9L7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C37 | C39 | doub | 1.38Å | 1.38Å | Aromatic |
| C37 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| C39 | C38 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | C30 | doub | 1.40Å | 1.40Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
| C4 | C1 | sing | 1.37Å | 1.39Å | Aromatic |
| C28 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C26 | sing | 1.40Å | 1.40Å | Aromatic |
| C38 | C35 | doub | 1.38Å | 1.39Å | Aromatic |
| C32 | C36 | sing | 1.40Å | 1.40Å | Aromatic |
| N9 | C5 | sing | 1.35Å | 1.40Å | Aromatic |
| N9 | C8 | doub | 1.31Å | 1.32Å | Aromatic |
| C30 | C35 | sing | 1.40Å | 1.40Å | Aromatic |
| C30 | C27 | sing | 1.48Å | 1.50Å | |
| C5 | C6 | sing | 1.41Å | 1.39Å | Aromatic |
| C1 | C2 | doub | 1.39Å | 1.41Å | Aromatic |
| C23 | C22 | sing | 1.53Å | 1.52Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C27 | C26 | sing | 1.48Å | 1.50Å | |
| C27 | O31 | doub | 1.22Å | 1.23Å | |
| C26 | C29 | doub | 1.40Å | 1.40Å | Aromatic |
| C36 | C8 | sing | 1.48Å | 1.47Å | |
| C36 | C33 | doub | 1.40Å | 1.40Å | Aromatic |
| C8 | N7 | sing | 1.37Å | 1.38Å | Aromatic |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C24 | C25 | sing | 1.53Å | 1.54Å | |
| C21 | C14 | sing | 1.53Å | 1.53Å | |
| C25 | C14 | sing | 1.53Å | 1.54Å | |
| C29 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | N7 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| N7 | C10 | sing | 1.46Å | 1.49Å | |
| C14 | N12 | sing | 1.46Å | 1.45Å | |
| N12 | C11 | sing | 1.35Å | 1.33Å | |
| C10 | C11 | sing | 1.51Å | 1.53Å | |
| C10 | C15 | sing | 1.53Å | 1.54Å | |
| C11 | O13 | doub | 1.21Å | 1.23Å | |
| C16 | C15 | sing | 1.53Å | 1.56Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C15 | C20 | sing | 1.53Å | 1.54Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| C18 | C19 | sing | 1.53Å | 1.55Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| N12 | H3 | sing | 0.97Å | 1.00Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C28 | H15 | sing | 1.08Å | 1.08Å | |
| C1 | H16 | sing | 1.08Å | 1.08Å | |
| C2 | H17 | sing | 1.08Å | 1.08Å | |
| C3 | H18 | sing | 1.08Å | 1.08Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C32 | H30 | sing | 1.08Å | 1.08Å | |
| C34 | H31 | sing | 1.08Å | 1.08Å | |
| C37 | H32 | sing | 1.08Å | 1.08Å | |
| C39 | H33 | sing | 1.08Å | 1.08Å | |
| C38 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C29 | H36 | sing | 1.08Å | 1.08Å | |
| C33 | H37 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C39 | C37 | C34 | 120.4° | 120.2° |
| C37 | C39 | C38 | 119.8° | 120.3° |
| C39 | C37 | H32 | 119.8° | 119.9° |
