7DN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | C11 | doub | 1.39Å | 1.40Å | Aromatic |
| C12 | C13 | sing | 1.36Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.36Å | 1.41Å | Aromatic |
| C13 | C8 | doub | 1.40Å | 1.41Å | Aromatic |
| C8 | C9 | sing | 1.42Å | 1.42Å | Aromatic |
| C8 | C7 | sing | 1.41Å | 1.40Å | Aromatic |
| C10 | C9 | doub | 1.41Å | 1.41Å | Aromatic |
| C10 | C14 | sing | 1.51Å | 1.51Å | |
| C9 | N1 | sing | 1.34Å | 1.35Å | Aromatic |
| C7 | C6 | doub | 1.36Å | 1.40Å | Aromatic |
| N1 | C5 | doub | 1.32Å | 1.36Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | N | sing | 1.39Å | 1.39Å | |
| N | C3 | sing | 1.47Å | 1.47Å | |
| N | C4 | sing | 1.47Å | 1.48Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C4 | C | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C | C1 | sing | 1.53Å | 1.55Å | |
| C22 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.40Å | Aromatic |
| C1 | C15 | sing | 1.51Å | 1.52Å | |
| C21 | C20 | doub | 1.38Å | 1.42Å | Aromatic |
| C24 | C25 | doub | 1.40Å | 1.42Å | Aromatic |
| C15 | O | doub | 1.21Å | 1.22Å | |
| C15 | N2 | sing | 1.35Å | 1.38Å | |
| C20 | C25 | sing | 1.40Å | 1.43Å | Aromatic |
| C20 | C19 | sing | 1.51Å | 1.52Å | |
| C25 | C26 | sing | 1.48Å | 1.52Å | |
| N2 | C16 | sing | 1.47Å | 1.46Å | |
| C19 | C18 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C26 | O2 | doub | 1.21Å | 1.27Å | |
| C26 | O1 | sing | 1.35Å | 1.27Å | |
| C16 | C17 | sing | 1.54Å | 1.55Å | |
| C16 | C29 | sing | 1.54Å | 1.53Å | |
| C17 | C27 | sing | 1.55Å | 1.53Å | |
| C29 | C28 | sing | 1.54Å | 1.52Å | |
| C27 | C28 | sing | 1.55Å | 1.52Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| C7 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H9 | sing | 1.09Å | 1.10Å | |
| C2 | H10 | sing | 1.09Å | 1.10Å | |
| N2 | H11 | sing | 0.97Å | 1.00Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C29 | H13 | sing | 1.09Å | 1.10Å | |
| C29 | H14 | sing | 1.09Å | 1.10Å | |
| C28 | H15 | sing | 1.09Å | 1.10Å | |
| C28 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.08Å | 1.08Å | |
| C22 | H25 | sing | 1.08Å | 1.08Å | |
| C23 | H26 | sing | 1.08Å | 1.08Å | |
| C24 | H27 | sing | 1.08Å | 1.08Å | |
| C | H28 | sing | 1.09Å | 1.10Å | |
| C | H29 | sing | 1.09Å | 1.10Å | |
| C13 | H30 | sing | 1.08Å | 1.08Å | |
| C12 | H31 | sing | 1.08Å | 1.08Å | |
| C11 | H32 | sing | 1.08Å | 1.08Å | |
