BC7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F40 | C38 | sing | 1.40Å | 1.29Å | |
| F39 | C38 | sing | 1.40Å | 1.33Å | |
| C38 | F41 | sing | 1.40Å | 1.31Å | |
| C38 | C26 | sing | 1.51Å | 1.50Å | |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.39Å | 1.41Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| S29 | C27 | sing | 1.76Å | 1.76Å | |
| S29 | C30 | sing | 1.81Å | 1.80Å | |
| C27 | C28 | doub | 1.39Å | 1.39Å | Aromatic |
| O32 | C31 | doub | 1.21Å | 1.22Å | |
| C24 | C23 | doub | 1.39Å | 1.39Å | Aromatic |
| C30 | C31 | sing | 1.51Å | 1.49Å | |
| C28 | C23 | sing | 1.39Å | 1.38Å | Aromatic |
| C31 | N33 | sing | 1.35Å | 1.36Å | |
| C23 | C9 | sing | 1.48Å | 1.47Å | |
| O2 | C1 | doub | 1.21Å | 1.22Å | |
| N33 | C37 | sing | 1.47Å | 1.47Å | |
| N33 | C34 | sing | 1.47Å | 1.47Å | |
| C37 | C36 | sing | 1.54Å | 1.52Å | |
| C9 | N10 | doub | 1.32Å | 1.33Å | Aromatic |
| C9 | C7 | sing | 1.40Å | 1.42Å | Aromatic |
| C36 | C35 | sing | 1.55Å | 1.52Å | |
| C8 | C7 | sing | 1.51Å | 1.48Å | |
| C8 | N3 | sing | 1.47Å | 1.44Å | |
| C34 | C35 | sing | 1.55Å | 1.57Å | |
| C1 | N3 | sing | 1.35Å | 1.35Å | |
| C1 | C43 | sing | 1.51Å | 1.50Å | |
| N10 | N11 | sing | 1.40Å | 1.37Å | Aromatic |
| C7 | C6 | doub | 1.35Å | 1.35Å | Aromatic |
| N3 | C4 | sing | 1.47Å | 1.48Å | |
| N11 | C6 | sing | 1.35Å | 1.36Å | Aromatic |
| N11 | C12 | sing | 1.47Å | 1.43Å | |
| C6 | C5 | sing | 1.51Å | 1.50Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C13 | C15 | sing | 1.53Å | 1.52Å | |
| C13 | O14 | sing | 1.43Å | 1.44Å | |
| C21 | N16 | sing | 1.47Å | 1.47Å | |
| C21 | C20 | sing | 1.53Å | 1.55Å | |
| C15 | N16 | sing | 1.47Å | 1.48Å | |
| N16 | C17 | sing | 1.47Å | 1.46Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | C18 | sing | 1.53Å | 1.53Å | |
| C19 | C22 | sing | 1.53Å | 1.55Å | |
| O42 | C22 | sing | 1.43Å | 1.44Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C22 | C44 | sing | 1.53Å | 1.51Å | |
| C22 | C45 | sing | 1.53Å | 1.52Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.08Å | 1.08Å | |
| C25 | H20 | sing | 1.08Å | 1.08Å | |
| C28 | H21 | sing | 1.08Å | 1.08Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| C34 | H26 | sing | 1.09Å | 1.10Å | |
| C34 | H27 | sing | 1.09Å | 1.10Å | |
| C35 | H28 | sing | 1.09Å | 1.10Å | |
| C35 | H29 | sing | 1.09Å | 1.10Å | |
| C36 | H30 | sing | 1.09Å | 1.10Å | |
| C36 | H31 | sing | 1.09Å | 1.10Å | |
| C37 | H32 | sing | 1.09Å | 1.10Å | |
| C37 | H33 | sing | 1.09Å | 1.10Å | |
| C43 | H34 | sing | 1.09Å | 1.10Å | |
| C43 | H35 | sing | 1.09Å | 1.10Å | |
| C43 | H36 | sing | 1.09Å | 1.10Å | |
| C44 | H37 | sing | 1.09Å | 1.10Å | |
| C44 | H38 | sing | 1.09Å | 1.10Å | |
| C44 | H39 | sing | 1.09Å | 1.10Å | |
| C45 | H40 | sing | 1.09Å | 1.10Å | |
| C45 | H41 | sing | 1.09Å | 1.10Å | |
| C45 | H42 | sing | 1.09Å | 1.10Å | |
| O14 | H44 | sing | 0.97Å | 0.95Å | |
| O42 | H45 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F40 | C38 | F39 | 105.8° | 109.5° |
| F40 | C38 | F41 | 106.1° | 109.5° |
| F40 | C38 | C26 | 112.5° | 109.4° |
