| O | C4 | N | 121.8° | 120.0° |
| C4 | N | C3 | 121.1° | 120.0° |
| C4 | N | H25 | 119.5° | 120.0° |
| C2 | C1 | C | 112.4° | 109.5° |
| C1 | C2 | C3 | 113.4° | 109.5° |
| C2 | C1 | H1 | 108.7° | 109.5° |
| C2 | C1 | H2 | 108.7° | 109.5° |
| C1 | C2 | H3 | 108.5° | 109.5° |
| C1 | C2 | H4 | 108.5° | 109.5° |
| C | C1 | H1 | 108.7° | 109.4° |
| C | C1 | H2 | 108.7° | 109.4° |
| C1 | C | H26 | 109.5° | 109.4° |
| C1 | C | H27 | 109.5° | 109.5° |
| C1 | C | H28 | 109.5° | 109.4° |
| C2 | C3 | N | 112.3° | 109.5° |
| C3 | C2 | H3 | 108.5° | 109.4° |
| C3 | C2 | H4 | 108.5° | 109.5° |
| C2 | C3 | H5 | 108.8° | 109.5° |
| C2 | C3 | H6 | 108.8° | 109.5° |
| N | C3 | H5 | 108.8° | 109.4° |
| N | C3 | H6 | 108.8° | 109.5° |
| C3 | N | H25 | 119.4° | 120.0° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H3 | C2 | H4 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H12 | C21 | H13 | 109.4° | 115.5° |
| H14 | C22 | H15 | 109.5° | 115.6° |
| H26 | C | H27 | 109.4° | 109.5° |
| H26 | C | H28 | 109.5° | 109.5° |
| H27 | C | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C22 | C20 | H14 | 109.4° | 107.4° |
| C21 | C22 | C20 | H15 | 109.4° | 107.5° |
| C22 | C21 | C20 | H12 | 109.4° | 107.5° |
| C22 | C21 | C20 | H13 | 109.4° | 107.5° |
| C21 | C22 | C20 | N2 | 108.8° | 107.5° |
| C21 | C22 | C20 | H11 | 106.4° | 107.5° |
| C22 | C21 | H12 | H13 | 144.8° | 145.7° |
| C21 | C22 | H14 | H15 | 144.8° | 145.7° |
| C22 | C20 | N2 | H11 | 144.6° | 145.7° |
| C22 | C20 | N2 | C19 | 79.0° | 134.6° |
| C20 | C22 | H14 | H15 | 144.8° | 145.7° |
| C22 | C20 | N2 | H17 | 101.0° | 45.5° |
| C21 | C20 | N2 | H11 | 145.9° | 145.7° |
| C21 | C20 | N2 | C19 | 148.5° | 156.8° |
| C20 | C21 | H12 | H13 | 144.8° | 145.7° |
| C21 | C20 | N2 | H17 | 31.5° | 23.1° |
| C20 | N2 | C19 | H17 | 180.0° | 179.9° |
| C20 | N2 | C19 | O1 | 2.2° | 5.2° |
| C20 | N2 | C19 | C18 | 170.8° | 174.9° |
| N2 | C20 | C21 | H12 | 1.9° | 145.0° |
| N2 | C20 | C21 | H13 | 143.0° | 0.0° |
| N2 | C20 | C22 | H14 | 141.7° | 0.0° |
| N2 | C20 | C22 | H15 | 0.6° | 145.0° |
| N2 | C19 | O1 | C18 | 172.7° | 179.9° |
| N2 | C19 | C18 | C17 | 0.4° | 5.4° |
| N2 | C19 | C18 | C23 | 178.0° | 174.6° |
| C19 | N2 | C20 | H11 | 65.6° | 11.1° |
| O1 | C19 | C18 | C17 | 172.7° | 174.5° |
| O1 | C19 | C18 | C23 | 5.0° | 5.4° |
| O1 | C19 | N2 | H17 | 177.9° | 174.9° |
| C19 | C18 | C17 | C23 | 177.7° | 179.9° |
| C19 | C18 | C17 | N1 | 175.9° | 180.0° |
| C19 | C18 | C23 | N3 | 7.3° | 0.0° |
| C19 | C18 | C23 | C13 | 177.2° | 180.0° |
