2LO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C26 | sing | 1.51Å | 1.45Å | |
| O2 | C26 | sing | 1.34Å | 1.34Å | Aromatic |
| O2 | N3 | sing | 1.21Å | 1.37Å | Aromatic |
| C26 | C2 | doub | 1.37Å | 1.39Å | Aromatic |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| C11 | C12 | sing | 1.51Å | 1.49Å | |
| N | C7 | sing | 1.36Å | 1.39Å | Aromatic |
| N | C9 | doub | 1.30Å | 1.32Å | Aromatic |
| C8 | C7 | doub | 1.40Å | 1.38Å | Aromatic |
| C8 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.51Å | 1.48Å | |
| N3 | C1 | doub | 1.30Å | 1.36Å | Aromatic |
| C2 | C3 | sing | 1.48Å | 1.46Å | |
| C2 | C1 | sing | 1.42Å | 1.40Å | Aromatic |
| C7 | C6 | sing | 1.41Å | 1.39Å | Aromatic |
| C9 | N1 | sing | 1.36Å | 1.39Å | Aromatic |
| C12 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | doub | 1.40Å | 1.42Å | Aromatic |
| C1 | C | sing | 1.51Å | 1.50Å | |
| C6 | N1 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C5 | doub | 1.39Å | 1.41Å | Aromatic |
| N1 | C19 | sing | 1.47Å | 1.47Å | |
| C13 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | CL | sing | 1.74Å | 1.70Å | |
| C16 | C15 | doub | 1.39Å | 1.37Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.37Å | Aromatic |
| C14 | C15 | sing | 1.39Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.53Å | 1.54Å | |
| C15 | O | sing | 1.36Å | 1.36Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C20 | N2 | sing | 1.47Å | 1.49Å | |
| O | C18 | sing | 1.43Å | 1.43Å | |
| N2 | C22 | sing | 1.47Å | 1.49Å | |
| N2 | C25 | sing | 1.47Å | 1.49Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| C25 | C24 | sing | 1.53Å | 1.55Å | |
| C23 | O1 | sing | 1.43Å | 1.41Å | |
| C24 | O1 | sing | 1.43Å | 1.42Å | |
| C18 | H1 | sing | 1.09Å | 1.10Å | |
| C18 | H2 | sing | 1.09Å | 1.10Å | |
| C18 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.08Å | 1.08Å | |
| C17 | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.09Å | 1.10Å | |
| C19 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C5 | H26 | sing | 1.08Å | 1.08Å | |
| C4 | H27 | sing | 1.08Å | 1.08Å | |
| C8 | H28 | sing | 1.08Å | 1.08Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C | H32 | sing | 1.09Å | 1.10Å | |
| C | H33 | sing | 1.09Å | 1.10Å | |
| C | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | C26 | O2 | 115.0° | 126.9° |
| C27 | C26 | C2 | 133.7° | 126.9° |
| C26 | C27 | H29 | 109.5° | 109.5° |
| C26 | C27 | H30 | 109.5° | 109.5° |
| C26 | C27 | H31 | 109.5° | 109.5° |