| F39 | C38 | F41 | 106.0° | 109.5° |
| F39 | C38 | C26 | 112.6° | 109.5° |
| F41 | C38 | C26 | 113.2° | 109.4° |
| C38 | C26 | C25 | 119.6° | 119.9° |
| C38 | C26 | C27 | 122.1° | 119.9° |
| C25 | C26 | C27 | 118.3° | 120.2° |
| C26 | C25 | C24 | 121.2° | 120.2° |
| C26 | C25 | H20 | 119.4° | 119.9° |
| C26 | C27 | S29 | 122.0° | 120.1° |
| C26 | C27 | C28 | 119.9° | 119.9° |
| C25 | C24 | C23 | 120.4° | 120.0° |
| C25 | C24 | H19 | 119.8° | 120.0° |
| C24 | C25 | H20 | 119.4° | 119.9° |
| C27 | S29 | C30 | 100.5° | 103.0° |
| S29 | C27 | C28 | 118.0° | 120.0° |
| S29 | C30 | C31 | 110.1° | 109.5° |
| S29 | C30 | H24 | 109.3° | 109.4° |
| S29 | C30 | H25 | 109.3° | 109.5° |
| C27 | C28 | C23 | 120.7° | 119.8° |
| C27 | C28 | H21 | 119.7° | 120.1° |
| O32 | C31 | C30 | 120.0° | 120.0° |
| O32 | C31 | N33 | 122.1° | 120.0° |
| C24 | C23 | C28 | 119.4° | 119.9° |
| C24 | C23 | C9 | 122.0° | 120.1° |
| C23 | C24 | H19 | 119.8° | 120.0° |
| C30 | C31 | N33 | 117.9° | 120.0° |
| C31 | C30 | H24 | 109.3° | 109.5° |
| C31 | C30 | H25 | 109.3° | 109.5° |
| C28 | C23 | C9 | 118.5° | 120.0° |
| C23 | C28 | H21 | 119.6° | 120.1° |
| C31 | N33 | C37 | 123.8° | 125.7° |
| C31 | N33 | C34 | 124.6° | 125.7° |
| C23 | C9 | N10 | 119.7° | 126.1° |
| C23 | C9 | C7 | 128.7° | 126.2° |
| O2 | C1 | N3 | 120.8° | 120.1° |
| O2 | C1 | C43 | 121.4° | 119.9° |
| C37 | N33 | C34 | 111.6° | 108.7° |
| N33 | C37 | C36 | 103.5° | 107.3° |
| N33 | C37 | H32 | 110.9° | 109.9° |
| N33 | C37 | H33 | 110.9° | 110.0° |
| N33 | C34 | C35 | 103.9° | 104.9° |
| N33 | C34 | H26 | 110.8° | 110.4° |
| N33 | C34 | H27 | 110.8° | 110.4° |
| C37 | C36 | C35 | 105.9° | 103.0° |
| C37 | C36 | H30 | 110.3° | 110.7° |
| C37 | C36 | H31 | 110.3° | 110.9° |
| C36 | C37 | H32 | 111.0° | 109.9° |
| C36 | C37 | H33 | 110.9° | 109.9° |
| N10 | C9 | C7 | 111.5° | 107.7° |
| C9 | N10 | N11 | 103.7° | 108.1° |
| C9 | C7 | C8 | 132.3° | 127.9° |
| C9 | C7 | C6 | 105.2° | 108.2° |
| C36 | C35 | C34 | 106.1° | 101.5° |
| C36 | C35 | H28 | 110.3° | 111.0° |
| C36 | C35 | H29 | 110.3° | 111.0° |
| C35 | C36 | H30 | 110.4° | 110.7° |
| C35 | C36 | H31 | 110.4° | 110.7° |
| C7 | C8 | N3 | 108.6° | 107.3° |
| C8 | C7 | C6 | 122.5° | 123.9° |
| C7 | C8 | H5 | 109.7° | 109.9° |
| C7 | C8 | H6 | 109.7° | 109.9° |
| C8 | N3 | C1 | 122.6° | 120.8° |
| C8 | N3 | C4 | 115.4° | 118.3° |
| N3 | C8 | H5 | 109.7° | 109.9° |
| N3 | C8 | H6 | 109.7° | 109.9° |
| C35 | C34 | H26 | 110.8° | 110.4° |
| C35 | C34 | H27 | 110.8° | 110.4° |
| C34 | C35 | H28 | 110.3° | 111.0° |
| C34 | C35 | H29 | 110.3° | 111.0° |
| N3 | C1 | C43 | 117.7° | 120.0° |
| C1 | N3 | C4 | 122.0° | 120.8° |
| C1 | C43 | H34 | 109.5° | 109.5° |
| C1 | C43 | H35 | 109.5° | 109.5° |
| C1 | C43 | H36 | 109.5° | 109.4° |
| N10 | N11 | C6 | 112.4° | 108.1° |
| N10 | N11 | C12 | 118.1° | 125.9° |
| C7 | C6 | N11 | 107.2° | 107.8° |
| C7 | C6 | C5 | 125.1° | 124.5° |
| N3 | C4 | C5 | 113.0° | 109.2° |
| N3 | C4 | H1 | 108.6° | 109.5° |
| N3 | C4 | H2 | 108.6° | 109.5° |
| C6 | N11 | C12 | 129.5° | 125.9° |
| N11 | C6 | C5 | 127.6° | 127.7° |