| C18 | C19 | N2 | H17 | 9.2° | 5.0° |
| C19 | C18 | C17 | H23 | 4.1° | 0.0° |
| C27 | C28 | C29 | H20 | 180.0° | 179.9° |
| C28 | C27 | C26 | H16 | 180.0° | 179.5° |
| C27 | C28 | C29 | C24 | 0.1° | 0.1° |
| C28 | C27 | C26 | C25 | 0.6° | 0.5° |
| C27 | C28 | C29 | H19 | 179.9° | 180.0° |
| C28 | C27 | C26 | H21 | 179.4° | 179.5° |
| C29 | C28 | C27 | C26 | 0.2° | 0.2° |
| C28 | C29 | C24 | H19 | 180.0° | 180.0° |
| C28 | C29 | C24 | C25 | 0.4° | 0.1° |
| C28 | C29 | C24 | N3 | 179.2° | 179.7° |
| C29 | C28 | C27 | H16 | 179.8° | 179.7° |
| C27 | C26 | C25 | H21 | 180.0° | 180.0° |
| C27 | C26 | C25 | C24 | 1.0° | 0.5° |
| C26 | C27 | C28 | H20 | 179.8° | 179.8° |
| C27 | C26 | C25 | H22 | 179.0° | 179.4° |
| C29 | C24 | C25 | C26 | 0.9° | 0.2° |
| C29 | C24 | C25 | N3 | 178.8° | 179.7° |
| C29 | C24 | N3 | C23 | 17.5° | 4.0° |
| C29 | C24 | N3 | H18 | 162.5° | 176.0° |
| C24 | C29 | C28 | H20 | 179.9° | 180.0° |
| C29 | C24 | C25 | H22 | 179.1° | 179.7° |
| C18 | C17 | N1 | H23 | 180.0° | 180.0° |
| C17 | C18 | C23 | N3 | 175.0° | 179.9° |
| C17 | C18 | C23 | C13 | 0.5° | 0.1° |
| C18 | C17 | N1 | C14 | 2.2° | 0.1° |
| C23 | C18 | C17 | N1 | 1.8° | 0.1° |
| C18 | C23 | N3 | C24 | 128.4° | 92.1° |
| C18 | C23 | N3 | C13 | 175.5° | 180.0° |
| C18 | C23 | C13 | C14 | 0.2° | 0.1° |
| C18 | C23 | C13 | C12 | 178.5° | 180.0° |
| C18 | C23 | N3 | H18 | 51.6° | 87.9° |
| C23 | C18 | C17 | H23 | 178.2° | 179.9° |
| C17 | N1 | C14 | C13 | 1.3° | 0.0° |
| C17 | N1 | C14 | C15 | 179.6° | 180.0° |
| C26 | C25 | C24 | H22 | 180.0° | 179.9° |
| C26 | C25 | C24 | N3 | 179.6° | 180.0° |
| C25 | C26 | C27 | H16 | 179.4° | 180.0° |
| C25 | C24 | N3 | C23 | 161.2° | 175.7° |
| C25 | C24 | N3 | H18 | 18.8° | 4.3° |
| C25 | C24 | C29 | H19 | 179.6° | 180.0° |
| C24 | C25 | C26 | H21 | 179.1° | 179.5° |
| C24 | N3 | C23 | H18 | 180.0° | 180.0° |
| C24 | N3 | C23 | C13 | 47.1° | 87.9° |
| N3 | C24 | C29 | H19 | 0.9° | 0.3° |
| N3 | C24 | C25 | H22 | 0.4° | 0.0° |
| N3 | C23 | C13 | C14 | 175.7° | 180.0° |
| N3 | C23 | C13 | C12 | 6.0° | 0.0° |
| C23 | C13 | C14 | N1 | 0.2° | 0.0° |
| C23 | C13 | C14 | C12 | 178.3° | 179.9° |
| C23 | C13 | C14 | C15 | 178.4° | 180.0° |
| C23 | C13 | C12 | C11 | 179.5° | 180.0° |
| C23 | C13 | C12 | H9 | 0.5° | 0.0° |
| C13 | C23 | N3 | H18 | 132.9° | 92.1° |
| N1 | C14 | C13 | C15 | 178.3° | 180.0° |
| N1 | C14 | C13 | C12 | 178.2° | 180.0° |
| N1 | C14 | C15 | C16 | 179.8° | 180.0° |
| N1 | C14 | C15 | H10 | 0.2° | 0.1° |
| C14 | N1 | C17 | H23 | 177.8° | 179.9° |
