3BI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C | sing | 1.38Å | 1.35Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| N1 | HN1A | sing | 0.97Å | 1.00Å | |
| C2 | N4 | doub | 1.33Å | 1.34Å | Aromatic |
| C2 | C5 | sing | 1.42Å | 1.49Å | Aromatic |
| C2 | C1 | sing | 1.46Å | 1.50Å | Aromatic |
| N3 | C1 | sing | 1.38Å | 1.36Å | |
| N3 | HN3 | sing | 0.97Å | 1.00Å | |
| N3 | HN3A | sing | 0.97Å | 1.00Å | |
| C4 | N5 | sing | 1.32Å | 1.36Å | Aromatic |
| C4 | C3 | doub | 1.39Å | 1.42Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| N5 | C5 | doub | 1.33Å | 1.36Å | Aromatic |
| C6 | N6 | sing | 1.47Å | 1.49Å | |
| C6 | C3 | sing | 1.51Å | 1.54Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C7 | N6 | sing | 1.47Å | 1.47Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C9 | C8 | doub | 1.40Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C11 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | N6 | sing | 1.39Å | 1.43Å | |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | C8 | sing | 1.40Å | 1.38Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | O | doub | 1.22Å | 1.35Å | |
| C14 | N7 | sing | 1.35Å | 1.28Å | |
| C14 | C8 | sing | 1.47Å | 1.50Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C15 | C17 | sing | 1.53Å | 1.56Å | |
| C15 | N7 | sing | 1.46Å | 1.48Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | O1 | sing | 1.34Å | 1.28Å | |
| C16 | O2 | doub | 1.21Å | 1.21Å | |
| C | N | doub | 1.32Å | 1.39Å | Aromatic |
| C | N2 | sing | 1.33Å | 1.35Å | Aromatic |
| N | C5 | sing | 1.34Å | 1.37Å | Aromatic |
| O8 | P | doub | 1.48Å | 1.54Å | |
| P | O7 | sing | 1.61Å | 1.68Å | |
| P | C19 | sing | 1.82Å | 1.74Å | |
| P | C18 | sing | 1.82Å | 1.73Å | |
| C19 | C20 | sing | 1.53Å | 1.56Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C20 | C24 | sing | 1.51Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C24 | O6 | doub | 1.21Å | 1.25Å | |
| C24 | O5 | sing | 1.34Å | 1.28Å | |
| C21 | C22 | sing | 1.53Å | 1.50Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C22 | C23 | sing | 1.51Å | 1.52Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | O4 | sing | 1.34Å | 1.28Å | |
| C23 | O3 | doub | 1.21Å | 1.26Å | |
| C18 | C17 | sing | 1.53Å | 1.50Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| N7 | HN7 | sing | 0.97Å | 1.00Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C3 | N4 | sing | 1.32Å | 1.36Å | Aromatic |
| C1 | N2 | doub | 1.33Å | 1.35Å | Aromatic |
| O4 | H27 | sing | 0.97Å | 0.95Å | |
| O7 | H28 | sing | 0.97Å | 0.95Å | |
| O1 | H29 | sing | 0.97Å | 0.95Å | |
| O5 | H30 | sing | 0.97Å | 0.95Å | |
| C7 | H7B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | N1 | HN1 | 109.5° | 120.0° |
| C | N1 | HN1A | 109.5° | 120.0° |
| N1 | C | N | 119.9° | 118.3° |
| N1 | C | N2 | 116.6° | 118.2° |
| HN1 | N1 | HN1A | 109.4° | 120.0° |
| N4 | C2 | C5 | 118.9° | 120.1° |
| N4 | C2 | C1 | 122.5° | 122.1° |
| C2 | N4 | C3 | 122.1° | 119.5° |
| C5 | C2 | C1 | 118.6° | 117.8° |
| C2 | C5 | N5 | 118.7° | 119.4° |
| C2 | C5 | N | 116.2° | 118.6° |
| C2 | C1 | N3 | 120.5° | 121.2° |
| C2 | C1 | N2 | 118.9° | 117.6° |
| C1 | N3 | HN3 | 109.5° | 120.0° |
| C1 | N3 | HN3A | 109.4° | 120.0° |
| N3 | C1 | N2 | 120.6° | 121.2° |
| HN3 | N3 | HN3A | 109.5° | 120.0° |
| N5 | C4 | C3 | 121.5° | 120.8° |
| N5 | C4 | H4 | 119.2° | 119.6° |
| C4 | N5 | C5 | 120.0° | 119.6° |
| C3 | C4 | H4 | 119.3° | 119.6° |
| C4 | C3 | C6 | 126.6° | 119.7° |
| C4 | C3 | N4 | 118.7° | 120.6° |
| N5 | C5 | N | 125.0° | 121.9° |
| N6 | C6 | C3 | 122.8° | 109.4° |