| N11 | C12 | C13 | 108.6° | 109.5° |
| N11 | C12 | H7 | 109.7° | 109.4° |
| N11 | C12 | H8 | 109.7° | 109.5° |
| C6 | C5 | C4 | 110.1° | 108.8° |
| C6 | C5 | H3 | 109.3° | 109.5° |
| C6 | C5 | H4 | 109.3° | 109.7° |
| C5 | C4 | H1 | 108.6° | 109.5° |
| C5 | C4 | H2 | 108.6° | 109.5° |
| C4 | C5 | H3 | 109.3° | 109.6° |
| C4 | C5 | H4 | 109.3° | 109.6° |
| C12 | C13 | C15 | 112.8° | 109.4° |
| C12 | C13 | O14 | 108.2° | 109.5° |
| C13 | C12 | H7 | 109.7° | 109.5° |
| C13 | C12 | H8 | 109.7° | 109.5° |
| C12 | C13 | H9 | 107.1° | 109.4° |
| C15 | C13 | O14 | 113.1° | 109.5° |
| C13 | C15 | N16 | 114.4° | 109.4° |
| C15 | C13 | H9 | 107.2° | 109.5° |
| C13 | C15 | H10 | 108.2° | 109.5° |
| C13 | C15 | H11 | 108.2° | 109.5° |
| O14 | C13 | H9 | 108.2° | 109.5° |
| C13 | O14 | H44 | 109.5° | 114.0° |
| N16 | C21 | C20 | 111.6° | 109.5° |
| C21 | N16 | C15 | 115.9° | 111.0° |
| C21 | N16 | C17 | 110.0° | 111.2° |
| N16 | C21 | H22 | 108.9° | 109.5° |
| N16 | C21 | H23 | 108.9° | 109.5° |
| C21 | C20 | C19 | 112.6° | 109.2° |
| C21 | C20 | H17 | 108.7° | 109.5° |
| C21 | C20 | H18 | 108.7° | 109.6° |
| C20 | C21 | H22 | 109.0° | 109.5° |
| C20 | C21 | H23 | 108.9° | 109.4° |
| C15 | N16 | C17 | 111.2° | 111.0° |
| N16 | C15 | H10 | 108.2° | 109.5° |
| N16 | C15 | H11 | 108.2° | 109.5° |
| N16 | C17 | C18 | 110.9° | 109.5° |
| N16 | C17 | H12 | 109.1° | 109.4° |
| N16 | C17 | H13 | 109.1° | 109.5° |
| C20 | C19 | C18 | 109.2° | 109.2° |
| C20 | C19 | C22 | 113.8° | 109.5° |
| C20 | C19 | H14 | 106.9° | 109.6° |
| C19 | C20 | H17 | 108.7° | 109.5° |
| C19 | C20 | H18 | 108.7° | 109.5° |
| C18 | C19 | C22 | 113.0° | 109.5° |
| C19 | C18 | C17 | 111.9° | 109.2° |
| C18 | C19 | H14 | 106.9° | 109.5° |
| C19 | C18 | H15 | 108.9° | 109.5° |
| C19 | C18 | H16 | 108.9° | 109.5° |
| C19 | C22 | O42 | 108.5° | 109.5° |
| C19 | C22 | C44 | 112.0° | 109.5° |
| C19 | C22 | C45 | 111.5° | 109.5° |
| C22 | C19 | H14 | 106.6° | 109.5° |
| O42 | C22 | C44 | 106.5° | 109.5° |
| O42 | C22 | C45 | 107.9° | 109.5° |
| C22 | O42 | H45 | 109.5° | 114.0° |
| C18 | C17 | H12 | 109.1° | 109.4° |
| C18 | C17 | H13 | 109.1° | 109.5° |
| C17 | C18 | H15 | 108.9° | 109.5° |
| C17 | C18 | H16 | 108.9° | 109.5° |
| C44 | C22 | C45 | 110.3° | 109.4° |
| C22 | C44 | H37 | 109.5° | 109.5° |
| C22 | C44 | H38 | 109.5° | 109.5° |
| C22 | C44 | H39 | 109.5° | 109.4° |
| C22 | C45 | H40 | 109.5° | 109.5° |
| C22 | C45 | H41 | 109.5° | 109.5° |
| C22 | C45 | H42 | 109.5° | 109.5° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H3 | C5 | H4 | 109.5° | 109.6° |
| H5 | C8 | H6 | 109.5° | 109.9° |
| H7 | C12 | H8 | 109.5° | 109.5° |
| H10 | C15 | H11 | 109.5° | 109.5° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H15 | C18 | H16 | 109.5° | 109.6° |
| H17 | C20 | H18 | 109.5° | 109.5° |
| H22 | C21 | H23 | 109.5° | 109.4° |
| H24 | C30 | H25 | 109.5° | 109.5° |
| H26 | C34 | H27 | 109.5° | 110.3° |
| H28 | C35 | H29 | 109.5° | 110.9° |
| H30 | C36 | H31 | 109.5° | 110.6° |
| H32 | C37 | H33 | 109.5° | 109.9° |
| H34 | C43 | H35 | 109.4° | 109.5° |