| C26 | O2 | N3 | 105.6° | 111.9° |
| O2 | C26 | C2 | 111.3° | 106.2° |
| O2 | N3 | C1 | 111.3° | 111.9° |
| C26 | C2 | C3 | 126.8° | 128.1° |
| C26 | C2 | C1 | 105.8° | 103.7° |
| C10 | C11 | C12 | 112.4° | 109.4° |
| C11 | C10 | C9 | 111.9° | 109.4° |
| C10 | C11 | H7 | 108.7° | 109.5° |
| C10 | C11 | H8 | 108.8° | 109.5° |
| C11 | C10 | H9 | 108.9° | 109.5° |
| C11 | C10 | H10 | 108.9° | 109.5° |
| C11 | C12 | C17 | 118.5° | 119.9° |
| C11 | C12 | C13 | 121.5° | 119.9° |
| C12 | C11 | H7 | 108.7° | 109.5° |
| C12 | C11 | H8 | 108.7° | 109.5° |
| C7 | N | C9 | 106.9° | 109.6° |
| N | C7 | C8 | 129.3° | 133.4° |
| N | C7 | C6 | 109.8° | 107.0° |
| N | C9 | C10 | 125.8° | 124.9° |
| N | C9 | N1 | 110.8° | 110.1° |
| C7 | C8 | C3 | 118.3° | 119.7° |
| C8 | C7 | C6 | 120.8° | 119.6° |
| C7 | C8 | H28 | 120.9° | 120.2° |
| C8 | C3 | C2 | 118.5° | 119.9° |
| C8 | C3 | C4 | 120.8° | 120.2° |
| C3 | C8 | H28 | 120.9° | 120.2° |
| C10 | C9 | N1 | 123.4° | 125.0° |
| C9 | C10 | H9 | 108.9° | 109.5° |
| C9 | C10 | H10 | 108.9° | 109.5° |
| N3 | C1 | C2 | 106.1° | 106.3° |
| N3 | C1 | C | 124.4° | 126.9° |
| C3 | C2 | C1 | 127.5° | 128.2° |
| C2 | C3 | C4 | 120.6° | 119.9° |
| C2 | C1 | C | 129.6° | 126.8° |
| C7 | C6 | N1 | 105.1° | 105.9° |
| C7 | C6 | C5 | 121.7° | 120.1° |
| C9 | N1 | C6 | 107.3° | 107.4° |
| C9 | N1 | C19 | 126.9° | 126.3° |
| C17 | C12 | C13 | 120.0° | 120.1° |
| C12 | C17 | C16 | 118.3° | 120.1° |
| C12 | C17 | H6 | 120.8° | 119.9° |
| C12 | C13 | C14 | 120.9° | 120.1° |
| C12 | C13 | H5 | 119.5° | 120.0° |
| C17 | C16 | CL | 119.7° | 120.0° |
| C17 | C16 | C15 | 122.3° | 119.9° |
| C16 | C17 | H6 | 120.8° | 120.0° |
| C3 | C4 | C5 | 120.6° | 120.3° |
| C3 | C4 | H27 | 119.7° | 119.8° |
| C1 | C | H32 | 109.5° | 109.4° |
| C1 | C | H33 | 109.5° | 109.4° |
| C1 | C | H34 | 109.5° | 109.5° |
| N1 | C6 | C5 | 133.1° | 133.9° |
| C6 | N1 | C19 | 125.8° | 126.3° |
| C6 | C5 | C4 | 117.7° | 120.0° |
| C6 | C5 | H26 | 121.2° | 120.0° |
| N1 | C19 | C20 | 109.9° | 109.4° |
| N1 | C19 | H11 | 109.4° | 109.4° |
| N1 | C19 | H12 | 109.3° | 109.5° |
| C13 | C14 | C15 | 120.1° | 119.9° |
| C13 | C14 | H4 | 120.0° | 120.0° |
| C14 | C13 | H5 | 119.5° | 120.0° |
| CL | C16 | C15 | 118.0° | 120.0° |
| C16 | C15 | C14 | 118.4° | 119.9° |
| C16 | C15 | O | 118.0° | 120.1° |
| C4 | C5 | H26 | 121.1° | 120.0° |
| C5 | C4 | H27 | 119.7° | 119.8° |
| C14 | C15 | O | 123.6° | 120.0° |
| C15 | C14 | H4 | 119.9° | 120.0° |