| C37 | C39 | H33 | 120.1° | 119.9° |
| C37 | C34 | C30 | 120.5° | 119.8° |
| C37 | C34 | H31 | 119.7° | 120.1° |
| C34 | C37 | H32 | 119.8° | 119.9° |
| C39 | C38 | C35 | 120.2° | 120.1° |
| C38 | C39 | H33 | 120.1° | 119.8° |
| C39 | C38 | H34 | 119.9° | 119.9° |
| C34 | C30 | C35 | 118.6° | 119.7° |
| C34 | C30 | C27 | 119.9° | 120.1° |
| C30 | C34 | H31 | 119.7° | 120.1° |
| C5 | C4 | C1 | 119.0° | 119.9° |
| C4 | C5 | N9 | 129.8° | 133.4° |
| C4 | C5 | C6 | 119.6° | 119.4° |
| C5 | C4 | H1 | 120.5° | 120.0° |
| C4 | C1 | C2 | 120.8° | 120.6° |
| C1 | C4 | H1 | 120.5° | 120.1° |
| C4 | C1 | H16 | 119.6° | 119.6° |
| C32 | C28 | C26 | 120.7° | 120.0° |
| C28 | C32 | C36 | 120.8° | 120.0° |
| C32 | C28 | H15 | 119.6° | 120.0° |
| C28 | C32 | H30 | 119.6° | 120.0° |
| C28 | C26 | C27 | 121.8° | 120.0° |
| C28 | C26 | C29 | 118.5° | 120.0° |
| C26 | C28 | H15 | 119.7° | 120.0° |
| C38 | C35 | C30 | 120.4° | 119.9° |
| C35 | C38 | H34 | 119.9° | 119.9° |
| C38 | C35 | H35 | 119.8° | 120.0° |
| C32 | C36 | C8 | 118.6° | 120.0° |
| C32 | C36 | C33 | 118.6° | 120.0° |
| C36 | C32 | H30 | 119.6° | 120.0° |
| C5 | N9 | C8 | 105.0° | 109.6° |
| N9 | C5 | C6 | 110.6° | 107.1° |
| N9 | C8 | C36 | 123.6° | 125.1° |
| N9 | C8 | N7 | 112.7° | 109.8° |
| C35 | C30 | C27 | 121.5° | 120.2° |
| C30 | C35 | H35 | 119.8° | 120.1° |
| C30 | C27 | C26 | 121.6° | 120.0° |
| C30 | C27 | O31 | 119.1° | 120.0° |
| C5 | C6 | N7 | 104.8° | 106.3° |
| C5 | C6 | C3 | 122.5° | 119.8° |
| C1 | C2 | C3 | 120.5° | 120.5° |
| C2 | C1 | H16 | 119.6° | 119.7° |
| C1 | C2 | H17 | 119.7° | 119.7° |
| C22 | C23 | C24 | 110.8° | 109.5° |
| C23 | C22 | C21 | 111.3° | 109.5° |
| C23 | C22 | H11 | 109.0° | 109.5° |
| C23 | C22 | H12 | 109.0° | 109.5° |
| C22 | C23 | H20 | 109.2° | 109.4° |
| C22 | C23 | H21 | 109.1° | 109.5° |
| C23 | C24 | C25 | 111.3° | 109.4° |
| C23 | C24 | H13 | 109.0° | 109.5° |
| C23 | C24 | H14 | 109.0° | 109.4° |
| C24 | C23 | H20 | 109.2° | 109.5° |
| C24 | C23 | H21 | 109.2° | 109.5° |
| C26 | C27 | O31 | 119.3° | 120.0° |
| C27 | C26 | C29 | 119.7° | 120.0° |
| C26 | C29 | C33 | 120.8° | 120.0° |
| C26 | C29 | H36 | 119.6° | 120.0° |
| C8 | C36 | C33 | 122.8° | 120.0° |
| C36 | C8 | N7 | 123.7° | 125.1° |
| C36 | C33 | C29 | 120.5° | 120.0° |
| C36 | C33 | H37 | 119.7° | 119.9° |
| C8 | N7 | C6 | 106.9° | 107.2° |
| C8 | N7 | C10 | 125.0° | 126.4° |
| C22 | C21 | C14 | 111.5° | 109.5° |
| C22 | C21 | H9 | 109.0° | 109.5° |
| C22 | C21 | H10 | 109.0° | 109.5° |
| C21 | C22 | H11 | 109.0° | 109.5° |
| C21 | C22 | H12 | 109.0° | 109.5° |
| C24 | C25 | C14 | 111.4° | 109.5° |
| C25 | C24 | H13 | 109.0° | 109.5° |