| C14 | H33 | sing | 1.09Å | 1.10Å | |
| C14 | H34 | sing | 1.09Å | 1.10Å | |
| C14 | H35 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | C12 | C13 | 120.2° | 120.9° |
| C12 | C11 | C10 | 120.5° | 121.0° |
| C11 | C12 | H31 | 119.9° | 119.6° |
| C12 | C11 | H32 | 119.8° | 119.5° |
| C12 | C13 | C8 | 120.0° | 119.6° |
| C12 | C13 | H30 | 120.0° | 120.2° |
| C13 | C12 | H31 | 119.9° | 119.6° |
| C11 | C10 | C9 | 119.9° | 119.7° |
| C11 | C10 | C14 | 120.0° | 120.2° |
| C10 | C11 | H32 | 119.8° | 119.4° |
| C13 | C8 | C9 | 120.4° | 119.6° |
| C13 | C8 | C7 | 121.8° | 121.3° |
| C8 | C13 | H30 | 120.0° | 120.2° |
| C9 | C8 | C7 | 117.8° | 119.1° |
| C8 | C9 | C10 | 119.0° | 119.1° |
| C8 | C9 | N1 | 120.8° | 119.9° |
| C8 | C7 | C6 | 119.8° | 118.3° |
| C8 | C7 | H2 | 120.1° | 120.9° |
| C9 | C10 | C14 | 120.1° | 120.1° |
| C10 | C9 | N1 | 120.2° | 121.0° |
| C10 | C14 | H33 | 109.5° | 109.5° |
| C10 | C14 | H34 | 109.5° | 109.5° |
| C10 | C14 | H35 | 109.5° | 109.5° |
| C9 | N1 | C5 | 122.4° | 121.2° |
| C7 | C6 | C5 | 120.5° | 119.9° |
| C6 | C7 | H2 | 120.1° | 120.8° |
| C7 | C6 | H3 | 119.7° | 120.1° |
| N1 | C5 | C6 | 118.7° | 121.5° |
| N1 | C5 | N | 117.9° | 119.2° |
| C6 | C5 | N | 123.3° | 119.3° |
| C5 | C6 | H3 | 119.8° | 120.1° |
| C5 | N | C3 | 122.6° | 111.0° |
| C5 | N | C4 | 119.3° | 111.0° |
| C3 | N | C4 | 115.8° | 111.2° |
| N | C3 | C2 | 109.3° | 109.5° |
| N | C3 | H7 | 109.5° | 109.5° |
| N | C3 | H8 | 109.5° | 109.4° |
| N | C4 | C | 111.7° | 109.6° |
| N | C4 | H5 | 108.9° | 109.5° |
| N | C4 | H6 | 108.9° | 109.5° |
| C3 | C2 | C1 | 111.9° | 109.3° |
| C2 | C3 | H7 | 109.5° | 109.5° |
| C2 | C3 | H8 | 109.5° | 109.5° |
| C3 | C2 | H9 | 108.9° | 109.5° |
| C3 | C2 | H10 | 108.9° | 109.5° |
| C4 | C | C1 | 111.3° | 109.3° |
| C | C4 | H5 | 108.9° | 109.5° |
| C | C4 | H6 | 108.9° | 109.4° |
| C4 | C | H28 | 109.0° | 109.5° |
| C4 | C | H29 | 109.0° | 109.5° |
| C2 | C1 | C | 111.9° | 109.3° |
| C2 | C1 | C15 | 106.3° | 109.5° |
| C2 | C1 | H4 | 108.5° | 109.5° |
| C1 | C2 | H9 | 108.9° | 109.5° |
| C1 | C2 | H10 | 108.9° | 109.5° |
| C | C1 | C15 | 112.7° | 109.5° |
| C | C1 | H4 | 108.5° | 109.5° |
| C1 | C | H28 | 109.0° | 109.5° |
| C1 | C | H29 | 109.0° | 109.5° |
| C23 | C22 | C21 | 119.8° | 120.3° |
| C22 | C23 | C24 | 119.7° | 120.1° |
| C23 | C22 | H25 | 120.1° | 119.8° |
| C22 | C23 | H26 | 120.2° | 119.9° |
| C22 | C21 | C20 | 121.8° | 120.2° |