| C19 | C20 | C21 | 112.8° | 109.4° |
| C19 | C20 | N2 | 108.8° | 109.5° |
| C20 | C19 | H11 | 109.4° | 109.5° |
| C20 | C19 | H12 | 109.3° | 109.5° |
| C19 | C20 | H13 | 106.6° | 109.5° |
| C15 | O | C18 | 119.9° | 117.0° |
| C21 | C20 | N2 | 114.2° | 109.4° |
| C21 | C20 | H13 | 106.7° | 109.5° |
| C20 | C21 | H23 | 109.5° | 109.4° |
| C20 | C21 | H24 | 109.4° | 109.4° |
| C20 | C21 | H25 | 109.5° | 109.5° |
| C20 | N2 | C22 | 112.1° | 111.0° |
| C20 | N2 | C25 | 115.9° | 111.0° |
| N2 | C20 | H13 | 107.2° | 109.5° |
| O | C18 | H1 | 109.5° | 109.5° |
| O | C18 | H2 | 109.5° | 109.5° |
| O | C18 | H3 | 109.5° | 109.5° |
| C22 | N2 | C25 | 112.5° | 110.8° |
| N2 | C22 | C23 | 111.7° | 109.3° |
| N2 | C22 | H21 | 108.9° | 109.5° |
| N2 | C22 | H22 | 108.9° | 109.5° |
| N2 | C25 | C24 | 106.9° | 109.3° |
| N2 | C25 | H15 | 110.1° | 109.5° |
| N2 | C25 | H16 | 110.1° | 109.4° |
| C22 | C23 | O1 | 110.6° | 109.3° |
| C22 | C23 | H19 | 109.2° | 109.5° |
| C22 | C23 | H20 | 109.2° | 109.5° |
| C23 | C22 | H21 | 108.9° | 109.5° |
| C23 | C22 | H22 | 108.9° | 109.5° |
| C25 | C24 | O1 | 111.9° | 109.2° |
| C24 | C25 | H15 | 110.1° | 109.5° |
| C24 | C25 | H16 | 110.1° | 109.5° |
| C25 | C24 | H17 | 108.9° | 109.5° |
| C25 | C24 | H18 | 108.9° | 109.5° |
| C23 | O1 | C24 | 115.0° | 113.8° |
| O1 | C23 | H19 | 109.2° | 109.5° |
| O1 | C23 | H20 | 109.2° | 109.5° |
| O1 | C24 | H17 | 108.8° | 109.5° |
| O1 | C24 | H18 | 108.9° | 109.5° |
| H1 | C18 | H2 | 109.5° | 109.5° |
| H1 | C18 | H3 | 109.5° | 109.4° |
| H2 | C18 | H3 | 109.4° | 109.5° |
| H7 | C11 | H8 | 109.5° | 109.5° |
| H9 | C10 | H10 | 109.4° | 109.5° |
| H11 | C19 | H12 | 109.5° | 109.6° |
| H15 | C25 | H16 | 109.5° | 109.6° |
| H17 | C24 | H18 | 109.4° | 109.6° |
| H19 | C23 | H20 | 109.5° | 109.5° |
| H21 | C22 | H22 | 109.5° | 109.5° |
| H23 | C21 | H24 | 109.5° | 109.5° |
| H23 | C21 | H25 | 109.4° | 109.5° |
| H24 | C21 | H25 | 109.5° | 109.5° |
| H29 | C27 | H30 | 109.5° | 109.5° |
| H29 | C27 | H31 | 109.5° | 109.4° |
| H30 | C27 | H31 | 109.5° | 109.5° |
| H32 | C | H33 | 109.5° | 109.5° |
| H32 | C | H34 | 109.4° | 109.5° |
| H33 | C | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | C26 | O2 | C2 | 179.4° | 180.0° |
| C27 | C26 | O2 | N3 | 179.0° | 179.9° |
| C27 | C26 | C2 | C3 | 0.4° | 0.0° |
| C27 | C26 | C2 | C1 | 178.5° | 179.7° |
| C26 | C27 | H29 | H30 | 120.0° | 120.0° |
| C26 | C27 | H29 | H31 | 120.0° | 119.9° |
| C26 | C27 | H30 | H31 | 120.0° | 120.0° |