| C25 | C24 | H14 | 109.0° | 109.5° |
| C24 | C25 | H22 | 109.0° | 109.4° |
| C24 | C25 | H23 | 109.0° | 109.5° |
| C21 | C14 | C25 | 111.4° | 109.5° |
| C21 | C14 | N12 | 110.8° | 109.5° |
| C14 | C21 | H9 | 109.0° | 109.4° |
| C14 | C21 | H10 | 109.0° | 109.5° |
| C21 | C14 | H19 | 108.0° | 109.4° |
| C25 | C14 | N12 | 109.9° | 109.5° |
| C25 | C14 | H19 | 107.8° | 109.5° |
| C14 | C25 | H22 | 108.9° | 109.5° |
| C14 | C25 | H23 | 109.0° | 109.5° |
| C33 | C29 | H36 | 119.6° | 120.0° |
| C29 | C33 | H37 | 119.7° | 120.0° |
| N7 | C6 | C3 | 132.7° | 134.0° |
| C6 | N7 | C10 | 128.1° | 126.5° |
| C6 | C3 | C2 | 117.6° | 119.7° |
| C6 | C3 | H18 | 121.2° | 120.1° |
| C3 | C2 | H17 | 119.7° | 119.8° |
| C2 | C3 | H18 | 121.2° | 120.2° |
| N7 | C10 | C11 | 109.9° | 109.5° |
| N7 | C10 | C15 | 114.1° | 109.5° |
| N7 | C10 | H2 | 107.1° | 109.5° |
| C14 | N12 | C11 | 122.9° | 120.0° |
| C14 | N12 | H3 | 118.5° | 120.0° |
| N12 | C14 | H19 | 108.9° | 109.5° |
| N12 | C11 | C10 | 115.4° | 120.0° |
| N12 | C11 | O13 | 123.2° | 120.0° |
| C11 | N12 | H3 | 118.6° | 119.9° |
| C11 | C10 | C15 | 112.1° | 109.4° |
| C10 | C11 | O13 | 121.4° | 120.0° |
| C11 | C10 | H2 | 106.6° | 109.5° |
| C10 | C15 | C16 | 112.3° | 109.5° |
| C10 | C15 | C20 | 111.4° | 109.5° |
| C15 | C10 | H2 | 106.6° | 109.5° |
| C10 | C15 | H4 | 108.0° | 109.5° |
| C15 | C16 | C17 | 111.9° | 109.5° |
| C16 | C15 | C20 | 109.5° | 109.4° |
| C16 | C15 | H4 | 107.7° | 109.4° |
| C15 | C16 | H24 | 108.8° | 109.5° |
| C15 | C16 | H25 | 108.9° | 109.5° |
| C16 | C17 | C18 | 111.3° | 109.5° |
| C16 | C17 | H5 | 109.0° | 109.5° |
| C16 | C17 | H6 | 109.0° | 109.4° |
| C17 | C16 | H24 | 108.9° | 109.4° |
| C17 | C16 | H25 | 108.9° | 109.5° |
| C15 | C20 | C19 | 111.8° | 109.5° |
| C20 | C15 | H4 | 107.9° | 109.5° |
| C15 | C20 | H7 | 108.9° | 109.4° |
| C15 | C20 | H8 | 108.9° | 109.5° |
| C17 | C18 | C19 | 111.4° | 109.4° |
| C18 | C17 | H5 | 109.0° | 109.5° |
| C18 | C17 | H6 | 109.0° | 109.5° |
| C17 | C18 | H26 | 109.0° | 109.5° |
| C17 | C18 | H27 | 109.0° | 109.5° |
| C20 | C19 | C18 | 111.3° | 109.5° |
| C19 | C20 | H7 | 108.9° | 109.4° |
| C19 | C20 | H8 | 108.9° | 109.5° |
| C20 | C19 | H28 | 109.0° | 109.5° |
| C20 | C19 | H29 | 109.0° | 109.5° |
| C19 | C18 | H26 | 109.0° | 109.5° |
| C19 | C18 | H27 | 109.0° | 109.5° |
| C18 | C19 | H28 | 109.0° | 109.5° |
| C18 | C19 | H29 | 109.0° | 109.5° |
| H5 | C17 | H6 | 109.5° | 109.5° |
| H7 | C20 | H8 | 109.5° | 109.5° |
| H9 | C21 | H10 | 109.5° | 109.5° |
| H11 | C22 | H12 | 109.5° | 109.4° |
| H13 | C24 | H14 | 109.5° | 109.5° |
| H20 | C23 | H21 | 109.4° | 109.5° |