| H34 | C43 | H36 | 109.5° | 109.4° |
| H35 | C43 | H36 | 109.5° | 109.5° |
| H37 | C44 | H38 | 109.5° | 109.5° |
| H37 | C44 | H39 | 109.5° | 109.5° |
| H38 | C44 | H39 | 109.5° | 109.5° |
| H40 | C45 | H41 | 109.4° | 109.5° |
| H40 | C45 | H42 | 109.5° | 109.4° |
| H41 | C45 | H42 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F40 | C38 | F39 | F41 | 112.4° | 120.1° |
| F40 | C38 | F39 | C26 | 123.3° | 120.0° |
| F40 | C38 | F41 | C26 | 123.9° | 120.0° |
| F40 | C38 | C26 | C25 | 1.5° | 120.0° |
| F40 | C38 | C26 | C27 | 177.8° | 59.9° |
| F39 | C38 | F41 | C26 | 123.9° | 120.0° |
| F39 | C38 | C26 | C25 | 121.0° | 120.0° |
| F39 | C38 | C26 | C27 | 58.3° | 60.0° |
| F41 | C38 | C26 | C25 | 118.7° | 0.0° |
| F41 | C38 | C26 | C27 | 61.9° | 180.0° |
| C38 | C26 | C25 | C27 | 179.4° | 180.0° |
| C38 | C26 | C25 | C24 | 179.6° | 179.9° |
| C38 | C26 | C27 | S29 | 0.6° | 0.0° |
| C38 | C26 | C27 | C28 | 179.6° | 179.8° |
| C38 | C26 | C25 | H20 | 0.4° | 0.0° |
| C26 | C25 | C24 | H20 | 180.0° | 179.9° |
| C25 | C26 | C27 | S29 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.2° | 0.2° |
| C26 | C25 | C24 | C23 | 0.0° | 0.0° |
| C26 | C25 | C24 | H19 | 180.0° | 180.0° |
| C27 | C26 | C25 | C24 | 0.3° | 0.0° |
| C26 | C27 | S29 | C28 | 179.8° | 179.8° |
| C26 | C27 | S29 | C30 | 127.7° | 180.0° |
| C26 | C27 | C28 | C23 | 0.0° | 0.5° |
| C27 | C26 | C25 | H20 | 179.8° | 180.0° |
| C26 | C27 | C28 | H21 | 180.0° | 180.0° |
| C25 | C24 | C23 | H19 | 180.0° | 180.0° |
| C25 | C24 | C23 | C28 | 0.2° | 0.3° |
| C25 | C24 | C23 | C9 | 179.6° | 179.9° |
| C27 | S29 | C30 | C31 | 175.0° | 180.0° |
| S29 | C27 | C28 | C23 | 179.8° | 179.7° |
| S29 | C27 | C28 | H21 | 0.2° | 0.2° |
| C27 | S29 | C30 | H24 | 64.9° | 60.0° |
| C27 | S29 | C30 | H25 | 54.9° | 60.0° |
| C30 | S29 | C27 | C28 | 52.1° | 0.2° |
| S29 | C30 | C31 | O32 | 1.2° | 0.0° |
| S29 | C30 | C31 | H24 | 120.1° | 120.0° |
| S29 | C30 | C31 | H25 | 120.1° | 120.0° |
| S29 | C30 | C31 | N33 | 178.9° | 180.0° |
| S29 | C30 | H24 | H25 | 119.7° | 120.0° |
| C27 | C28 | C23 | C24 | 0.2° | 0.5° |
| C27 | C28 | C23 | H21 | 180.0° | 179.5° |
| C27 | C28 | C23 | C9 | 179.6° | 179.8° |
| O32 | C31 | C30 | N33 | 179.9° | 180.0° |
| O32 | C31 | N33 | C37 | 0.1° | 0.0° |
| O32 | C31 | N33 | C34 | 179.8° | 179.9° |
| O32 | C31 | C30 | H24 | 121.4° | 120.0° |
| O32 | C31 | C30 | H25 | 118.8° | 120.0° |
| C24 | C23 | C28 | C9 | 179.4° | 179.7° |
| C24 | C23 | C9 | N10 | 49.4° | 145.0° |
| C24 | C23 | C9 | C7 | 130.7° | 35.0° |
| C23 | C24 | C25 | H20 | 180.0° | 180.0° |
| C24 | C23 | C28 | H21 | 179.8° | 180.0° |
| C30 | C31 | N33 | C37 | 180.0° | 180.0° |
| C30 | C31 | N33 | C34 | 0.0° | 0.0° |
| C31 | C30 | H24 | H25 | 119.7° | 120.0° |
| C28 | C23 | C9 | N10 | 131.2° | 35.3° |
| C28 | C23 | C9 | C7 | 48.7° | 144.7° |
| C28 | C23 | C24 | H19 | 179.8° | 179.7° |
| C31 | N33 | C37 | C34 | 179.9° | 180.0° |
| C31 | N33 | C37 | C36 | 151.6° | 179.0° |
| C31 | N33 | C34 | C35 | 164.7° | 155.9° |
| N33 | C31 | C30 | H24 | 58.8° | 60.0° |
| N33 | C31 | C30 | H25 | 61.0° | 60.0° |
