NY3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | N2 | doub | 1.31Å | 1.34Å | Aromatic |
| C20 | N3 | sing | 1.35Å | 1.33Å | Aromatic |
| N2 | C19 | sing | 1.34Å | 1.37Å | Aromatic |
| N3 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | C18 | doub | 1.36Å | 1.37Å | Aromatic |
| C18 | C17 | sing | 1.48Å | 1.47Å | |
| C21 | C17 | doub | 1.40Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C17 | C16 | sing | 1.40Å | 1.39Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.51Å | 1.51Å | |
| C14 | N1 | sing | 1.46Å | 1.46Å | |
| N1 | C13 | sing | 1.35Å | 1.34Å | |
| C13 | O2 | doub | 1.22Å | 1.21Å | |
| C13 | O1 | sing | 1.35Å | 1.36Å | |
| O1 | C12 | sing | 1.45Å | 1.45Å | |
| O3 | C9 | doub | 1.22Å | 1.21Å | |
| C1 | C | sing | 1.53Å | 1.49Å | |
| C1 | N | sing | 1.46Å | 1.46Å | |
| O | C9 | sing | 1.34Å | 1.37Å | |
| O | C8 | sing | 1.35Å | 1.37Å | |
| C9 | C10 | sing | 1.41Å | 1.49Å | |
| C26 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C26 | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.53Å | 1.51Å | |
| C8 | C7 | sing | 1.41Å | 1.40Å | Aromatic |
| N | C4 | sing | 1.39Å | 1.44Å | |
| N | C2 | sing | 1.46Å | 1.51Å | |
| C4 | C5 | doub | 1.40Å | 1.41Å | Aromatic |
| C10 | C11 | sing | 1.51Å | 1.50Å | |
| C10 | C24 | doub | 1.36Å | 1.37Å | |
| C2 | C3 | sing | 1.53Å | 1.48Å | |
| C7 | C24 | sing | 1.46Å | 1.48Å | |
| C7 | C6 | doub | 1.40Å | 1.40Å | Aromatic |
| C24 | C25 | sing | 1.51Å | 1.50Å | |
| C5 | C6 | sing | 1.36Å | 1.39Å | Aromatic |
| C26 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å | |
| C | H9 | sing | 1.09Å | 1.10Å | |
| C | H10 | sing | 1.09Å | 1.10Å | |
| C | H11 | sing | 1.09Å | 1.10Å | |
| C25 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C6 | H15 | sing | 1.08Å | 1.08Å | |
| C5 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| N1 | H21 | sing | 0.97Å | 1.00Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.08Å | 1.08Å | |
| C22 | H25 | sing | 1.08Å | 1.08Å | |
| C21 | H26 | sing | 1.08Å | 1.08Å | |
| C16 | H27 | sing | 1.08Å | 1.08Å | |
| N3 | H28 | sing | 0.97Å | 1.00Å | |
| C20 | H29 | sing | 1.08Å | 1.08Å | |
| C19 | H31 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C20 | N3 | 112.0° | 109.0° |
| C20 | N2 | C19 | 107.1° | 109.5° |
| N2 | C20 | H29 | 124.0° | 125.5° |
| C20 | N3 | C18 | 105.1° | 107.1° |
| C20 | N3 | H28 | 127.4° | 126.5° |
| N3 | C20 | H29 | 124.0° | 125.5° |
| N2 | C19 | C18 | 106.6° | 107.9° |
| N2 | C19 | H31 | 126.7° | 126.0° |
| N3 | C18 | C19 | 109.2° | 106.5° |