| H22 | C25 | H23 | 109.5° | 109.5° |
| H24 | C16 | H25 | 109.5° | 109.5° |
| H26 | C18 | H27 | 109.4° | 109.5° |
| H28 | C19 | H29 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C39 | C37 | C34 | H32 | 180.0° | 180.0° |
| C37 | C39 | C38 | H33 | 180.0° | 179.9° |
| C39 | C37 | C34 | C30 | 0.1° | 0.0° |
| C37 | C39 | C38 | C35 | 0.0° | 0.1° |
| C39 | C37 | C34 | H31 | 179.9° | 180.0° |
| C37 | C39 | C38 | H34 | 180.0° | 180.0° |
| C34 | C37 | C39 | C38 | 0.1° | 0.0° |
| C37 | C34 | C30 | H31 | 180.0° | 179.9° |
| C37 | C34 | C30 | C35 | 0.3° | 0.0° |
| C37 | C34 | C30 | C27 | 179.8° | 179.7° |
| C34 | C37 | C39 | H33 | 179.9° | 179.9° |
| C39 | C38 | C35 | H34 | 180.0° | 179.9° |
| C39 | C38 | C35 | C30 | 0.1° | 0.1° |
| C38 | C39 | C37 | H32 | 180.0° | 180.0° |
| C39 | C38 | C35 | H35 | 179.8° | 179.7° |
| C34 | C30 | C35 | C38 | 0.3° | 0.1° |
| C34 | C30 | C35 | C27 | 179.6° | 179.7° |
| C34 | C30 | C27 | C26 | 139.3° | 23.0° |
| C34 | C30 | C27 | O31 | 40.8° | 157.1° |
| C30 | C34 | C37 | H32 | 179.9° | 180.0° |
| C34 | C30 | C35 | H35 | 179.7° | 179.8° |
| C5 | C4 | C1 | H1 | 180.0° | 179.7° |
| C4 | C5 | N9 | C6 | 179.9° | 180.0° |
| C4 | C5 | N9 | C8 | 179.9° | 179.9° |
| C5 | C4 | C1 | C2 | 0.2° | 0.1° |
| C4 | C5 | C6 | N7 | 180.0° | 180.0° |
| C4 | C5 | C6 | C3 | 0.1° | 0.0° |
| C5 | C4 | C1 | H16 | 179.8° | 180.0° |
| C1 | C4 | C5 | N9 | 179.8° | 180.0° |
| C1 | C4 | C5 | C6 | 0.1° | 0.1° |
| C4 | C1 | C2 | H16 | 180.0° | 179.9° |
| C4 | C1 | C2 | C3 | 0.2° | 0.1° |
| C4 | C1 | C2 | H17 | 179.7° | 180.0° |
| C32 | C28 | C26 | H15 | 180.0° | 180.0° |
| C28 | C32 | C36 | H30 | 180.0° | 180.0° |
| C32 | C28 | C26 | C27 | 179.9° | 179.8° |
| C32 | C28 | C26 | C29 | 0.1° | 0.1° |
| C28 | C32 | C36 | C8 | 179.5° | 179.9° |
| C28 | C32 | C36 | C33 | 0.4° | 0.0° |
| C26 | C28 | C32 | C36 | 0.2° | 0.1° |
| C28 | C26 | C27 | C30 | 24.6° | 157.7° |
| C28 | C26 | C27 | C29 | 179.8° | 179.7° |
| C28 | C26 | C27 | O31 | 155.5° | 22.4° |
| C28 | C26 | C29 | C33 | 0.2° | 0.1° |
| C26 | C28 | C32 | H30 | 179.8° | 179.9° |
| C28 | C26 | C29 | H36 | 179.8° | 180.0° |
| C38 | C35 | C30 | H35 | 180.0° | 179.8° |
| C38 | C35 | C30 | C27 | 179.9° | 179.7° |
| C35 | C38 | C39 | H33 | 180.0° | 180.0° |
| C32 | C36 | C8 | N9 | 68.9° | 146.4° |
| C32 | C36 | C8 | C33 | 179.1° | 180.0° |
| C32 | C36 | C8 | N7 | 110.1° | 33.4° |
| C32 | C36 | C33 | C29 | 0.3° | 0.0° |
| C36 | C32 | C28 | H15 | 179.8° | 180.0° |
| C32 | C36 | C33 | H37 | 179.7° | 180.0° |
| C5 | N9 | C8 | C36 | 179.2° | 180.0° |
| C5 | N9 | C8 | N7 | 0.0° | 0.1° |
| N9 | C5 | C6 | N7 | 0.0° | 0.0° |
| N9 | C5 | C6 | C3 | 179.9° | 180.0° |