| C14 | C13 | C12 | C11 | 2.2° | 0.0° |
| C13 | C14 | C15 | C16 | 1.5° | 0.1° |
| C14 | C13 | C12 | H9 | 177.8° | 179.9° |
| C13 | C14 | C15 | H10 | 178.5° | 180.0° |
| C12 | C13 | C14 | C15 | 0.1° | 0.1° |
| C13 | C12 | C11 | H9 | 180.0° | 179.9° |
| C13 | C12 | C11 | C16 | 2.7° | 0.0° |
| C13 | C12 | C11 | C8 | 178.9° | 179.7° |
| C14 | C15 | C16 | H10 | 180.0° | 179.9° |
| C14 | C15 | C16 | C11 | 1.0° | 0.1° |
| C14 | C15 | C16 | F1 | 178.4° | 179.8° |
| C12 | C11 | C16 | C15 | 1.1° | 0.0° |
| C12 | C11 | C16 | C8 | 175.9° | 179.7° |
| C12 | C11 | C16 | F1 | 179.5° | 179.7° |
| C12 | C11 | C8 | C9 | 40.6° | 49.7° |
| C12 | C11 | C8 | C7 | 131.9° | 130.3° |
| C15 | C16 | C11 | F1 | 179.4° | 179.7° |
| C15 | C16 | C11 | C8 | 177.1° | 179.7° |
| C16 | C11 | C8 | C9 | 143.4° | 130.0° |
| C16 | C11 | C8 | C7 | 44.1° | 50.0° |
| C16 | C11 | C12 | H9 | 177.3° | 180.0° |
| C11 | C16 | C15 | H10 | 179.0° | 179.9° |
| C8 | C11 | C16 | F1 | 3.5° | 0.0° |
| C11 | C8 | C9 | C7 | 172.7° | 180.0° |
| C11 | C8 | C9 | C10 | 177.3° | 180.0° |
| C11 | C8 | C7 | C6 | 177.1° | 180.0° |
| C11 | C8 | C7 | H7 | 2.9° | 0.3° |
| C11 | C8 | C9 | H8 | 2.7° | 0.0° |
| C8 | C11 | C12 | H9 | 1.1° | 0.3° |
| F1 | C16 | C15 | H10 | 1.6° | 0.3° |
| C8 | C9 | C10 | H8 | 180.0° | 180.0° |
| C8 | C9 | C10 | F | 176.7° | 180.0° |
| C8 | C9 | C10 | C5 | 2.4° | 0.0° |
| C9 | C8 | C7 | C6 | 4.4° | 0.0° |
| C9 | C8 | C7 | H7 | 175.5° | 179.7° |
| C9 | C10 | F | C5 | 179.2° | 180.0° |
| C10 | C9 | C8 | C7 | 4.6° | 0.0° |
| C9 | C10 | C5 | C6 | 0.3° | 0.0° |
| C9 | C10 | C5 | C4 | 178.2° | 180.0° |
| F | C10 | C5 | C6 | 179.4° | 180.0° |
| F | C10 | C5 | C4 | 2.7° | 0.0° |
| F | C10 | C9 | H8 | 3.2° | 0.0° |
| C8 | C7 | C6 | H7 | 180.0° | 179.7° |
| C8 | C7 | C6 | C5 | 1.9° | 0.0° |
| C7 | C8 | C9 | H8 | 175.4° | 180.0° |
| C8 | C7 | C6 | H24 | 178.1° | 179.7° |
| C10 | C5 | C6 | C7 | 0.5° | 0.0° |
| C10 | C5 | C6 | C4 | 177.9° | 180.0° |
| C10 | C5 | C4 | O | 10.9° | 0.0° |
| C10 | C5 | C4 | N | 170.4° | 180.0° |
| C5 | C10 | C9 | H8 | 177.7° | 180.0° |
| C10 | C5 | C6 | H24 | 179.5° | 179.7° |
| C7 | C6 | C5 | H24 | 180.0° | 179.7° |
| C7 | C6 | C5 | C4 | 178.4° | 180.0° |
| C6 | C5 | C4 | O | 167.0° | 180.0° |
| C6 | C5 | C4 | N | 11.8° | 0.0° |
| C5 | C6 | C7 | H7 | 178.1° | 179.7° |
| C5 | C4 | O | N | 178.7° | 180.0° |
| C5 | C4 | N | C3 | 151.7° | 180.0° |
| C4 | C5 | C6 | H24 | 1.6° | 0.3° |
| C5 | C4 | N | H25 | 28.3° | 0.1° |
| O | C4 | N | C3 | 29.5° | 0.1° |
| O | C4 | N | H25 | 150.4° | 180.0° |