| N3 | C18 | C17 | 121.9° | 126.7° |
| C18 | N3 | H28 | 127.4° | 126.5° |
| C19 | C18 | C17 | 128.9° | 126.7° |
| C18 | C19 | H31 | 126.7° | 126.1° |
| C18 | C17 | C21 | 120.8° | 120.1° |
| C18 | C17 | C16 | 119.8° | 120.1° |
| C17 | C21 | C22 | 120.3° | 119.8° |
| C21 | C17 | C16 | 119.3° | 119.7° |
| C17 | C21 | H26 | 119.8° | 120.1° |
| C21 | C22 | C23 | 119.9° | 120.1° |
| C21 | C22 | H25 | 120.1° | 119.9° |
| C22 | C21 | H26 | 119.8° | 120.1° |
| C17 | C16 | C15 | 120.8° | 119.8° |
| C17 | C16 | H27 | 119.6° | 120.1° |
| C22 | C23 | C15 | 120.6° | 120.3° |
| C22 | C23 | H24 | 119.7° | 119.8° |
| C23 | C22 | H25 | 120.0° | 120.0° |
| C16 | C15 | C23 | 119.1° | 120.1° |
| C16 | C15 | C14 | 119.3° | 119.9° |
| C15 | C16 | H27 | 119.6° | 120.1° |
| C23 | C15 | C14 | 121.6° | 120.0° |
| C15 | C23 | H24 | 119.7° | 119.8° |
| C15 | C14 | N1 | 112.5° | 109.5° |
| C15 | C14 | H22 | 108.7° | 109.4° |
| C15 | C14 | H23 | 108.7° | 109.5° |
| C14 | N1 | C13 | 123.2° | 120.0° |
| C14 | N1 | H21 | 118.4° | 120.0° |
| N1 | C14 | H22 | 108.7° | 109.5° |
| N1 | C14 | H23 | 108.7° | 109.4° |
| N1 | C13 | O2 | 124.2° | 120.0° |
| N1 | C13 | O1 | 110.7° | 120.0° |
| C13 | N1 | H21 | 118.4° | 120.0° |
| O2 | C13 | O1 | 125.0° | 120.0° |
| C13 | O1 | C12 | 118.3° | 117.0° |
| O1 | C12 | C11 | 106.9° | 109.4° |
| O1 | C12 | H19 | 110.1° | 109.6° |
| O1 | C12 | H20 | 110.1° | 109.5° |
| O3 | C9 | O | 115.6° | 119.1° |
| O3 | C9 | C10 | 126.4° | 119.1° |
| C | C1 | N | 112.4° | 109.5° |
| C | C1 | H7 | 108.7° | 109.5° |
| C | C1 | H8 | 108.8° | 109.5° |
| C1 | C | H9 | 109.5° | 109.5° |
| C1 | C | H10 | 109.5° | 109.4° |
| C1 | C | H11 | 109.5° | 109.5° |
| C1 | N | C4 | 122.1° | 120.0° |
| C1 | N | C2 | 115.6° | 120.0° |
| N | C1 | H7 | 108.8° | 109.4° |
| N | C1 | H8 | 108.7° | 109.5° |
| C9 | O | C8 | 122.2° | 121.4° |
| O | C9 | C10 | 117.8° | 121.8° |
| O | C8 | C26 | 115.8° | 120.8° |
| O | C8 | C7 | 121.5° | 119.8° |
| C9 | C10 | C11 | 115.8° | 120.1° |
| C9 | C10 | C24 | 121.6° | 119.8° |
| C8 | C26 | C4 | 120.1° | 119.8° |
| C26 | C8 | C7 | 122.7° | 119.4° |
| C8 | C26 | H1 | 119.9° | 120.1° |
| C26 | C4 | N | 121.3° | 119.8° |
| C26 | C4 | C5 | 117.7° | 120.4° |
| C4 | C26 | H1 | 120.0° | 120.1° |
| C12 | C11 | C10 | 105.7° | 109.4° |
| C12 | C11 | H17 | 110.4° | 109.5° |
| C12 | C11 | H18 | 110.4° | 109.4° |
| C11 | C12 | H19 | 110.1° | 109.5° |
| C11 | C12 | H20 | 110.1° | 109.4° |
| C8 | C7 | C24 | 119.4° | 119.0° |
| C8 | C7 | C6 | 116.8° | 120.1° |
| C4 | N | C2 | 122.2° | 120.0° |
| N | C4 | C5 | 121.0° | 119.8° |