| C31 | N33 | C34 | H26 | 45.6° | 85.2° |
| C31 | N33 | C34 | H27 | 76.2° | 37.0° |
| C31 | N33 | C37 | H32 | 89.3° | 59.6° |
| C31 | N33 | C37 | H33 | 32.6° | 61.5° |
| C23 | C9 | N10 | C7 | 179.9° | 180.0° |
| C23 | C9 | C7 | C8 | 0.1° | 0.3° |
| C23 | C9 | N10 | N11 | 179.6° | 179.9° |
| C23 | C9 | C7 | C6 | 179.9° | 179.8° |
| C9 | C23 | C24 | H19 | 0.4° | 0.0° |
| C9 | C23 | C28 | H21 | 0.4° | 0.3° |
| O2 | C1 | N3 | C8 | 0.4° | 0.2° |
| O2 | C1 | N3 | C43 | 179.9° | 179.8° |
| O2 | C1 | N3 | C4 | 179.9° | 179.7° |
| O2 | C1 | C43 | H34 | 0.0° | 90.3° |
| O2 | C1 | C43 | H35 | 120.0° | 29.7° |
| O2 | C1 | C43 | H36 | 120.0° | 149.8° |
| N33 | C37 | C36 | H32 | 119.0° | 119.4° |
| N33 | C37 | C36 | H33 | 119.0° | 119.6° |
| N33 | C37 | C36 | C35 | 29.6° | 22.2° |
| C37 | N33 | C34 | C35 | 15.4° | 24.2° |
| C37 | N33 | C34 | H26 | 134.5° | 94.7° |
| C37 | N33 | C34 | H27 | 103.8° | 143.0° |
| N33 | C37 | C36 | H30 | 149.0° | 140.6° |
| N33 | C37 | C36 | H31 | 89.9° | 96.3° |
| N33 | C37 | H32 | H33 | 122.7° | 121.1° |
| C34 | N33 | C37 | C36 | 28.5° | 1.1° |
| N33 | C34 | C35 | C36 | 4.0° | 37.0° |
| N33 | C34 | C35 | H26 | 119.1° | 118.9° |
| N33 | C34 | C35 | H27 | 119.1° | 118.9° |
| N33 | C34 | H26 | H27 | 122.6° | 122.3° |
| N33 | C34 | C35 | H28 | 115.5° | 81.0° |
| N33 | C34 | C35 | H29 | 123.5° | 155.1° |
| C34 | N33 | C37 | H32 | 90.6° | 120.5° |
| C34 | N33 | C37 | H33 | 147.5° | 118.4° |
| C37 | C36 | C35 | H30 | 119.4° | 118.4° |
| C37 | C36 | C35 | H31 | 119.4° | 118.6° |
| C37 | C36 | C35 | C34 | 20.9° | 35.5° |
| C37 | C36 | C35 | H28 | 98.6° | 82.5° |
| C37 | C36 | C35 | H29 | 140.3° | 153.6° |
| C37 | C36 | H30 | H31 | 121.6° | 123.3° |
| C36 | C37 | H32 | H33 | 122.8° | 121.0° |
| N10 | C9 | C7 | C8 | 180.0° | 179.7° |
| N10 | C9 | C7 | C6 | 0.2° | 0.2° |
| C9 | N10 | N11 | C6 | 0.7° | 0.1° |
| C9 | N10 | N11 | C12 | 179.2° | 179.9° |
| C9 | C7 | C8 | C6 | 179.7° | 179.9° |
| C9 | C7 | C8 | N3 | 156.4° | 168.9° |
| C7 | C9 | N10 | N11 | 0.6° | 0.1° |
| C9 | C7 | C6 | N11 | 0.2° | 0.3° |
| C9 | C7 | C6 | C5 | 179.9° | 179.6° |
| C9 | C7 | C8 | H5 | 36.5° | 71.6° |
| C9 | C7 | C8 | H6 | 83.8° | 49.5° |
| C36 | C35 | C34 | H28 | 119.5° | 118.1° |
| C36 | C35 | C34 | H29 | 119.5° | 118.1° |
| C36 | C35 | C34 | H26 | 115.1° | 81.9° |
| C36 | C35 | C34 | H27 | 123.1° | 155.9° |
| C36 | C35 | H28 | H29 | 121.6° | 124.0° |
| C35 | C36 | H30 | H31 | 121.7° | 123.1° |
| C35 | C36 | C37 | H32 | 89.5° | 97.2° |
| C35 | C36 | C37 | H33 | 148.6° | 141.8° |
| C7 | C8 | N3 | H5 | 119.8° | 119.4° |
| C7 | C8 | N3 | H6 | 119.9° | 119.4° |
| C7 | C8 | N3 | C1 | 126.9° | 135.7° |
| C7 | C8 | N3 | C4 | 52.6° | 44.2° |
| C8 | C7 | C6 | N11 | 179.6° | 179.7° |
| C8 | C7 | C6 | C5 | 0.3° | 0.4° |
| C7 | C8 | H5 | H6 | 120.4° | 121.1° |
| C8 | N3 | C1 | C4 | 179.4° | 179.9° |
| C8 | N3 | C1 | C43 | 179.6° | 180.0° |
| N3 | C8 | C7 | C6 | 23.4° | 11.2° |
| C8 | N3 | C4 | C5 | 58.7° | 64.5° |
| C8 | N3 | C4 | H1 | 179.2° | 175.6° |
| C8 | N3 | C4 | H2 | 61.8° | 55.5° |
| N3 | C8 | H5 | H6 | 120.4° | 121.1° |
| C35 | C34 | H26 | H27 | 122.6° | 122.2° |