| N9 | C5 | C4 | H1 | 0.2° | 0.3° |
| C8 | N9 | C5 | C6 | 0.0° | 0.0° |
| N9 | C8 | C36 | N7 | 179.1° | 179.9° |
| N9 | C8 | C36 | C33 | 111.9° | 33.6° |
| N9 | C8 | N7 | C6 | 0.0° | 0.1° |
| N9 | C8 | N7 | C10 | 179.8° | 180.0° |
| C35 | C30 | C27 | C26 | 41.1° | 157.4° |
| C35 | C30 | C27 | O31 | 138.8° | 22.5° |
| C35 | C30 | C34 | H31 | 179.7° | 180.0° |
| C30 | C35 | C38 | H34 | 179.8° | 179.9° |
| C30 | C27 | C26 | O31 | 179.9° | 179.9° |
| C30 | C27 | C26 | C29 | 155.2° | 22.7° |
| C27 | C30 | C34 | H31 | 0.2° | 0.3° |
| C27 | C30 | C35 | H35 | 0.1° | 0.1° |
| C5 | C6 | N7 | C8 | 0.0° | 0.0° |
| C5 | C6 | N7 | C3 | 179.9° | 180.0° |
| C5 | C6 | C3 | C2 | 0.1° | 0.0° |
| C5 | C6 | N7 | C10 | 179.8° | 180.0° |
| C6 | C5 | C4 | H1 | 179.8° | 179.7° |
| C5 | C6 | C3 | H18 | 179.9° | 180.0° |
| C1 | C2 | C3 | C6 | 0.2° | 0.0° |
| C1 | C2 | C3 | H17 | 180.0° | 179.9° |
| C2 | C1 | C4 | H1 | 179.7° | 179.7° |
| C1 | C2 | C3 | H18 | 179.9° | 180.0° |
| C22 | C23 | C24 | H20 | 120.2° | 120.0° |
| C22 | C23 | C24 | H21 | 120.2° | 120.0° |
| C23 | C22 | C21 | H11 | 120.3° | 120.0° |
| C23 | C22 | C21 | H12 | 120.3° | 120.0° |
| C22 | C23 | C24 | C25 | 56.6° | 60.0° |
| C23 | C22 | C21 | C14 | 55.9° | 60.0° |
| C23 | C22 | C21 | H9 | 64.5° | 60.0° |
| C23 | C22 | C21 | H10 | 176.2° | 180.0° |
| C23 | C22 | H11 | H12 | 119.1° | 120.0° |
| C22 | C23 | C24 | H13 | 63.7° | 60.0° |
| C22 | C23 | C24 | H14 | 176.8° | 180.0° |
| C22 | C23 | H20 | H21 | 119.4° | 120.0° |
| C24 | C23 | C22 | C21 | 57.0° | 60.0° |
| C23 | C24 | C25 | H13 | 120.3° | 120.0° |
| C23 | C24 | C25 | H14 | 120.3° | 119.9° |
| C23 | C24 | C25 | C14 | 54.8° | 60.0° |
| C24 | C23 | C22 | H11 | 177.3° | 60.0° |
| C24 | C23 | C22 | H12 | 63.3° | 180.0° |
| C23 | C24 | H13 | H14 | 119.2° | 120.0° |
| C24 | C23 | H20 | H21 | 119.4° | 120.1° |
| C23 | C24 | C25 | H22 | 175.1° | 180.0° |
| C23 | C24 | C25 | H23 | 65.5° | 60.0° |
| C27 | C26 | C29 | C33 | 179.9° | 179.7° |
| C27 | C26 | C28 | H15 | 0.0° | 0.3° |
| C27 | C26 | C29 | H36 | 0.1° | 0.4° |
| O31 | C27 | C26 | C29 | 24.6° | 157.3° |
| C26 | C29 | C33 | C36 | 0.0° | 0.0° |
| C26 | C29 | C33 | H36 | 180.0° | 179.9° |
| C29 | C26 | C28 | H15 | 179.9° | 180.0° |
| C26 | C29 | C33 | H37 | 180.0° | 180.0° |
| C8 | C36 | C33 | C29 | 179.4° | 179.9° |
| C36 | C8 | N7 | C6 | 179.2° | 180.0° |
| C36 | C8 | N7 | C10 | 0.7° | 0.1° |
| C8 | C36 | C32 | H30 | 0.5° | 0.1° |
| C8 | C36 | C33 | H37 | 0.6° | 0.0° |
| C33 | C36 | C8 | N7 | 69.0° | 146.5° |
| C36 | C33 | C29 | H37 | 180.0° | 180.0° |
| C33 | C36 | C32 | H30 | 179.6° | 180.0° |
| C36 | C33 | C29 | H36 | 180.0° | 179.9° |