| N | C2 | C3 | 110.8° | 109.5° |
| N | C2 | H2 | 109.2° | 109.5° |
| N | C2 | H3 | 109.2° | 109.5° |
| C4 | C5 | C6 | 121.4° | 120.5° |
| C4 | C5 | H16 | 119.3° | 119.8° |
| C11 | C10 | C24 | 122.6° | 120.1° |
| C10 | C11 | H17 | 110.4° | 109.5° |
| C10 | C11 | H18 | 110.4° | 109.4° |
| C10 | C24 | C7 | 117.4° | 118.2° |
| C10 | C24 | C25 | 123.6° | 120.9° |
| C3 | C2 | H2 | 109.1° | 109.4° |
| C3 | C2 | H3 | 109.1° | 109.5° |
| C2 | C3 | H4 | 109.5° | 109.5° |
| C2 | C3 | H5 | 109.5° | 109.5° |
| C2 | C3 | H6 | 109.5° | 109.5° |
| C24 | C7 | C6 | 123.7° | 121.0° |
| C7 | C24 | C25 | 118.9° | 120.9° |
| C7 | C6 | C5 | 121.2° | 119.8° |
| C7 | C6 | H15 | 119.4° | 120.1° |
| C24 | C25 | H12 | 109.5° | 109.5° |
| C24 | C25 | H13 | 109.5° | 109.5° |
| C24 | C25 | H14 | 109.4° | 109.5° |
| C5 | C6 | H15 | 119.4° | 120.1° |
| C6 | C5 | H16 | 119.3° | 119.8° |
| H2 | C2 | H3 | 109.5° | 109.4° |
| H4 | C3 | H5 | 109.5° | 109.4° |
| H4 | C3 | H6 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H7 | C1 | H8 | 109.5° | 109.4° |
| H9 | C | H10 | 109.5° | 109.5° |
| H9 | C | H11 | 109.4° | 109.5° |
| H10 | C | H11 | 109.5° | 109.5° |
| H12 | C25 | H13 | 109.4° | 109.5° |
| H12 | C25 | H14 | 109.5° | 109.5° |
| H13 | C25 | H14 | 109.5° | 109.5° |
| H17 | C11 | H18 | 109.5° | 109.6° |
| H19 | C12 | H20 | 109.5° | 109.5° |
| H22 | C14 | H23 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C20 | N3 | H29 | 180.0° | 179.7° |
| N2 | C20 | N3 | C18 | 0.1° | 0.0° |
| C20 | N2 | C19 | C18 | 0.2° | 0.4° |
| N2 | C20 | N3 | H28 | 179.9° | 180.0° |
| C20 | N2 | C19 | H31 | 179.8° | 179.9° |
| N3 | C20 | N2 | C19 | 0.2° | 0.3° |
| C20 | N3 | C18 | H28 | 180.0° | 179.9° |
| C20 | N3 | C18 | C19 | 0.0° | 0.2° |
| C20 | N3 | C18 | C17 | 178.1° | 180.0° |
| N2 | C19 | C18 | N3 | 0.1° | 0.4° |
| N2 | C19 | C18 | H31 | 180.0° | 179.7° |
| N2 | C19 | C18 | C17 | 178.0° | 179.8° |
| C19 | N2 | C20 | H29 | 179.9° | 179.9° |
| N3 | C18 | C19 | C17 | 177.9° | 179.8° |
| N3 | C18 | C17 | C21 | 33.0° | 0.1° |
| N3 | C18 | C17 | C16 | 143.2° | 179.8° |
| C18 | N3 | C20 | H29 | 179.9° | 179.7° |
| N3 | C18 | C19 | H31 | 179.9° | 180.0° |
| C19 | C18 | C17 | C21 | 149.3° | 179.7° |
| C19 | C18 | C17 | C16 | 34.5° | 0.0° |
| C19 | C18 | N3 | H28 | 180.0° | 179.7° |
| C18 | C17 | C21 | C16 | 176.2° | 179.7° |
| C18 | C17 | C21 | C22 | 174.5° | 179.9° |
| C18 | C17 | C16 | C15 | 174.6° | 179.8° |
| C18 | C17 | C21 | H26 | 5.5° | 0.3° |
| C18 | C17 | C16 | H27 | 5.4° | 0.3° |
| C17 | C18 | N3 | H28 | 1.9° | 0.1° |