| C26 | O2 | N3 | C1 | 0.2° | 0.3° |
| O2 | C26 | C2 | C3 | 179.6° | 180.0° |
| O2 | C26 | C2 | C1 | 0.6° | 0.2° |
| O2 | C26 | C27 | H29 | 0.0° | 90.0° |
| O2 | C26 | C27 | H30 | 120.0° | 30.0° |
| O2 | C26 | C27 | H31 | 120.0° | 150.1° |
| N3 | O2 | C26 | C2 | 0.3° | 0.0° |
| O2 | N3 | C1 | C2 | 0.6° | 0.4° |
| O2 | N3 | C1 | C | 179.6° | 179.7° |
| C26 | C2 | C3 | C8 | 42.7° | 64.7° |
| C26 | C2 | C1 | N3 | 0.7° | 0.4° |
| C26 | C2 | C3 | C1 | 178.8° | 179.7° |
| C26 | C2 | C3 | C4 | 136.3° | 115.1° |
| C26 | C2 | C1 | C | 179.7° | 179.7° |
| C2 | C26 | C27 | H29 | 179.2° | 89.9° |
| C2 | C26 | C27 | H30 | 59.2° | 150.0° |
| C2 | C26 | C27 | H31 | 60.8° | 30.0° |
| C10 | C11 | C12 | H7 | 120.4° | 120.0° |
| C10 | C11 | C12 | H8 | 120.4° | 120.0° |
| C11 | C10 | C9 | N | 51.7° | 90.3° |
| C11 | C10 | C9 | H9 | 120.4° | 120.0° |
| C11 | C10 | C9 | H10 | 120.4° | 120.0° |
| C11 | C10 | C9 | N1 | 130.7° | 90.0° |
| C10 | C11 | C12 | C17 | 97.7° | 90.0° |
| C10 | C11 | C12 | C13 | 80.7° | 90.6° |
| C10 | C11 | H7 | H8 | 118.7° | 120.0° |
| C11 | C10 | H9 | H10 | 118.9° | 120.0° |
| C12 | C11 | C10 | C9 | 64.0° | 180.0° |
| C11 | C12 | C17 | C13 | 178.4° | 179.4° |
| C11 | C12 | C17 | C16 | 177.6° | 180.0° |
| C11 | C12 | C13 | C14 | 177.2° | 179.7° |
| C11 | C12 | C13 | H5 | 2.8° | 0.3° |
| C11 | C12 | C17 | H6 | 2.3° | 0.3° |
| C12 | C11 | H7 | H8 | 118.6° | 120.0° |
| C12 | C11 | C10 | H9 | 56.4° | 60.0° |
| C12 | C11 | C10 | H10 | 175.7° | 60.0° |
| N | C7 | C8 | C6 | 176.5° | 179.6° |
| N | C7 | C8 | C3 | 175.4° | 179.8° |
| C7 | N | C9 | C10 | 177.1° | 179.9° |
| C7 | N | C9 | N1 | 0.8° | 0.4° |
| N | C7 | C6 | N1 | 0.7° | 0.3° |
| N | C7 | C6 | C5 | 177.3° | 179.8° |
| N | C7 | C8 | H28 | 4.6° | 0.0° |
| C9 | N | C7 | C8 | 176.8° | 180.0° |
| N | C9 | C10 | N1 | 177.6° | 179.7° |
| C9 | N | C7 | C6 | 0.0° | 0.4° |
| N | C9 | N1 | C6 | 1.2° | 0.2° |
| N | C9 | N1 | C19 | 177.5° | 179.8° |
| N | C9 | C10 | H9 | 172.1° | 149.7° |
| N | C9 | C10 | H10 | 68.6° | 29.7° |
| C7 | C8 | C3 | H28 | 180.0° | 179.8° |
| C7 | C8 | C3 | C2 | 177.8° | 180.0° |
| C7 | C8 | C3 | C4 | 1.3° | 0.2° |
| C8 | C7 | C6 | N1 | 177.9° | 179.9° |
| C8 | C7 | C6 | C5 | 0.1° | 0.1° |
| C8 | C3 | C2 | C4 | 179.1° | 179.8° |
| C8 | C3 | C2 | C1 | 138.5° | 115.0° |
| C3 | C8 | C7 | C6 | 1.2° | 0.2° |
| C8 | C3 | C4 | C5 | 0.1° | 0.2° |
| C8 | C3 | C4 | H27 | 179.9° | 179.9° |
| C10 | C9 | N1 | C6 | 176.7° | 179.9° |
| C10 | C9 | N1 | C19 | 4.6° | 0.0° |