| C34 | C35 | H28 | H29 | 121.6° | 123.9° |
| C34 | C35 | C36 | H30 | 140.3° | 153.9° |
| C34 | C35 | C36 | H31 | 98.6° | 83.1° |
| C1 | N3 | C4 | C5 | 120.8° | 115.5° |
| C1 | N3 | C4 | H1 | 0.3° | 4.5° |
| C1 | N3 | C4 | H2 | 118.7° | 124.6° |
| C1 | N3 | C8 | H5 | 7.1° | 104.8° |
| C1 | N3 | C8 | H6 | 113.2° | 16.3° |
| N3 | C1 | C43 | H34 | 179.9° | 89.9° |
| N3 | C1 | C43 | H35 | 60.0° | 150.0° |
| N3 | C1 | C43 | H36 | 60.1° | 30.0° |
| C43 | C1 | N3 | C4 | 0.2° | 0.1° |
| C1 | C43 | H34 | H35 | 120.0° | 120.0° |
| C1 | C43 | H34 | H36 | 120.0° | 119.9° |
| C1 | C43 | H35 | H36 | 120.0° | 120.0° |
| N10 | N11 | C6 | C7 | 0.6° | 0.2° |
| N10 | N11 | C6 | C12 | 178.2° | 179.9° |
| N10 | N11 | C6 | C5 | 179.5° | 179.7° |
| N10 | N11 | C12 | C13 | 73.4° | 90.0° |
| N10 | N11 | C12 | H7 | 46.4° | 30.0° |
| N10 | N11 | C12 | H8 | 166.7° | 150.0° |
| C7 | C6 | N11 | C5 | 179.9° | 179.9° |
| C7 | C6 | N11 | C12 | 178.8° | 179.7° |
| C7 | C6 | C5 | C4 | 3.1° | 18.0° |
| C7 | C6 | C5 | H3 | 123.2° | 137.7° |
| C7 | C6 | C5 | H4 | 117.0° | 101.9° |
| C6 | C7 | C8 | H5 | 143.2° | 108.3° |
| C6 | C7 | C8 | H6 | 96.5° | 130.6° |
| N3 | C4 | C5 | C6 | 30.1° | 45.4° |
| N3 | C4 | C5 | H1 | 120.5° | 119.9° |
| N3 | C4 | C5 | H2 | 120.5° | 119.9° |
| N3 | C4 | H1 | H2 | 118.4° | 120.2° |
| N3 | C4 | C5 | H3 | 150.2° | 165.1° |
| N3 | C4 | C5 | H4 | 90.0° | 74.5° |
| C4 | N3 | C8 | H5 | 172.4° | 75.3° |
| C4 | N3 | C8 | H6 | 67.3° | 163.6° |
| N11 | C6 | C5 | C4 | 177.0° | 162.1° |
| C6 | N11 | C12 | C13 | 104.7° | 89.9° |
| N11 | C6 | C5 | H3 | 56.9° | 42.4° |
| N11 | C6 | C5 | H4 | 62.9° | 78.0° |
| C6 | N11 | C12 | H7 | 135.4° | 150.1° |
| C6 | N11 | C12 | H8 | 15.1° | 30.1° |
| C12 | N11 | C6 | C5 | 1.3° | 0.4° |
| N11 | C12 | C13 | H7 | 119.9° | 120.0° |
| N11 | C12 | C13 | H8 | 119.9° | 120.0° |
| N11 | C12 | C13 | C15 | 158.5° | 175.0° |
| N11 | C12 | C13 | O14 | 75.6° | 65.0° |
| N11 | C12 | H7 | H8 | 120.4° | 120.0° |
| N11 | C12 | C13 | H9 | 40.8° | 55.0° |
| C6 | C5 | C4 | H3 | 120.1° | 119.7° |
| C6 | C5 | C4 | H4 | 120.1° | 119.9° |
| C6 | C5 | C4 | H1 | 150.6° | 165.3° |
| C6 | C5 | C4 | H2 | 90.4° | 74.5° |
| C6 | C5 | H3 | H4 | 119.7° | 120.4° |
| C5 | C4 | H1 | H2 | 118.4° | 120.1° |
| C4 | C5 | H3 | H4 | 119.7° | 120.3° |
| C12 | C13 | C15 | O14 | 123.2° | 120.0° |
| C12 | C13 | C15 | H9 | 117.6° | 119.9° |
| C12 | C13 | O14 | H9 | 115.7° | 120.0° |
| C12 | C13 | C15 | N16 | 175.3° | 175.0° |
| C13 | C12 | H7 | H8 | 120.4° | 120.0° |
| C12 | C13 | C15 | H10 | 54.5° | 55.0° |
| C12 | C13 | C15 | H11 | 64.0° | 65.1° |
| C12 | C13 | O14 | H44 | 180.0° | 60.0° |
| C15 | C13 | O14 | H9 | 118.6° | 120.0° |
| C13 | C15 | N16 | C21 | 27.7° | 170.0° |
| C13 | C15 | N16 | H10 | 120.7° | 120.0° |
| C13 | C15 | N16 | H11 | 120.7° | 120.0° |
| C13 | C15 | N16 | C17 | 98.9° | 65.8° |
| C15 | C13 | C12 | H7 | 38.7° | 65.1° |
| C15 | C13 | C12 | H8 | 81.6° | 55.0° |
| C13 | C15 | H10 | H11 | 117.8° | 120.0° |
| C15 | C13 | O14 | H44 | 54.3° | 60.0° |
| O14 | C13 | C15 | N16 | 61.6° | 65.0° |