| C17 | C18 | C19 | H31 | 2.0° | 0.1° |
| C17 | C21 | C22 | H26 | 180.0° | 179.8° |
| C17 | C21 | C22 | C23 | 1.1° | 0.0° |
| C21 | C17 | C16 | C15 | 1.6° | 0.6° |
| C17 | C21 | C22 | H25 | 178.9° | 180.0° |
| C21 | C17 | C16 | H27 | 178.4° | 179.9° |
| C22 | C21 | C17 | C16 | 1.7° | 0.3° |
| C21 | C22 | C23 | H25 | 180.0° | 180.0° |
| C21 | C22 | C23 | C15 | 0.3° | 0.0° |
| C21 | C22 | C23 | H24 | 179.7° | 180.0° |
| C17 | C16 | C15 | H27 | 180.0° | 179.5° |
| C17 | C16 | C15 | C23 | 0.9° | 0.6° |
| C17 | C16 | C15 | C14 | 176.6° | 179.7° |
| C16 | C17 | C21 | H26 | 178.3° | 179.9° |
| C22 | C23 | C15 | C16 | 0.2° | 0.3° |
| C22 | C23 | C15 | H24 | 180.0° | 180.0° |
| C22 | C23 | C15 | C14 | 177.2° | 180.0° |
| C23 | C22 | C21 | H26 | 178.9° | 179.8° |
| C16 | C15 | C23 | C14 | 177.4° | 179.7° |
| C16 | C15 | C14 | N1 | 98.4° | 90.2° |
| C16 | C15 | C14 | H22 | 22.1° | 149.7° |
| C16 | C15 | C14 | H23 | 141.2° | 29.7° |
| C16 | C15 | C23 | H24 | 179.9° | 179.7° |
| C23 | C15 | C14 | N1 | 79.0° | 90.0° |
| C23 | C15 | C14 | H22 | 160.5° | 30.0° |
| C23 | C15 | C14 | H23 | 41.4° | 150.0° |
| C15 | C23 | C22 | H25 | 179.7° | 180.0° |
| C23 | C15 | C16 | H27 | 179.2° | 179.9° |
| C15 | C14 | N1 | H22 | 120.4° | 120.0° |
| C15 | C14 | N1 | H23 | 120.4° | 120.0° |
| C15 | C14 | N1 | C13 | 155.3° | 180.0° |
| C15 | C14 | N1 | H21 | 24.7° | 0.0° |
| C15 | C14 | H22 | H23 | 118.6° | 120.0° |
| C14 | C15 | C23 | H24 | 2.7° | 0.0° |
| C14 | C15 | C16 | H27 | 3.4° | 0.2° |
| C14 | N1 | C13 | H21 | 180.0° | 180.0° |
| C14 | N1 | C13 | O2 | 174.2° | 0.1° |
| C14 | N1 | C13 | O1 | 1.8° | 180.0° |
| N1 | C14 | H22 | H23 | 118.6° | 120.0° |
| N1 | C13 | O2 | O1 | 175.4° | 179.9° |
| N1 | C13 | O1 | C12 | 173.9° | 180.0° |
| C13 | N1 | C14 | H22 | 84.3° | 60.0° |
| C13 | N1 | C14 | H23 | 34.9° | 60.0° |
| O2 | C13 | O1 | C12 | 10.1° | 0.1° |
| O2 | C13 | N1 | H21 | 5.8° | 180.0° |
| C13 | O1 | C12 | C11 | 172.6° | 180.0° |
| C13 | O1 | C12 | H19 | 67.8° | 60.0° |
| C13 | O1 | C12 | H20 | 53.0° | 60.1° |
| O1 | C13 | N1 | H21 | 178.2° | 0.0° |
| O1 | C12 | C11 | H19 | 119.6° | 120.1° |
| O1 | C12 | C11 | H20 | 119.6° | 120.0° |
| O1 | C12 | C11 | C10 | 63.1° | 180.0° |
| O1 | C12 | C11 | H17 | 56.3° | 60.0° |
| O1 | C12 | C11 | H18 | 177.5° | 60.1° |
| O1 | C12 | H19 | H20 | 121.2° | 120.1° |
| O3 | C9 | O | C10 | 175.6° | 179.7° |
| O3 | C9 | O | C8 | 173.0° | 180.0° |
| O3 | C9 | C10 | C11 | 9.3° | 0.0° |
| O3 | C9 | C10 | C24 | 172.2° | 180.0° |
| C | C1 | N | H7 | 120.4° | 120.0° |