| C9 | C10 | C11 | H7 | 56.5° | 60.0° |
| C9 | C10 | C11 | H8 | 175.6° | 60.0° |
| C9 | C10 | H9 | H10 | 118.9° | 120.0° |
| N3 | C1 | C2 | C3 | 179.7° | 179.9° |
| N3 | C1 | C2 | C | 178.9° | 179.9° |
| N3 | C1 | C | H32 | 0.0° | 89.8° |
| N3 | C1 | C | H33 | 120.0° | 30.1° |
| N3 | C1 | C | H34 | 120.0° | 150.2° |
| C3 | C2 | C1 | C | 1.4° | 0.0° |
| C2 | C3 | C4 | C5 | 179.0° | 180.0° |
| C2 | C3 | C4 | H27 | 1.1° | 0.1° |
| C2 | C3 | C8 | H28 | 2.2° | 0.3° |
| C1 | C2 | C3 | C4 | 42.4° | 65.2° |
| C2 | C1 | C | H32 | 178.8° | 90.0° |
| C2 | C1 | C | H33 | 58.8° | 150.0° |
| C2 | C1 | C | H34 | 61.2° | 30.0° |
| C7 | C6 | N1 | C9 | 1.2° | 0.0° |
| C7 | C6 | N1 | C5 | 177.6° | 179.9° |
| C7 | C6 | N1 | C19 | 177.6° | 180.0° |
| C7 | C6 | C5 | C4 | 1.3° | 0.1° |
| C7 | C6 | C5 | H26 | 178.7° | 180.0° |
| C6 | C7 | C8 | H28 | 178.9° | 179.6° |
| C9 | N1 | C6 | C19 | 178.7° | 180.0° |
| C9 | N1 | C6 | C5 | 176.5° | 180.0° |
| C9 | N1 | C19 | C20 | 75.7° | 90.0° |
| N1 | C9 | C10 | H9 | 10.3° | 30.0° |
| N1 | C9 | C10 | H10 | 109.0° | 150.0° |
| C9 | N1 | C19 | H11 | 44.3° | 150.0° |
| C9 | N1 | C19 | H12 | 164.2° | 30.0° |
| C12 | C17 | C16 | H6 | 180.0° | 179.7° |
| C17 | C12 | C13 | C14 | 1.2° | 0.3° |
| C12 | C17 | C16 | CL | 179.6° | 179.7° |
| C12 | C17 | C16 | C15 | 0.5° | 0.5° |
| C17 | C12 | C13 | H5 | 178.8° | 179.7° |
| C17 | C12 | C11 | H7 | 22.7° | 150.0° |
| C17 | C12 | C11 | H8 | 141.9° | 30.0° |
| C13 | C12 | C17 | C16 | 0.8° | 0.6° |
| C12 | C13 | C14 | H5 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 0.4° | 0.0° |
| C12 | C13 | C14 | H4 | 179.6° | 179.9° |
| C13 | C12 | C17 | H6 | 179.2° | 179.7° |
| C13 | C12 | C11 | H7 | 158.9° | 29.4° |
| C13 | C12 | C11 | H8 | 39.7° | 149.5° |
| C17 | C16 | CL | C15 | 179.9° | 179.8° |
| C17 | C16 | C15 | C14 | 1.3° | 0.2° |
| C17 | C16 | C15 | O | 176.8° | 179.7° |
| C3 | C4 | C5 | C6 | 1.2° | 0.1° |
| C3 | C4 | C5 | H27 | 180.0° | 179.9° |
| C3 | C4 | C5 | H26 | 178.8° | 180.0° |
| C4 | C3 | C8 | H28 | 178.8° | 179.6° |
| C1 | C | H32 | H33 | 120.0° | 119.9° |
| C1 | C | H32 | H34 | 120.0° | 120.0° |
| C1 | C | H33 | H34 | 120.0° | 120.0° |
| N1 | C6 | C5 | C4 | 176.0° | 180.0° |
| C6 | N1 | C19 | C20 | 102.7° | 90.0° |
| C6 | N1 | C19 | H11 | 137.2° | 30.0° |
| C6 | N1 | C19 | H12 | 17.3° | 150.1° |
| N1 | C6 | C5 | H26 | 4.0° | 0.1° |
| C5 | C6 | N1 | C19 | 4.8° | 0.1° |
| C6 | C5 | C4 | H26 | 180.0° | 179.9° |
| C6 | C5 | C4 | H27 | 178.8° | 180.0° |