| C22 | C21 | H24 | 119.1° | 119.9° |
| C21 | C22 | H25 | 120.1° | 119.9° |
| C23 | C24 | C25 | 121.7° | 119.9° |
| C24 | C23 | H26 | 120.1° | 120.0° |
| C23 | C24 | H27 | 119.2° | 120.1° |
| C1 | C15 | O | 123.7° | 120.0° |
| C1 | C15 | N2 | 112.2° | 120.0° |
| C15 | C1 | H4 | 108.8° | 109.5° |
| C21 | C20 | C25 | 118.3° | 119.8° |
| C21 | C20 | C19 | 118.1° | 120.1° |
| C20 | C21 | H24 | 119.1° | 119.9° |
| C24 | C25 | C20 | 118.7° | 119.7° |
| C24 | C25 | C26 | 116.5° | 120.2° |
| C25 | C24 | H27 | 119.1° | 120.1° |
| O | C15 | N2 | 124.1° | 120.0° |
| C15 | N2 | C16 | 122.2° | 120.0° |
| C15 | N2 | H11 | 118.9° | 120.0° |
| C25 | C20 | C19 | 123.6° | 120.1° |
| C20 | C25 | C26 | 124.8° | 120.1° |
| C20 | C19 | C18 | 113.5° | 109.5° |
| C20 | C19 | H22 | 108.5° | 109.5° |
| C20 | C19 | H23 | 108.4° | 109.4° |
| C25 | C26 | O2 | 118.1° | 120.0° |
| C25 | C26 | O1 | 117.2° | 120.0° |
| N2 | C16 | C17 | 111.8° | 110.0° |
| N2 | C16 | C29 | 113.4° | 110.0° |
| C16 | N2 | H11 | 118.9° | 120.0° |
| N2 | C16 | H12 | 109.6° | 110.0° |
| C19 | C18 | C17 | 115.3° | 109.5° |
| C19 | C18 | H20 | 108.0° | 109.5° |
| C19 | C18 | H21 | 108.0° | 109.5° |
| C18 | C19 | H22 | 108.5° | 109.5° |
| C18 | C19 | H23 | 108.5° | 109.5° |
| C18 | C17 | C16 | 115.7° | 110.5° |
| C18 | C17 | C27 | 110.9° | 110.5° |
| C18 | C17 | H19 | 108.4° | 110.6° |
| C17 | C18 | H20 | 108.0° | 109.5° |
| C17 | C18 | H21 | 108.0° | 109.5° |
| O2 | C26 | O1 | 124.7° | 120.0° |
| C26 | O1 | H1 | 109.5° | 117.0° |
| C17 | C16 | C29 | 104.6° | 106.6° |
| C16 | C17 | C27 | 104.9° | 104.2° |
| C17 | C16 | H12 | 108.5° | 110.0° |
| C16 | C17 | H19 | 108.2° | 110.4° |
| C16 | C29 | C28 | 106.5° | 106.6° |
| C29 | C16 | H12 | 108.7° | 110.1° |
| C16 | C29 | H13 | 110.2° | 110.1° |
| C16 | C29 | H14 | 110.2° | 110.0° |
| C17 | C27 | C28 | 107.6° | 102.8° |
| C17 | C27 | H17 | 109.9° | 110.7° |
| C17 | C27 | H18 | 109.9° | 110.9° |
| C27 | C17 | H19 | 108.5° | 110.5° |
| C29 | C28 | C27 | 107.0° | 104.2° |
| C28 | C29 | H13 | 110.2° | 110.0° |
| C28 | C29 | H14 | 110.2° | 110.0° |
| C29 | C28 | H15 | 110.1° | 110.5° |
| C29 | C28 | H16 | 110.1° | 110.5° |
| C27 | C28 | H15 | 110.1° | 110.5° |
| C27 | C28 | H16 | 110.1° | 110.6° |
| C28 | C27 | H17 | 110.0° | 110.8° |
| C28 | C27 | H18 | 110.0° | 110.8° |
| H5 | C4 | H6 | 109.5° | 109.4° |
| H7 | C3 | H8 | 109.5° | 109.5° |
| H9 | C2 | H10 | 109.5° | 109.6° |