| C8 | N7 | C6 | C10 | 179.9° | 180.0° |
| C8 | N7 | C6 | C3 | 179.8° | 180.0° |
| C8 | N7 | C10 | C11 | 119.0° | 67.7° |
| C8 | N7 | C10 | C15 | 114.1° | 172.4° |
| C8 | N7 | C10 | H2 | 3.6° | 52.4° |
| C22 | C21 | C14 | H9 | 120.3° | 120.0° |
| C22 | C21 | C14 | H10 | 120.3° | 120.0° |
| C22 | C21 | C14 | C25 | 53.7° | 60.0° |
| C22 | C21 | C14 | N12 | 176.4° | 180.0° |
| C22 | C21 | H9 | H10 | 119.1° | 120.0° |
| C21 | C22 | H11 | H12 | 119.2° | 120.0° |
| C22 | C21 | C14 | H19 | 64.4° | 60.0° |
| C21 | C22 | C23 | H20 | 177.2° | 180.0° |
| C21 | C22 | C23 | H21 | 63.2° | 60.0° |
| C24 | C25 | C14 | C21 | 53.3° | 60.0° |
| C24 | C25 | C14 | H22 | 120.3° | 120.0° |
| C24 | C25 | C14 | H23 | 120.3° | 120.0° |
| C24 | C25 | C14 | N12 | 176.5° | 180.0° |
| C25 | C24 | H13 | H14 | 119.1° | 120.0° |
| C24 | C25 | C14 | H19 | 64.9° | 59.9° |
| C25 | C24 | C23 | H20 | 176.8° | 180.0° |
| C25 | C24 | C23 | H21 | 63.6° | 60.0° |
| C24 | C25 | H22 | H23 | 119.1° | 120.0° |
| C21 | C14 | C25 | N12 | 123.2° | 120.0° |
| C21 | C14 | C25 | H19 | 118.2° | 119.9° |
| C21 | C14 | N12 | H19 | 118.6° | 120.0° |
| C21 | C14 | N12 | C11 | 109.4° | 155.0° |
| C21 | C14 | N12 | H3 | 70.6° | 25.1° |
| C14 | C21 | H9 | H10 | 119.1° | 120.0° |
| C14 | C21 | C22 | H11 | 176.1° | 60.0° |
| C14 | C21 | C22 | H12 | 64.4° | 180.0° |
| C21 | C14 | C25 | H22 | 173.6° | 179.9° |
| C21 | C14 | C25 | H23 | 67.0° | 60.0° |
| C25 | C14 | N12 | H19 | 117.9° | 120.0° |
| C25 | C14 | N12 | C11 | 127.1° | 85.0° |
| C25 | C14 | N12 | H3 | 52.9° | 94.9° |
| C25 | C14 | C21 | H9 | 66.6° | 60.0° |
| C25 | C14 | C21 | H10 | 174.0° | 180.0° |
| C14 | C25 | C24 | H13 | 65.5° | 60.0° |
| C14 | C25 | C24 | H14 | 175.1° | 180.0° |
| C14 | C25 | H22 | H23 | 119.1° | 120.0° |
| N7 | C6 | C3 | C2 | 179.9° | 180.0° |
| C6 | N7 | C10 | C11 | 60.8° | 112.3° |
| C6 | N7 | C10 | C15 | 66.0° | 7.6° |
| C6 | N7 | C10 | H2 | 176.3° | 127.6° |
| N7 | C6 | C3 | H18 | 0.1° | 0.0° |
| C6 | C3 | C2 | H18 | 180.0° | 180.0° |
| C3 | C6 | N7 | C10 | 0.3° | 0.0° |
| C6 | C3 | C2 | H17 | 179.8° | 179.9° |
| C3 | C2 | C1 | H16 | 179.8° | 180.0° |
| N7 | C10 | C11 | N12 | 43.9° | 151.7° |
| N7 | C10 | C11 | C15 | 128.0° | 120.0° |
| N7 | C10 | C11 | H2 | 115.8° | 120.1° |
| N7 | C10 | C15 | H2 | 118.0° | 120.0° |
| N7 | C10 | C11 | O13 | 136.0° | 28.2° |
| N7 | C10 | C15 | C16 | 36.7° | 65.7° |
| N7 | C10 | C15 | C20 | 159.9° | 174.3° |
| N7 | C10 | C15 | H4 | 81.8° | 54.3° |
| C14 | N12 | C11 | H3 | 180.0° | 179.9° |
| C14 | N12 | C11 | C10 | 179.9° | 175.2° |
| C14 | N12 | C11 | O13 | 0.2° | 4.7° |
| N12 | C14 | C21 | H9 | 56.1° | 60.0° |
| N12 | C14 | C21 | H10 | 63.3° | 60.0° |