| N1 | C19 | C20 | H11 | 120.1° | 119.9° |
| N1 | C19 | C20 | H12 | 120.0° | 120.0° |
| N1 | C19 | C20 | C21 | 57.7° | 175.0° |
| N1 | C19 | C20 | N2 | 174.5° | 65.1° |
| N1 | C19 | H11 | H12 | 119.8° | 120.0° |
| N1 | C19 | C20 | H13 | 59.2° | 55.0° |
| C13 | C14 | C15 | C16 | 0.9° | 0.0° |
| C13 | C14 | C15 | H4 | 180.0° | 179.9° |
| C13 | C14 | C15 | O | 177.1° | 180.0° |
| CL | C16 | C15 | C14 | 178.8° | 180.0° |
| CL | C16 | C15 | O | 3.1° | 0.1° |
| CL | C16 | C17 | H6 | 0.4° | 0.0° |
| C16 | C15 | C14 | O | 178.0° | 179.9° |
| C16 | C15 | O | C18 | 167.2° | 180.0° |
| C16 | C15 | C14 | H4 | 179.1° | 180.0° |
| C15 | C16 | C17 | H6 | 179.5° | 179.7° |
| C14 | C15 | O | C18 | 10.8° | 0.0° |
| C15 | C14 | C13 | H5 | 179.6° | 180.0° |
| C19 | C20 | C21 | N2 | 124.9° | 119.9° |
| C19 | C20 | C21 | H13 | 116.7° | 120.0° |
| C19 | C20 | N2 | H13 | 114.9° | 120.1° |
| C19 | C20 | N2 | C22 | 159.8° | 170.0° |
| C19 | C20 | N2 | C25 | 69.2° | 66.2° |
| C20 | C19 | H11 | H12 | 119.8° | 120.1° |
| C19 | C20 | C21 | H23 | 180.0° | 60.1° |
| C19 | C20 | C21 | H24 | 60.0° | 180.0° |
| C19 | C20 | C21 | H25 | 60.0° | 60.0° |
| C15 | O | C18 | H1 | 180.0° | 180.0° |
| C15 | O | C18 | H2 | 60.0° | 60.0° |
| C15 | O | C18 | H3 | 60.0° | 60.0° |
| O | C15 | C14 | H4 | 2.9° | 0.1° |
| C21 | C20 | N2 | H13 | 118.0° | 120.0° |
| C21 | C20 | N2 | C22 | 73.1° | 70.1° |
| C21 | C20 | N2 | C25 | 57.8° | 53.6° |
| C21 | C20 | C19 | H11 | 177.8° | 65.0° |
| C21 | C20 | C19 | H12 | 62.4° | 55.1° |
| C20 | C21 | H23 | H24 | 120.0° | 119.9° |
| C20 | C21 | H23 | H25 | 120.0° | 120.0° |
| C20 | C21 | H24 | H25 | 120.0° | 120.1° |
| C20 | N2 | C22 | C25 | 132.7° | 123.9° |
| C20 | N2 | C22 | C23 | 110.5° | 177.6° |
| C20 | N2 | C25 | C24 | 166.2° | 177.6° |
| N2 | C20 | C19 | H11 | 54.4° | 54.8° |
| N2 | C20 | C19 | H12 | 65.5° | 175.0° |
| C20 | N2 | C25 | H15 | 74.2° | 57.6° |
| C20 | N2 | C25 | H16 | 46.6° | 62.5° |
| C20 | N2 | C22 | H21 | 9.9° | 62.5° |
| C20 | N2 | C22 | H22 | 129.2° | 57.6° |
| N2 | C20 | C21 | H23 | 55.1° | 180.0° |
| N2 | C20 | C21 | H24 | 65.0° | 60.1° |
| N2 | C20 | C21 | H25 | 175.0° | 60.0° |
| O | C18 | H1 | H2 | 120.0° | 120.0° |
| O | C18 | H1 | H3 | 120.0° | 120.0° |
| O | C18 | H2 | H3 | 120.0° | 120.0° |
| N2 | C22 | C23 | H21 | 120.3° | 119.9° |
| N2 | C22 | C23 | H22 | 120.3° | 120.0° |
| C22 | N2 | C25 | C24 | 35.4° | 58.6° |
| N2 | C22 | C23 | O1 | 61.2° | 56.8° |
| C22 | N2 | C20 | H13 | 44.9° | 50.0° |