| H13 | C29 | H14 | 109.4° | 110.0° |
| H15 | C28 | H16 | 109.5° | 110.4° |
| H17 | C27 | H18 | 109.4° | 110.6° |
| H20 | C18 | H21 | 109.5° | 109.4° |
| H22 | C19 | H23 | 109.5° | 109.4° |
| H28 | C | H29 | 109.5° | 109.5° |
| H33 | C14 | H34 | 109.5° | 109.4° |
| H33 | C14 | H35 | 109.4° | 109.5° |
| H34 | C14 | H35 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | C12 | C13 | H31 | 180.0° | 179.3° |
| C12 | C11 | C10 | H32 | 180.0° | 179.3° |
| C11 | C12 | C13 | C8 | 0.0° | 0.1° |
| C12 | C11 | C10 | C9 | 0.1° | 1.2° |
| C12 | C11 | C10 | C14 | 179.7° | 179.9° |
| C11 | C12 | C13 | H30 | 180.0° | 179.9° |
| C13 | C12 | C11 | C10 | 0.2° | 0.7° |
| C12 | C13 | C8 | H30 | 180.0° | 180.0° |
| C12 | C13 | C8 | C9 | 0.4° | 0.0° |
| C12 | C13 | C8 | C7 | 179.9° | 179.5° |
| C13 | C12 | C11 | H32 | 179.8° | 180.0° |
| C11 | C10 | C9 | C8 | 0.5° | 1.2° |
| C11 | C10 | C9 | C14 | 179.8° | 178.8° |
| C11 | C10 | C9 | N1 | 179.9° | 179.4° |
| C10 | C11 | C12 | H31 | 179.8° | 180.0° |
| C11 | C10 | C14 | H33 | 89.9° | 90.0° |
| C11 | C10 | C14 | H34 | 150.1° | 150.0° |
| C11 | C10 | C14 | H35 | 30.1° | 30.0° |
| C13 | C8 | C9 | C7 | 179.7° | 179.4° |
| C13 | C8 | C9 | C10 | 0.6° | 0.6° |
| C13 | C8 | C9 | N1 | 179.7° | 180.0° |
| C13 | C8 | C7 | C6 | 179.9° | 179.4° |
| C13 | C8 | C7 | H2 | 0.1° | 0.3° |
| C8 | C13 | C12 | H31 | 180.0° | 179.4° |
| C8 | C9 | C10 | N1 | 179.6° | 179.5° |
| C8 | C9 | C10 | C14 | 179.3° | 180.0° |
| C9 | C8 | C7 | C6 | 0.2° | 0.0° |
| C8 | C9 | N1 | C5 | 0.2° | 0.9° |
| C9 | C8 | C7 | H2 | 179.8° | 179.7° |
| C9 | C8 | C13 | H30 | 179.6° | 180.0° |
| C7 | C8 | C9 | C10 | 179.7° | 180.0° |
| C7 | C8 | C9 | N1 | 0.0° | 0.5° |
| C8 | C7 | C6 | H2 | 180.0° | 179.7° |
| C8 | C7 | C6 | C5 | 0.1° | 0.3° |
| C8 | C7 | C6 | H3 | 179.9° | 179.8° |
| C7 | C8 | C13 | H30 | 0.1° | 0.6° |
| C10 | C9 | N1 | C5 | 179.4° | 179.7° |
| C9 | C10 | C11 | H32 | 179.9° | 179.5° |
| C9 | C10 | C14 | H33 | 89.9° | 91.1° |
| C9 | C10 | C14 | H34 | 30.1° | 28.8° |
| C9 | C10 | C14 | H35 | 150.1° | 148.9° |
| C14 | C10 | C9 | N1 | 0.3° | 0.6° |
| C14 | C10 | C11 | H32 | 0.3° | 0.6° |
| C10 | C14 | H33 | H34 | 120.0° | 120.0° |
| C10 | C14 | H33 | H35 | 120.0° | 120.0° |
| C10 | C14 | H34 | H35 | 120.0° | 120.0° |
| C9 | N1 | C5 | C6 | 0.2° | 0.6° |
| C9 | N1 | C5 | N | 179.9° | 179.4° |
| C7 | C6 | C5 | N1 | 0.1° | 0.0° |
| C7 | C6 | C5 | H3 | 180.0° | 179.9° |