| C | C1 | N | H8 | 120.4° | 120.0° |
| C | C1 | N | C4 | 74.4° | 90.0° |
| C | C1 | N | C2 | 108.2° | 90.0° |
| C | C1 | H7 | H8 | 118.7° | 120.0° |
| C1 | C | H9 | H10 | 120.0° | 120.0° |
| C1 | C | H9 | H11 | 120.0° | 120.0° |
| C1 | C | H10 | H11 | 120.0° | 120.0° |
| C1 | N | C4 | C26 | 1.3° | 0.1° |
| C1 | N | C4 | C2 | 177.1° | 180.0° |
| C1 | N | C4 | C5 | 178.2° | 180.0° |
| C1 | N | C2 | C3 | 91.4° | 90.0° |
| C1 | N | C2 | H2 | 148.4° | 30.0° |
| C1 | N | C2 | H3 | 28.8° | 150.0° |
| N | C1 | H7 | H8 | 118.7° | 120.0° |
| N | C1 | C | H9 | 180.0° | 180.0° |
| N | C1 | C | H10 | 60.0° | 60.0° |
| N | C1 | C | H11 | 60.0° | 60.0° |
| C9 | O | C8 | C26 | 178.8° | 179.9° |
| C9 | O | C8 | C7 | 0.7° | 0.0° |
| O | C9 | C10 | C11 | 175.6° | 179.7° |
| O | C9 | C10 | C24 | 2.8° | 0.3° |
| C8 | O | C9 | C10 | 2.6° | 0.3° |
| O | C8 | C26 | C7 | 178.0° | 179.9° |
| O | C8 | C26 | C4 | 177.3° | 180.0° |
| O | C8 | C7 | C24 | 1.1° | 0.3° |
| O | C8 | C7 | C6 | 178.8° | 180.0° |
| O | C8 | C26 | H1 | 2.7° | 0.1° |
| C9 | C10 | C11 | C12 | 95.1° | 85.0° |
| C9 | C10 | C11 | C24 | 178.4° | 180.0° |
| C9 | C10 | C24 | C7 | 1.1° | 0.0° |
| C9 | C10 | C24 | C25 | 179.0° | 180.0° |
| C9 | C10 | C11 | H17 | 24.3° | 34.9° |
| C9 | C10 | C11 | H18 | 145.5° | 155.0° |
| C8 | C26 | C4 | H1 | 180.0° | 179.9° |
| C8 | C26 | C4 | N | 177.5° | 180.0° |
| C8 | C26 | C4 | C5 | 0.6° | 0.1° |
| C26 | C8 | C7 | C24 | 176.8° | 179.8° |
| C26 | C8 | C7 | C6 | 0.9° | 0.1° |
| C4 | C26 | C8 | C7 | 0.7° | 0.1° |
| C26 | C4 | N | C5 | 176.9° | 180.0° |
| C26 | C4 | N | C2 | 175.8° | 180.0° |
| C26 | C4 | C5 | C6 | 1.2° | 0.0° |
| C26 | C4 | C5 | H16 | 178.8° | 180.0° |
| C12 | C11 | C10 | H17 | 119.4° | 120.0° |
| C12 | C11 | C10 | H18 | 119.4° | 119.9° |
| C12 | C11 | C10 | C24 | 86.5° | 95.0° |
| C12 | C11 | H17 | H18 | 121.7° | 120.0° |
| C11 | C12 | H19 | H20 | 121.2° | 119.9° |
| C8 | C7 | C24 | C10 | 0.8° | 0.3° |
| C8 | C7 | C24 | C6 | 177.5° | 179.7° |
| C8 | C7 | C24 | C25 | 179.1° | 179.8° |
| C8 | C7 | C6 | C5 | 2.7° | 0.1° |
| C7 | C8 | C26 | H1 | 179.3° | 180.0° |
| C8 | C7 | C6 | H15 | 177.3° | 180.0° |
| C4 | N | C2 | C3 | 91.3° | 90.0° |
| N | C4 | C5 | C6 | 175.8° | 180.0° |
| N | C4 | C26 | H1 | 2.4° | 0.1° |
| C4 | N | C2 | H2 | 28.9° | 150.0° |
| C4 | N | C2 | H3 | 148.5° | 30.0° |
| C4 | N | C1 | H7 | 46.0° | 150.0° |
| C4 | N | C1 | H8 | 165.1° | 30.1° |
| N | C4 | C5 | H16 | 4.2° | 0.0° |
| C2 | N | C4 | C5 | 1.0° | 0.0° |
| N | C2 | C3 | H2 | 120.2° | 120.0° |
| N | C2 | C3 | H3 | 120.2° | 120.1° |