| O14 | C13 | C12 | H7 | 164.6° | 55.0° |
| O14 | C13 | C12 | H8 | 44.3° | 175.0° |
| O14 | C13 | C15 | H10 | 177.7° | 175.0° |
| O14 | C13 | C15 | H11 | 59.2° | 55.0° |
| N16 | C21 | C20 | H22 | 120.3° | 120.0° |
| N16 | C21 | C20 | H23 | 120.3° | 120.0° |
| C21 | N16 | C15 | C17 | 126.6° | 124.2° |
| N16 | C21 | C20 | C19 | 33.1° | 59.2° |
| C21 | N16 | C17 | C18 | 70.5° | 61.8° |
| C21 | N16 | C15 | H10 | 93.0° | 70.0° |
| C21 | N16 | C15 | H11 | 148.4° | 50.0° |
| C21 | N16 | C17 | H12 | 169.3° | 178.3° |
| C21 | N16 | C17 | H13 | 49.7° | 58.2° |
| N16 | C21 | C20 | H17 | 87.4° | 179.1° |
| N16 | C21 | C20 | H18 | 153.6° | 60.7° |
| N16 | C21 | H22 | H23 | 119.0° | 120.0° |
| C20 | C21 | N16 | C15 | 156.8° | 62.3° |
| C20 | C21 | N16 | C17 | 29.6° | 61.8° |
| C21 | C20 | C19 | H17 | 120.5° | 119.9° |
| C21 | C20 | C19 | H18 | 120.5° | 120.0° |
| C21 | C20 | C19 | C18 | 58.5° | 57.7° |
| C21 | C20 | C19 | C22 | 174.2° | 177.6° |
| C21 | C20 | C19 | H14 | 56.7° | 62.3° |
| C21 | C20 | H17 | H18 | 118.6° | 120.2° |
| C20 | C21 | H22 | H23 | 119.1° | 120.0° |
| C15 | N16 | C17 | C18 | 159.7° | 62.3° |
| N16 | C15 | C13 | H9 | 57.6° | 55.1° |
| N16 | C15 | H10 | H11 | 117.7° | 120.0° |
| C15 | N16 | C17 | H12 | 39.5° | 57.6° |
| C15 | N16 | C17 | H13 | 80.1° | 177.7° |
| C15 | N16 | C21 | H22 | 36.5° | 177.6° |
| C15 | N16 | C21 | H23 | 82.9° | 57.7° |
| N16 | C17 | C18 | C19 | 42.5° | 59.2° |
| N16 | C17 | C18 | H12 | 120.2° | 119.9° |
| N16 | C17 | C18 | H13 | 120.2° | 120.1° |
| C17 | N16 | C15 | H10 | 140.4° | 54.2° |
| C17 | N16 | C15 | H11 | 21.9° | 174.2° |
| N16 | C17 | H12 | H13 | 119.3° | 120.0° |
| N16 | C17 | C18 | H15 | 162.8° | 179.1° |
| N16 | C17 | C18 | H16 | 77.9° | 60.7° |
| C17 | N16 | C21 | H22 | 90.8° | 58.2° |
| C17 | N16 | C21 | H23 | 149.9° | 178.2° |
| C20 | C19 | C18 | C22 | 127.8° | 119.9° |
| C20 | C19 | C18 | H14 | 115.2° | 120.0° |
| C20 | C19 | C22 | H14 | 117.6° | 120.2° |
| C20 | C19 | C22 | O42 | 61.4° | 59.7° |
| C20 | C19 | C18 | C17 | 19.7° | 57.7° |
| C20 | C19 | C22 | C44 | 55.8° | 60.4° |
| C20 | C19 | C22 | C45 | 179.9° | 179.7° |
| C20 | C19 | C18 | H15 | 100.7° | 177.6° |
| C20 | C19 | C18 | H16 | 140.0° | 62.2° |
| C19 | C20 | H17 | H18 | 118.5° | 120.1° |
| C19 | C20 | C21 | H22 | 153.4° | 60.8° |
| C19 | C20 | C21 | H23 | 87.2° | 179.2° |
| C18 | C19 | C22 | H14 | 117.1° | 120.1° |
| C18 | C19 | C22 | O42 | 173.3° | 60.0° |
| C19 | C18 | C17 | H15 | 120.4° | 119.9° |
| C19 | C18 | C17 | H16 | 120.3° | 119.9° |
| C18 | C19 | C22 | C44 | 69.4° | 180.0° |
| C18 | C19 | C22 | C45 | 54.6° | 60.0° |
| C19 | C18 | C17 | H12 | 162.7° | 179.1° |
| C19 | C18 | C17 | H13 | 77.7° | 60.9° |
| C19 | C18 | H15 | H16 | 118.9° | 120.1° |
| C18 | C19 | C20 | H17 | 62.0° | 177.6° |
| C18 | C19 | C20 | H18 | 179.0° | 62.3° |
| C19 | C22 | O42 | C44 | 120.7° | 120.0° |
| C19 | C22 | O42 | C45 | 120.9° | 120.0° |
| C22 | C19 | C18 | C17 | 147.5° | 177.6° |
| C19 | C22 | C44 | C45 | 124.7° | 120.0° |
| C22 | C19 | C18 | H15 | 27.1° | 62.5° |
| C22 | C19 | C18 | H16 | 92.2° | 57.7° |
| C22 | C19 | C20 | H17 | 65.3° | 62.5° |