| C7 | C6 | C5 | N | 179.7° | 180.0° |
| N1 | C5 | C6 | N | 179.7° | 180.0° |
| N1 | C5 | N | C3 | 146.0° | 0.0° |
| N1 | C5 | N | C4 | 16.0° | 124.2° |
| N1 | C5 | C6 | H3 | 179.9° | 179.9° |
| C6 | C5 | N | C3 | 34.3° | 180.0° |
| C6 | C5 | N | C4 | 163.7° | 55.8° |
| C5 | C6 | C7 | H2 | 179.8° | 180.0° |
| C5 | N | C3 | C4 | 162.6° | 124.1° |
| C5 | N | C3 | C2 | 140.3° | 174.1° |
| C5 | N | C4 | C | 141.6° | 174.1° |
| N | C5 | C6 | H3 | 0.3° | 0.1° |
| C5 | N | C4 | H5 | 21.3° | 65.8° |
| C5 | N | C4 | H6 | 98.1° | 54.1° |
| C5 | N | C3 | H7 | 99.7° | 54.1° |
| C5 | N | C3 | H8 | 20.4° | 65.8° |
| N | C3 | C2 | H7 | 119.9° | 120.0° |
| N | C3 | C2 | H8 | 120.0° | 120.0° |
| C3 | N | C4 | C | 55.2° | 61.7° |
| N | C3 | C2 | C1 | 54.9° | 59.1° |
| C3 | N | C4 | H5 | 175.5° | 58.3° |
| C3 | N | C4 | H6 | 65.2° | 178.2° |
| N | C3 | H7 | H8 | 120.1° | 119.9° |
| N | C3 | C2 | H9 | 175.2° | 60.8° |
| N | C3 | C2 | H10 | 65.5° | 179.1° |
| C4 | N | C3 | C2 | 57.0° | 61.7° |
| N | C4 | C | H5 | 120.3° | 120.0° |
| N | C4 | C | H6 | 120.3° | 120.0° |
| N | C4 | C | C1 | 49.5° | 59.2° |
| N | C4 | H5 | H6 | 119.0° | 119.9° |
| C4 | N | C3 | H7 | 62.9° | 178.2° |
| C4 | N | C3 | H8 | 177.0° | 58.3° |
| N | C4 | C | H28 | 70.8° | 179.1° |
| N | C4 | C | H29 | 169.7° | 60.7° |
| C3 | C2 | C1 | H9 | 120.4° | 119.9° |
| C3 | C2 | C1 | H10 | 120.3° | 119.9° |
| C3 | C2 | C1 | C | 53.1° | 57.6° |
| C3 | C2 | C1 | C15 | 176.6° | 177.6° |
| C3 | C2 | C1 | H4 | 66.5° | 62.3° |
| C2 | C3 | H7 | H8 | 120.1° | 120.0° |
| C3 | C2 | H9 | H10 | 118.9° | 120.1° |
| C4 | C | C1 | C2 | 49.8° | 57.6° |
| C4 | C | C1 | H28 | 120.3° | 120.0° |
| C4 | C | C1 | H29 | 120.3° | 119.9° |
| C4 | C | C1 | C15 | 169.5° | 177.6° |
| C4 | C | C1 | H4 | 69.9° | 62.4° |
| C | C4 | H5 | H6 | 119.0° | 119.9° |
| C4 | C | H28 | H29 | 119.1° | 120.1° |
| C2 | C1 | C | C15 | 119.7° | 119.9° |
| C2 | C1 | C | H4 | 119.7° | 120.0° |
| C2 | C1 | C15 | H4 | 116.7° | 120.1° |
| C2 | C1 | C15 | O | 85.1° | 0.1° |
| C2 | C1 | C15 | N2 | 93.2° | 179.9° |
| C1 | C2 | C3 | H7 | 65.1° | 179.2° |
| C1 | C2 | C3 | H8 | 174.8° | 60.8° |
| C1 | C2 | H9 | H10 | 118.9° | 120.2° |
| C2 | C1 | C | H28 | 70.5° | 177.6° |
| C2 | C1 | C | H29 | 170.0° | 62.3° |
| C | C1 | C15 | H4 | 120.4° | 120.1° |
| C | C1 | C15 | O | 37.8° | 119.9° |
| C | C1 | C15 | N2 | 143.8° | 60.1° |
| C1 | C | C4 | H5 | 169.8° | 60.9° |
| C1 | C | C4 | H6 | 70.9° | 179.2° |