| N12 | C14 | C25 | H22 | 63.2° | 60.0° |
| N12 | C14 | C25 | H23 | 56.2° | 60.0° |
| N12 | C11 | C10 | O13 | 179.9° | 179.9° |
| N12 | C11 | C10 | C15 | 171.9° | 88.3° |
| N12 | C11 | C10 | H2 | 71.9° | 31.7° |
| C11 | N12 | C14 | H19 | 9.2° | 35.1° |
| C11 | C10 | C15 | H2 | 116.2° | 120.0° |
| C11 | C10 | C15 | C16 | 162.5° | 174.3° |
| C11 | C10 | C15 | C20 | 74.4° | 54.3° |
| C10 | C11 | N12 | H3 | 0.1° | 4.9° |
| C11 | C10 | C15 | H4 | 43.9° | 65.7° |
| C15 | C10 | C11 | O13 | 8.0° | 91.8° |
| C10 | C15 | C16 | C20 | 124.2° | 120.0° |
| C10 | C15 | C16 | H4 | 118.7° | 120.0° |
| C10 | C15 | C16 | C17 | 179.6° | 180.0° |
| C10 | C15 | C20 | H4 | 118.3° | 120.1° |
| C10 | C15 | C20 | C19 | 179.2° | NaN° |
| C10 | C15 | C20 | H7 | 58.8° | 60.0° |
| C10 | C15 | C20 | H8 | 60.4° | 59.9° |
| C10 | C15 | C16 | H24 | 60.0° | 60.0° |
| C10 | C15 | C16 | H25 | 59.2° | 60.0° |
| O13 | C11 | C10 | H2 | 108.2° | 148.3° |
| O13 | C11 | N12 | H3 | 179.8° | 175.2° |
| C15 | C16 | C17 | H24 | 120.3° | 120.0° |
| C15 | C16 | C17 | H25 | 120.4° | 120.0° |
| C16 | C15 | C20 | H4 | 116.9° | 119.9° |
| C15 | C16 | C17 | C18 | 56.0° | 60.0° |
| C16 | C15 | C20 | C19 | 56.0° | 60.0° |
| C16 | C15 | C10 | H2 | 81.3° | 54.3° |
| C15 | C16 | C17 | H5 | 176.3° | 180.0° |
| C15 | C16 | C17 | H6 | 64.3° | 60.0° |
| C16 | C15 | C20 | H7 | 176.4° | 180.0° |
| C16 | C15 | C20 | H8 | 64.3° | 60.1° |
| C15 | C16 | H24 | H25 | 118.9° | 120.0° |
| C17 | C16 | C15 | C20 | 56.2° | 60.0° |
| C16 | C17 | C18 | H5 | 120.3° | 120.0° |
| C16 | C17 | C18 | H6 | 120.3° | 120.0° |
| C16 | C17 | C18 | C19 | 54.5° | 60.0° |
| C17 | C16 | C15 | H4 | 60.9° | 60.0° |
| C16 | C17 | H5 | H6 | 119.2° | 120.0° |
| C17 | C16 | H24 | H25 | 118.9° | 120.0° |
| C16 | C17 | C18 | H26 | 65.8° | 60.0° |
| C16 | C17 | C18 | H27 | 174.8° | 179.9° |
| C15 | C20 | C19 | H7 | 120.4° | 120.0° |
| C15 | C20 | C19 | H8 | 120.3° | 120.0° |
| C15 | C20 | C19 | C18 | 55.8° | 60.0° |
| C20 | C15 | C10 | H2 | 41.9° | 65.7° |
| C15 | C20 | H7 | H8 | 118.9° | 120.0° |
| C20 | C15 | C16 | H24 | 64.2° | 60.0° |
| C20 | C15 | C16 | H25 | 176.5° | 180.0° |
| C15 | C20 | C19 | H28 | 64.5° | 60.0° |
| C15 | C20 | C19 | H29 | 176.1° | 180.0° |
| C17 | C18 | C19 | C20 | 54.4° | 60.0° |
| C17 | C18 | C19 | H26 | 120.3° | 120.0° |
| C17 | C18 | C19 | H27 | 120.3° | 120.0° |
| C18 | C17 | H5 | H6 | 119.2° | 120.0° |
| C18 | C17 | C16 | H24 | 64.3° | 60.0° |
| C18 | C17 | C16 | H25 | 176.4° | 180.0° |
| C17 | C18 | H26 | H27 | 119.1° | 120.0° |
| C17 | C18 | C19 | H28 | 65.9° | 60.0° |
| C17 | C18 | C19 | H29 | 174.7° | 180.0° |
| C20 | C19 | C18 | H28 | 120.3° | 120.0° |