| C22 | C19 | C20 | H18 | 53.7° | 57.6° |
| C19 | C22 | C44 | H37 | 180.0° | 60.0° |
| C19 | C22 | C44 | H38 | 60.0° | 180.0° |
| C19 | C22 | C44 | H39 | 60.0° | 60.0° |
| C19 | C22 | C45 | H40 | 180.0° | 60.0° |
| C19 | C22 | C45 | H41 | 60.0° | 180.0° |
| C19 | C22 | C45 | H42 | 60.0° | 59.9° |
| C19 | C22 | O42 | H45 | 180.0° | 60.0° |
| O42 | C22 | C44 | C45 | 116.8° | 120.0° |
| O42 | C22 | C19 | H14 | 56.2° | 179.9° |
| O42 | C22 | C44 | H37 | 61.6° | 180.0° |
| O42 | C22 | C44 | H38 | 178.4° | 59.9° |
| O42 | C22 | C44 | H39 | 58.4° | 60.0° |
| O42 | C22 | C45 | H40 | 61.0° | 60.1° |
| O42 | C22 | C45 | H41 | 59.0° | 60.0° |
| O42 | C22 | C45 | H42 | 179.0° | 180.0° |
| C18 | C17 | H12 | H13 | 119.4° | 120.0° |
| C17 | C18 | C19 | H14 | 95.5° | 62.3° |
| C17 | C18 | H15 | H16 | 118.9° | 120.1° |
| C44 | C22 | C19 | H14 | 173.4° | 59.9° |
| C22 | C44 | H37 | H38 | 120.0° | 120.0° |
| C22 | C44 | H37 | H39 | 120.0° | 120.0° |
| C22 | C44 | H38 | H39 | 120.0° | 119.9° |
| C44 | C22 | C45 | H40 | 55.0° | 179.9° |
| C44 | C22 | C45 | H41 | 174.9° | 60.0° |
| C44 | C22 | C45 | H42 | 65.1° | 60.0° |
| C44 | C22 | O42 | H45 | 59.2° | 60.0° |
| C45 | C22 | C19 | H14 | 62.5° | 60.1° |
| C45 | C22 | C44 | H37 | 55.3° | 60.0° |
| C45 | C22 | C44 | H38 | 64.8° | 60.0° |
| C45 | C22 | C44 | H39 | 175.2° | 180.0° |
| C22 | C45 | H40 | H41 | 120.0° | 120.0° |
| C22 | C45 | H40 | H42 | 120.0° | 119.9° |
| C22 | C45 | H41 | H42 | 120.0° | 120.0° |
| C45 | C22 | O42 | H45 | 59.1° | 180.0° |
| H1 | C4 | C5 | H3 | 89.3° | 75.0° |
| H1 | C4 | C5 | H4 | 30.5° | 45.4° |
| H2 | C4 | C5 | H3 | 29.7° | 45.2° |
| H2 | C4 | C5 | H4 | 149.5° | 165.5° |
| H7 | C12 | C13 | H9 | 79.0° | 175.0° |
| H8 | C12 | C13 | H9 | 160.7° | 65.0° |
| H9 | C13 | C15 | H10 | 63.1° | 64.9° |
| H9 | C13 | C15 | H11 | 178.4° | 175.0° |
| H9 | C13 | O14 | H44 | 64.3° | 180.0° |
| H12 | C17 | C18 | H15 | 77.0° | 61.0° |
| H12 | C17 | C18 | H16 | 42.3° | 59.2° |
| H13 | C17 | C18 | H15 | 42.6° | 59.1° |
| H13 | C17 | C18 | H16 | 161.9° | 179.2° |
| H14 | C19 | C18 | H15 | 144.1° | 57.6° |
| H14 | C19 | C18 | H16 | 24.8° | 177.8° |
| H14 | C19 | C20 | H17 | 177.2° | 57.6° |
| H14 | C19 | C20 | H18 | 63.7° | 177.7° |
| H17 | C20 | C21 | H22 | 32.9° | 59.1° |
| H17 | C20 | C21 | H23 | 152.3° | 60.9° |
| H18 | C20 | C21 | H22 | 86.1° | 179.2° |
| H18 | C20 | C21 | H23 | 33.3° | 59.3° |
| H19 | C24 | C25 | H20 | 0.0° | 0.1° |
| H26 | C34 | C35 | H28 | 125.4° | 160.1° |
| H26 | C34 | C35 | H29 | 4.4° | 36.2° |
| H27 | C34 | C35 | H28 | 3.6° | 37.9° |
| H27 | C34 | C35 | H29 | 117.4° | 86.0° |
| H28 | C35 | C36 | H30 | 20.8° | 35.9° |
| H28 | C35 | C36 | H31 | 142.0° | 158.9° |
| H29 | C35 | C36 | H30 | 100.3° | 88.0° |
| H29 | C35 | C36 | H31 | 20.9° | 35.0° |
| H30 | C36 | C37 | H32 | 30.0° | 21.2° |
| H30 | C36 | C37 | H33 | 91.9° | 99.8° |
| H31 | C36 | C37 | H32 | 151.1° | 144.3° |
| H31 | C36 | C37 | H33 | 29.2° | 23.3° |
| H34 | C43 | H35 | H36 | 120.0° | 120.0° |
| H37 | C44 | H38 | H39 | 120.0° | 120.0° |
| H40 | C45 | H41 | H42 | 120.0° | 120.0° |