| C | C1 | C2 | H9 | 173.5° | 62.3° |
| C | C1 | C2 | H10 | 67.2° | 177.5° |
| C1 | C | H28 | H29 | 119.2° | 120.1° |
| C23 | C22 | C21 | H25 | 180.0° | 180.0° |
| C22 | C23 | C24 | H26 | 180.0° | 179.9° |
| C23 | C22 | C21 | C20 | 0.1° | 0.0° |
| C22 | C23 | C24 | C25 | 0.2° | 0.0° |
| C23 | C22 | C21 | H24 | 179.9° | 180.0° |
| C22 | C23 | C24 | H27 | 179.8° | 179.9° |
| C21 | C22 | C23 | C24 | 0.2° | 0.0° |
| C22 | C21 | C20 | H24 | 180.0° | 180.0° |
| C22 | C21 | C20 | C25 | 0.5° | 0.0° |
| C22 | C21 | C20 | C19 | 179.6° | 179.7° |
| C21 | C22 | C23 | H26 | 179.8° | 180.0° |
| C23 | C24 | C25 | H27 | 180.0° | 179.9° |
| C23 | C24 | C25 | C20 | 0.3° | 0.0° |
| C23 | C24 | C25 | C26 | 179.9° | 179.7° |
| C24 | C23 | C22 | H25 | 179.8° | 179.9° |
| C1 | C15 | O | N2 | 178.2° | 180.0° |
| C1 | C15 | N2 | C16 | 176.9° | 180.0° |
| C15 | C1 | C2 | H9 | 63.0° | 57.7° |
| C15 | C1 | C2 | H10 | 56.2° | 62.5° |
| C1 | C15 | N2 | H11 | 3.1° | 0.0° |
| C15 | C1 | C | H28 | 49.2° | 62.5° |
| C15 | C1 | C | H29 | 70.2° | 57.6° |
| C21 | C20 | C25 | C24 | 0.6° | 0.0° |
| C21 | C20 | C25 | C19 | 179.0° | 179.7° |
| C21 | C20 | C25 | C26 | 179.6° | 179.7° |
| C21 | C20 | C19 | C18 | 49.4° | 101.6° |
| C21 | C20 | C19 | H22 | 170.0° | 138.4° |
| C21 | C20 | C19 | H23 | 71.2° | 18.4° |
| C20 | C21 | C22 | H25 | 179.9° | 179.9° |
| C24 | C25 | C20 | C26 | 179.8° | 179.7° |
| C24 | C25 | C20 | C19 | 179.6° | 179.7° |
| C24 | C25 | C26 | O2 | 48.5° | 174.5° |
| C24 | C25 | C26 | O1 | 133.7° | 5.5° |
| C25 | C24 | C23 | H26 | 179.9° | 180.0° |
| O | C15 | N2 | C16 | 1.4° | 0.0° |
| O | C15 | C1 | H4 | 158.2° | 120.0° |
| O | C15 | N2 | H11 | 178.6° | 180.0° |
| C15 | N2 | C16 | H11 | 180.0° | 180.0° |
| C15 | N2 | C16 | C17 | 127.8° | 155.0° |
| C15 | N2 | C16 | C29 | 114.3° | 87.8° |
| N2 | C15 | C1 | H4 | 23.5° | 60.0° |
| C15 | N2 | C16 | H12 | 7.4° | 33.6° |
| C25 | C20 | C19 | C18 | 131.6° | 78.1° |
| C20 | C25 | C26 | O2 | 131.7° | 5.8° |
| C20 | C25 | C26 | O1 | 46.1° | 174.2° |
| C25 | C20 | C19 | H22 | 11.0° | 41.9° |
| C25 | C20 | C19 | H23 | 107.8° | 161.9° |
| C25 | C20 | C21 | H24 | 179.5° | 180.0° |
| C20 | C25 | C24 | H27 | 179.7° | 179.9° |
| C19 | C20 | C25 | C26 | 0.7° | 0.0° |
| C20 | C19 | C18 | H22 | 120.6° | 120.1° |
| C20 | C19 | C18 | H23 | 120.6° | 120.0° |
| C20 | C19 | C18 | C17 | 179.5° | 180.0° |
| C20 | C19 | C18 | H20 | 59.7° | 59.9° |