| N | C2 | H2 | H3 | 119.4° | 120.0° |
| N | C2 | C3 | H4 | 180.0° | 180.0° |
| N | C2 | C3 | H5 | 60.0° | 60.0° |
| N | C2 | C3 | H6 | 60.0° | 60.0° |
| C2 | N | C1 | H7 | 131.3° | 30.0° |
| C2 | N | C1 | H8 | 12.2° | 150.0° |
| C4 | C5 | C6 | C7 | 2.9° | 0.0° |
| C4 | C5 | C6 | H16 | 180.0° | 180.0° |
| C5 | C4 | C26 | H1 | 179.4° | 180.0° |
| C4 | C5 | C6 | H15 | 177.1° | 180.0° |
| C11 | C10 | C24 | C7 | 177.2° | 180.0° |
| C11 | C10 | C24 | C25 | 2.7° | 0.0° |
| C10 | C11 | H17 | H18 | 121.7° | 120.0° |
| C10 | C11 | C12 | H19 | 177.3° | 59.9° |
| C10 | C11 | C12 | H20 | 56.5° | 60.0° |
| C10 | C24 | C7 | C25 | 179.9° | 180.0° |
| C10 | C24 | C7 | C6 | 178.3° | 180.0° |
| C10 | C24 | C25 | H12 | 180.0° | 90.0° |
| C10 | C24 | C25 | H13 | 60.0° | 150.0° |
| C10 | C24 | C25 | H14 | 60.0° | 30.0° |
| C24 | C10 | C11 | H17 | 154.1° | 145.1° |
| C24 | C10 | C11 | H18 | 32.9° | 25.0° |
| C3 | C2 | H2 | H3 | 119.3° | 120.0° |
| C2 | C3 | H4 | H5 | 120.0° | 120.0° |
| C2 | C3 | H4 | H6 | 120.0° | 120.1° |
| C2 | C3 | H5 | H6 | 120.0° | 120.0° |
| C24 | C7 | C6 | C5 | 174.9° | 179.8° |
| C7 | C24 | C25 | H12 | 0.1° | 90.0° |
| C7 | C24 | C25 | H13 | 119.9° | 30.0° |
| C7 | C24 | C25 | H14 | 120.1° | 150.0° |
| C24 | C7 | C6 | H15 | 5.1° | 0.3° |
| C6 | C7 | C24 | C25 | 1.5° | 0.1° |
| C7 | C6 | C5 | H15 | 180.0° | 180.0° |
| C7 | C6 | C5 | H16 | 177.1° | 180.0° |
| C24 | C25 | H12 | H13 | 120.0° | 120.0° |
| C24 | C25 | H12 | H14 | 120.0° | 120.0° |
| C24 | C25 | H13 | H14 | 120.0° | 120.0° |
| H2 | C2 | C3 | H4 | 59.8° | 60.0° |
| H2 | C2 | C3 | H5 | 179.8° | 179.9° |
| H2 | C2 | C3 | H6 | 60.2° | 60.1° |
| H3 | C2 | C3 | H4 | 59.8° | 59.9° |
| H3 | C2 | C3 | H5 | 60.2° | 60.0° |
| H3 | C2 | C3 | H6 | 179.8° | 180.0° |
| H4 | C3 | H5 | H6 | 120.0° | 119.9° |
| H7 | C1 | C | H9 | 59.5° | 60.0° |
| H7 | C1 | C | H10 | 60.5° | 180.0° |
| H7 | C1 | C | H11 | 179.5° | 60.0° |
| H8 | C1 | C | H9 | 59.6° | 60.0° |
| H8 | C1 | C | H10 | 179.6° | 60.0° |
| H8 | C1 | C | H11 | 60.4° | 180.0° |
| H9 | C | H10 | H11 | 119.9° | 120.0° |
| H12 | C25 | H13 | H14 | 120.0° | 120.0° |
| H15 | C6 | C5 | H16 | 2.9° | 0.0° |
| H17 | C11 | C12 | H19 | 63.3° | 179.9° |
| H17 | C11 | C12 | H20 | 175.9° | 60.0° |
| H18 | C11 | C12 | H19 | 57.9° | 60.0° |
| H18 | C11 | C12 | H20 | 62.9° | 180.0° |
| H21 | N1 | C14 | H22 | 95.7° | 120.0° |
| H21 | N1 | C14 | H23 | 145.2° | 120.0° |
| H24 | C23 | C22 | H25 | 0.3° | 0.0° |
| H25 | C22 | C21 | H26 | 1.1° | 0.2° |
| H28 | N3 | C20 | H29 | 0.1° | 0.3° |