| C22 | N2 | C25 | H15 | 155.1° | 178.5° |
| C22 | N2 | C25 | H16 | 84.1° | 61.3° |
| N2 | C22 | C23 | H19 | 59.0° | 63.1° |
| N2 | C22 | C23 | H20 | 178.6° | 176.8° |
| N2 | C22 | H21 | H22 | 119.0° | 120.1° |
| C25 | N2 | C22 | C23 | 22.2° | 58.6° |
| N2 | C25 | C24 | H15 | 119.6° | 120.0° |
| N2 | C25 | C24 | H16 | 119.6° | 119.8° |
| N2 | C25 | C24 | O1 | 66.3° | 56.8° |
| C25 | N2 | C20 | H13 | 175.9° | 173.7° |
| N2 | C25 | H15 | H16 | 121.2° | 120.1° |
| N2 | C25 | C24 | H17 | 54.1° | 63.1° |
| N2 | C25 | C24 | H18 | 173.3° | 176.7° |
| C25 | N2 | C22 | H21 | 142.6° | 61.4° |
| C25 | N2 | C22 | H22 | 98.1° | 178.5° |
| C22 | C23 | O1 | H19 | 120.2° | 119.9° |
| C22 | C23 | O1 | H20 | 120.2° | 120.0° |
| C22 | C23 | O1 | C24 | 32.1° | 58.7° |
| C22 | C23 | H19 | H20 | 119.5° | 120.1° |
| C23 | C22 | H21 | H22 | 119.0° | 120.1° |
| C25 | C24 | O1 | C23 | 29.1° | 58.6° |
| C25 | C24 | O1 | H17 | 120.4° | 119.9° |
| C25 | C24 | O1 | H18 | 120.4° | 119.9° |
| C24 | C25 | H15 | H16 | 121.2° | 120.1° |
| C25 | C24 | H17 | H18 | 118.9° | 120.1° |
| C23 | O1 | C24 | H17 | 91.3° | 61.2° |
| C23 | O1 | C24 | H18 | 149.5° | 178.6° |
| O1 | C23 | H19 | H20 | 119.5° | 120.1° |
| O1 | C23 | C22 | H21 | 178.5° | 63.1° |
| O1 | C23 | C22 | H22 | 59.1° | 176.8° |
| O1 | C24 | C25 | H15 | 174.2° | 176.7° |
| O1 | C24 | C25 | H16 | 53.3° | 63.1° |
| O1 | C24 | H17 | H18 | 118.9° | 120.2° |
| C24 | O1 | C23 | H19 | 88.0° | 61.3° |
| C24 | O1 | C23 | H20 | 152.3° | 178.7° |
| H1 | C18 | H2 | H3 | 119.9° | 120.0° |
| H4 | C14 | C13 | H5 | 0.4° | 0.0° |
| H7 | C11 | C10 | H9 | 176.9° | 180.0° |
| H7 | C11 | C10 | H10 | 63.9° | 60.0° |
| H8 | C11 | C10 | H9 | 64.0° | 60.0° |
| H8 | C11 | C10 | H10 | 55.3° | 180.0° |
| H11 | C19 | C20 | H13 | 60.9° | 174.9° |
| H12 | C19 | C20 | H13 | 179.2° | 65.0° |
| H13 | C20 | C21 | H23 | 63.2° | 60.0° |
| H13 | C20 | C21 | H24 | 176.7° | 60.0° |
| H13 | C20 | C21 | H25 | 56.7° | 180.0° |
| H15 | C25 | C24 | H17 | 65.5° | 56.9° |
| H15 | C25 | C24 | H18 | 53.8° | 63.3° |
| H16 | C25 | C24 | H17 | 173.7° | 177.1° |
| H16 | C25 | C24 | H18 | 67.1° | 56.9° |
| H19 | C23 | C22 | H21 | 61.3° | 176.9° |
| H19 | C23 | C22 | H22 | 179.3° | 56.8° |
| H20 | C23 | C22 | H21 | 58.3° | 56.9° |
| H20 | C23 | C22 | H22 | 61.0° | 63.3° |
| H23 | C21 | H24 | H25 | 120.0° | 120.0° |
| H26 | C5 | C4 | H27 | 1.2° | 0.1° |
| H29 | C27 | H30 | H31 | 120.0° | 120.0° |
| H32 | C | H33 | H34 | 120.0° | 120.1° |