| C20 | C19 | C18 | H21 | 58.6° | 60.0° |
| C20 | C19 | H22 | H23 | 118.1° | 119.9° |
| C19 | C20 | C21 | H24 | 0.5° | 0.3° |
| C25 | C26 | O2 | O1 | 177.7° | 180.0° |
| C25 | C26 | O1 | H1 | 177.7° | 179.9° |
| C26 | C25 | C24 | H27 | 0.1° | 0.4° |
| N2 | C16 | C17 | C18 | 29.5° | 23.0° |
| N2 | C16 | C17 | C29 | 123.1° | 119.3° |
| N2 | C16 | C17 | H12 | 121.0° | 121.4° |
| N2 | C16 | C29 | H12 | 122.2° | 121.4° |
| N2 | C16 | C17 | C27 | 93.0° | 95.7° |
| N2 | C16 | C29 | C28 | 93.2° | 119.3° |
| N2 | C16 | C29 | H13 | 147.2° | 121.4° |
| N2 | C16 | C29 | H14 | 26.3° | 0.0° |
| N2 | C16 | C17 | H19 | 151.3° | 145.7° |
| C19 | C18 | C17 | H20 | 120.8° | 120.0° |
| C19 | C18 | C17 | H21 | 120.9° | 120.0° |
| C19 | C18 | C17 | C16 | 112.6° | 175.0° |
| C19 | C18 | C17 | C27 | 128.1° | 70.3° |
| C19 | C18 | C17 | H19 | 9.1° | 52.4° |
| C19 | C18 | H20 | H21 | 117.4° | 120.0° |
| C18 | C19 | H22 | H23 | 118.2° | 120.0° |
| C18 | C17 | C16 | C27 | 122.5° | 118.7° |
| C18 | C17 | C16 | H19 | 121.8° | 122.7° |
| C18 | C17 | C16 | C29 | 152.6° | 142.3° |
| C18 | C17 | C27 | H19 | 118.9° | 122.7° |
| C18 | C17 | C27 | C28 | 145.9° | 156.6° |
| C18 | C17 | C16 | H12 | 91.4° | 98.4° |
| C18 | C17 | C27 | H17 | 26.2° | 85.1° |
| C18 | C17 | C27 | H18 | 94.3° | 38.2° |
| C17 | C18 | H20 | H21 | 117.3° | 120.0° |
| C17 | C18 | C19 | H22 | 58.9° | 60.0° |
| C17 | C18 | C19 | H23 | 59.9° | 60.0° |
| O2 | C26 | O1 | H1 | 0.0° | 0.1° |
| C17 | C16 | C29 | H12 | 115.8° | 119.3° |
| C16 | C17 | C27 | H19 | 115.5° | 118.6° |
| C17 | C16 | C29 | C28 | 28.8° | 0.0° |
| C16 | C17 | C27 | C28 | 20.4° | 37.9° |
| C17 | C16 | N2 | H11 | 52.2° | 25.0° |
| C17 | C16 | C29 | H13 | 90.7° | 119.3° |
| C17 | C16 | C29 | H14 | 148.4° | 119.3° |
| C16 | C17 | C27 | H17 | 99.3° | 156.3° |
| C16 | C17 | C27 | H18 | 140.1° | 80.5° |
| C16 | C17 | C18 | H20 | 8.2° | 65.0° |
| C16 | C17 | C18 | H21 | 126.5° | 55.0° |
| C29 | C16 | C17 | C27 | 30.2° | 23.6° |
| C16 | C29 | C28 | H13 | 119.6° | 119.3° |
| C16 | C29 | C28 | H14 | 119.6° | 119.3° |
| C16 | C29 | C28 | C27 | 16.4° | 23.6° |
| C29 | C16 | N2 | H11 | 65.8° | 92.1° |
| C16 | C29 | H13 | H14 | 121.4° | 121.4° |
| C16 | C29 | C28 | H15 | 136.0° | 95.0° |
| C16 | C29 | C28 | H16 | 103.3° | 142.4° |
| C29 | C16 | C17 | H19 | 85.5° | 95.0° |
| C17 | C27 | C28 | C29 | 2.7° | 37.9° |
| C17 | C27 | C28 | H17 | 119.7° | 118.3° |