| C4 | N | C3 | C2 | 66.8° | 180.0° |
| C4 | N | C3 | H25 | 180.0° | 179.9° |
| C4 | N | C3 | H5 | 53.6° | 60.0° |
| C4 | N | C3 | H6 | 172.8° | 60.0° |
| C2 | C1 | C | H1 | 120.5° | 120.0° |
| C2 | C1 | C | H2 | 120.4° | 120.0° |
| C1 | C2 | C3 | H3 | 120.6° | 120.0° |
| C1 | C2 | C3 | H4 | 120.6° | 120.0° |
| C1 | C2 | C3 | N | 140.4° | 180.0° |
| C2 | C1 | H1 | H2 | 118.6° | 120.0° |
| C1 | C2 | H3 | H4 | 118.2° | 120.0° |
| C1 | C2 | C3 | H5 | 20.0° | 60.0° |
| C1 | C2 | C3 | H6 | 99.2° | 60.0° |
| C2 | C1 | C | H26 | 180.0° | 60.0° |
| C2 | C1 | C | H27 | 60.0° | 180.0° |
| C2 | C1 | C | H28 | 60.0° | 60.0° |
| C | C1 | C2 | C3 | 81.2° | 180.0° |
| C | C1 | H1 | H2 | 118.6° | 119.9° |
| C | C1 | C2 | H3 | 39.4° | 60.0° |
| C | C1 | C2 | H4 | 158.2° | 60.0° |
| C1 | C | H26 | H27 | 120.0° | 120.0° |
| C1 | C | H26 | H28 | 120.0° | 119.9° |
| C1 | C | H27 | H28 | 120.0° | 120.0° |
| C2 | C3 | N | H5 | 120.4° | 120.0° |
| C2 | C3 | N | H6 | 120.4° | 120.0° |
| C3 | C2 | C1 | H1 | 39.2° | 60.0° |
| C3 | C2 | C1 | H2 | 158.3° | 60.0° |
| C3 | C2 | H3 | H4 | 118.2° | 120.0° |
| C2 | C3 | H5 | H6 | 118.7° | 120.0° |
| C2 | C3 | N | H25 | 113.2° | 0.1° |
| N | C3 | C2 | H3 | 99.1° | 60.0° |
| N | C3 | C2 | H4 | 19.8° | 60.0° |
| N | C3 | H5 | H6 | 118.7° | 120.0° |
| H1 | C1 | C2 | H3 | 159.8° | 60.0° |
| H1 | C1 | C2 | H4 | 81.4° | 180.0° |
| H1 | C1 | C | H26 | 59.5° | 60.1° |
| H1 | C1 | C | H27 | 179.5° | 60.0° |
| H1 | C1 | C | H28 | 60.5° | 180.0° |
| H2 | C1 | C2 | H3 | 81.1° | 180.0° |
| H2 | C1 | C2 | H4 | 37.8° | 60.0° |
| H2 | C1 | C | H26 | 59.6° | NaN° |
| H2 | C1 | C | H27 | 60.4° | 60.0° |
| H2 | C1 | C | H28 | 179.6° | 60.1° |
| H3 | C2 | C3 | H5 | 140.5° | 180.0° |
| H3 | C2 | C3 | H6 | 21.3° | 60.0° |
| H4 | C2 | C3 | H5 | 100.6° | 60.0° |
| H4 | C2 | C3 | H6 | 140.2° | 180.0° |
| H5 | C3 | N | H25 | 126.4° | 120.1° |
| H6 | C3 | N | H25 | 7.2° | 119.9° |
| H7 | C7 | C6 | H24 | 1.9° | 0.0° |
| H11 | C20 | C21 | H12 | 144.1° | 0.0° |
| H11 | C20 | C21 | H13 | 3.0° | 145.0° |
| H11 | C20 | C22 | H14 | 3.0° | 145.0° |
| H11 | C20 | C22 | H15 | 144.1° | 0.0° |
| H11 | C20 | N2 | H17 | 114.3° | 168.8° |
| H12 | C21 | C22 | H14 | 141.2° | 145.0° |
| H12 | C21 | C22 | H15 | 0.0° | 0.0° |
| H13 | C21 | C22 | H14 | 0.0° | 0.0° |
| H13 | C21 | C22 | H15 | 141.1° | 145.0° |
| H16 | C27 | C28 | H20 | 0.2° | 0.3° |
| H16 | C27 | C26 | H21 | 0.6° | 0.0° |
| H19 | C29 | C28 | H20 | 0.1° | 0.0° |
| H21 | C26 | C25 | H22 | 1.0° | 0.6° |
| H26 | C | H27 | H28 | 120.0° | 120.0° |