| C20 | C19 | C18 | H29 | 120.3° | 120.0° |
| C19 | C20 | C15 | H4 | 60.9° | 59.9° |
| C19 | C20 | H7 | H8 | 119.0° | 120.0° |
| C20 | C19 | C18 | H26 | 65.9° | 60.0° |
| C20 | C19 | C18 | H27 | 174.7° | 180.0° |
| C20 | C19 | H28 | H29 | 119.2° | 120.0° |
| C19 | C18 | C17 | H5 | 174.8° | 180.0° |
| C19 | C18 | C17 | H6 | 65.8° | 60.0° |
| C18 | C19 | C20 | H7 | 176.2° | 180.0° |
| C18 | C19 | C20 | H8 | 64.5° | 60.0° |
| C19 | C18 | H26 | H27 | 119.1° | 120.0° |
| C18 | C19 | H28 | H29 | 119.1° | 120.0° |
| H1 | C4 | C1 | H16 | 0.2° | 0.3° |
| H2 | C10 | C15 | H4 | 160.2° | 174.3° |
| H3 | N12 | C14 | H19 | 170.8° | 145.0° |
| H4 | C15 | C20 | H7 | 59.5° | 60.0° |
| H4 | C15 | C20 | H8 | 178.8° | 180.0° |
| H4 | C15 | C16 | H24 | 178.7° | 179.9° |
| H4 | C15 | C16 | H25 | 59.5° | 60.0° |
| H5 | C17 | C16 | H24 | 55.9° | 60.0° |
| H5 | C17 | C16 | H25 | 63.4° | 60.0° |
| H5 | C17 | C18 | H26 | 54.4° | 60.0° |
| H5 | C17 | C18 | H27 | 65.0° | 60.1° |
| H6 | C17 | C16 | H24 | 175.4° | 180.0° |
| H6 | C17 | C16 | H25 | 56.1° | 60.0° |
| H6 | C17 | C18 | H26 | 173.9° | 180.0° |
| H6 | C17 | C18 | H27 | 54.5° | 60.0° |
| H7 | C20 | C19 | H28 | 55.9° | 60.0° |
| H7 | C20 | C19 | H29 | 63.6° | 60.0° |
| H8 | C20 | C19 | H28 | 175.2° | 180.0° |
| H8 | C20 | C19 | H29 | 55.8° | 60.0° |
| H9 | C21 | C22 | H11 | 55.8° | 180.0° |
| H9 | C21 | C22 | H12 | 175.3° | 60.0° |
| H9 | C21 | C14 | H19 | 175.3° | 180.0° |
| H10 | C21 | C22 | H11 | 63.6° | 60.0° |
| H10 | C21 | C22 | H12 | 55.9° | 60.0° |
| H10 | C21 | C14 | H19 | 55.9° | 60.0° |
| H11 | C22 | C23 | H20 | 62.5° | 60.0° |
| H11 | C22 | C23 | H21 | 57.1° | 180.0° |
| H12 | C22 | C23 | H20 | 56.9° | 60.0° |
| H12 | C22 | C23 | H21 | 176.5° | 60.0° |
| H13 | C24 | C23 | H20 | 56.5° | 60.0° |
| H13 | C24 | C23 | H21 | 176.1° | 180.0° |
| H13 | C24 | C25 | H22 | 54.8° | 60.0° |
| H13 | C24 | C25 | H23 | 174.2° | 180.0° |
| H14 | C24 | C23 | H20 | 62.9° | 60.0° |
| H14 | C24 | C23 | H21 | 56.6° | 60.0° |
| H14 | C24 | C25 | H22 | 64.6° | 60.1° |
| H14 | C24 | C25 | H23 | 54.8° | 60.0° |
| H15 | C28 | C32 | H30 | 0.2° | 0.0° |
| H16 | C1 | C2 | H17 | 0.3° | 0.1° |
| H17 | C2 | C3 | H18 | 0.2° | 0.1° |
| H19 | C14 | C25 | H22 | 55.4° | 60.0° |
| H19 | C14 | C25 | H23 | 174.8° | 179.9° |
| H26 | C18 | C19 | H28 | 173.8° | 180.0° |
| H26 | C18 | C19 | H29 | 54.3° | 60.0° |
| H27 | C18 | C19 | H28 | 54.4° | 59.9° |
| H27 | C18 | C19 | H29 | 65.0° | 60.0° |
| H31 | C34 | C37 | H32 | 0.1° | 0.0° |
| H32 | C37 | C39 | H33 | 0.0° | 0.1° |
| H33 | C39 | C38 | H34 | 0.0° | 0.1° |
| H34 | C38 | C35 | H35 | 0.2° | 0.2° |
| H36 | C29 | C33 | H37 | 0.0° | 0.1° |