| C17 | C27 | C28 | H18 | 119.7° | 118.5° |
| C27 | C17 | C16 | H12 | 146.1° | 142.9° |
| C17 | C27 | C28 | H15 | 116.9° | 80.7° |
| C17 | C27 | C28 | H16 | 122.3° | 156.7° |
| C17 | C27 | H17 | H18 | 120.8° | 123.4° |
| C27 | C17 | C18 | H20 | 111.1° | 49.7° |
| C27 | C17 | C18 | H21 | 7.2° | 169.7° |
| C29 | C28 | C27 | H15 | 119.6° | 118.7° |
| C29 | C28 | C27 | H16 | 119.6° | 118.8° |
| C28 | C29 | C16 | H12 | 144.6° | 119.3° |
| C28 | C29 | H13 | H14 | 121.4° | 121.4° |
| C29 | C28 | H15 | H16 | 121.1° | 122.6° |
| C29 | C28 | C27 | H17 | 117.0° | 156.2° |
| C29 | C28 | C27 | H18 | 122.4° | 80.6° |
| C27 | C28 | C29 | H13 | 103.2° | 142.9° |
| C27 | C28 | C29 | H14 | 135.9° | 95.7° |
| C27 | C28 | H15 | H16 | 121.1° | 122.7° |
| C28 | C27 | H17 | H18 | 120.9° | 123.3° |
| C28 | C27 | C17 | H19 | 95.1° | 80.7° |
| H2 | C7 | C6 | H3 | 0.2° | 0.1° |
| H4 | C1 | C2 | H9 | 53.9° | 177.8° |
| H4 | C1 | C2 | H10 | 173.1° | 57.6° |
| H4 | C1 | C | H28 | 169.8° | 57.6° |
| H4 | C1 | C | H29 | 50.4° | 177.7° |
| H5 | C4 | C | H28 | 49.5° | 59.1° |
| H5 | C4 | C | H29 | 69.9° | 179.2° |
| H6 | C4 | C | H28 | 168.8° | 60.9° |
| H6 | C4 | C | H29 | 49.4° | 59.3° |
| H7 | C3 | C2 | H9 | 55.3° | 59.2° |
| H7 | C3 | C2 | H10 | 174.6° | 60.9° |
| H8 | C3 | C2 | H9 | 64.8° | 179.2° |
| H8 | C3 | C2 | H10 | 54.5° | 59.1° |
| H11 | N2 | C16 | H12 | 172.5° | 146.4° |
| H12 | C16 | C29 | H13 | 25.0° | 0.0° |
| H12 | C16 | C29 | H14 | 95.9° | 121.4° |
| H12 | C16 | C17 | H19 | 30.4° | 24.3° |
| H13 | C29 | C28 | H15 | 16.4° | 24.3° |
| H13 | C29 | C28 | H16 | 137.2° | 98.2° |
| H14 | C29 | C28 | H15 | 104.5° | 145.7° |
| H14 | C29 | C28 | H16 | 16.3° | 23.1° |
| H15 | C28 | C27 | H17 | 123.4° | 37.6° |
| H15 | C28 | C27 | H18 | 2.8° | 160.7° |
| H16 | C28 | C27 | H17 | 2.6° | 85.0° |
| H16 | C28 | C27 | H18 | 118.0° | 38.2° |
| H17 | C27 | C17 | H19 | 145.2° | 37.7° |
| H18 | C27 | C17 | H19 | 24.6° | 160.9° |
| H19 | C17 | C18 | H20 | 129.9° | 172.4° |
| H19 | C17 | C18 | H21 | 111.8° | 67.6° |
| H20 | C18 | C19 | H22 | 179.7° | 180.0° |
| H20 | C18 | C19 | H23 | 60.9° | 60.0° |
| H21 | C18 | C19 | H22 | 62.0° | 60.0° |
| H21 | C18 | C19 | H23 | 179.2° | NaN° |
| H24 | C21 | C22 | H25 | 0.1° | 0.0° |
| H25 | C22 | C23 | H26 | 0.2° | 0.0° |
| H26 | C23 | C24 | H27 | 0.1° | 0.1° |
| H30 | C13 | C12 | H31 | 0.0° | 0.6° |
| H31 | C12 | C11 | H32 | 0.2° | 0.7° |
| H33 | C14 | H34 | H35 | 119.9° | 120.0° |