| N6 | C6 | H6 | 105.2° | 109.5° |
| N6 | C6 | H6A | 102.1° | 109.5° |
| C6 | N6 | C7 | 109.2° | 120.0° |
| C6 | N6 | C11 | 111.7° | 120.0° |
| C3 | C6 | H6 | 105.2° | 109.5° |
| C3 | C6 | H6A | 102.1° | 109.5° |
| C6 | C3 | N4 | 114.6° | 119.7° |
| H6 | C6 | H6A | 120.7° | 109.5° |
| N6 | C7 | H7 | 109.5° | 109.5° |
| N6 | C7 | H7A | 109.4° | 109.5° |
| C7 | N6 | C11 | 113.4° | 120.0° |
| N6 | C7 | H7B | 109.5° | 109.5° |
| H7 | C7 | H7A | 109.5° | 109.4° |
| H7 | C7 | H7B | 109.4° | 109.5° |
| H7A | C7 | H7B | 109.5° | 109.5° |
| C8 | C9 | C10 | 120.3° | 119.9° |
| C8 | C9 | H9 | 119.8° | 120.1° |
| C9 | C8 | C13 | 119.2° | 119.9° |
| C9 | C8 | C14 | 122.6° | 120.1° |
| C10 | C9 | H9 | 119.8° | 120.0° |
| C9 | C10 | C11 | 120.1° | 120.1° |
| C9 | C10 | H10 | 119.9° | 119.9° |
| C12 | C11 | C10 | 118.7° | 120.1° |
| C12 | C11 | N6 | 120.0° | 119.9° |
| C11 | C12 | C13 | 121.0° | 120.1° |
| C11 | C12 | H12 | 119.5° | 120.0° |
| C10 | C11 | N6 | 121.2° | 120.0° |
| C11 | C10 | H10 | 120.0° | 120.0° |
| C13 | C12 | H12 | 119.5° | 119.9° |
| C12 | C13 | C8 | 120.6° | 119.9° |
| C12 | C13 | H13 | 119.7° | 120.0° |
| C8 | C13 | H13 | 119.7° | 120.1° |
| C13 | C8 | C14 | 118.0° | 120.0° |
| O | C14 | N7 | 120.3° | 120.0° |
| O | C14 | C8 | 115.2° | 120.0° |
| N7 | C14 | C8 | 124.1° | 120.0° |
| C14 | N7 | C15 | 123.1° | 120.0° |
| C14 | N7 | HN7 | 118.5° | 119.9° |
| C16 | C15 | C17 | 112.2° | 109.5° |
| C16 | C15 | N7 | 117.5° | 109.5° |
| C16 | C15 | H15 | 100.3° | 109.5° |
| C15 | C16 | O1 | 125.7° | 120.0° |
| C15 | C16 | O2 | 113.6° | 120.0° |
| C17 | C15 | N7 | 104.7° | 109.4° |
| C17 | C15 | H15 | 114.2° | 109.5° |
| C15 | C17 | C18 | 108.2° | 109.5° |
| C15 | C17 | H17 | 109.9° | 109.4° |
| C15 | C17 | H17A | 110.1° | 109.5° |
| N7 | C15 | H15 | 108.4° | 109.4° |
| C15 | N7 | HN7 | 118.4° | 120.1° |
| O1 | C16 | O2 | 120.6° | 119.9° |
| C16 | O1 | H29 | 109.5° | 117.0° |
| N | C | N2 | 123.5° | 123.5° |
| C | N | C5 | 122.0° | 121.1° |
| C | N2 | C1 | 120.8° | 121.3° |
| O8 | P | O7 | 105.1° | 109.5° |
| O8 | P | C19 | 110.9° | 109.5° |
| O8 | P | C18 | 111.1° | 109.5° |
| O7 | P | C19 | 108.5° | 109.5° |
| O7 | P | C18 | 111.3° | 109.4° |
| P | O7 | H28 | 109.5° | 114.0° |
| C19 | P | C18 | 109.8° | 109.4° |
| P | C19 | C20 | 116.9° | 109.4° |
| P | C19 | H19 | 107.1° | 109.5° |
| P | C19 | H19A | 105.4° | 109.5° |
| P | C18 | C17 | 116.9° | 109.5° |
| P | C18 | H18 | 107.1° | 109.5° |
| P | C18 | H18A | 105.4° | 109.5° |
| C20 | C19 | H19 | 107.1° | 109.4° |
| C20 | C19 | H19A | 105.4° | 109.4° |
| C19 | C20 | C24 | 111.2° | 109.5° |
| C19 | C20 | C21 | 114.3° | 109.5° |
| C19 | C20 | H20 | 105.6° | 109.5° |
| H19 | C19 | H19A | 115.5° | 109.5° |
| C24 | C20 | C21 | 111.5° | 109.5° |
| C24 | C20 | H20 | 108.7° | 109.5° |
| C20 | C24 | O6 | 120.3° | 120.0° |
| C20 | C24 | O5 | 118.7° | 120.0° |
| C21 | C20 | H20 | 105.1° | 109.4° |
| C20 | C21 | C22 | 110.1° | 109.5° |
| C20 | C21 | H21 | 109.3° | 109.5° |
| C20 | C21 | H21A | 109.1° | 109.5° |
| O6 | C24 | O5 | 120.8° | 120.0° |
| C24 | O5 | H30 | 109.5° | 117.0° |
| C22 | C21 | H21 | 109.2° | 109.5° |
| C22 | C21 | H21A | 109.1° | 109.5° |
| C21 | C22 | C23 | 112.6° | 109.5° |
| C21 | C22 | H22 | 108.4° | 109.5° |
| C21 | C22 | H22A | 107.8° | 109.5° |
| H21 | C21 | H21A | 110.0° | 109.5° |
| C23 | C22 | H22 | 108.4° | 109.4° |
| C23 | C22 | H22A | 107.7° | 109.5° |
| C22 | C23 | O4 | 120.3° | 120.0° |
| C22 | C23 | O3 | 117.3° | 120.0° |
| H22 | C22 | H22A | 112.0° | 109.5° |
| O4 | C23 | O3 | 122.1° | 120.0° |
| C23 | O4 | H27 | 109.5° | 117.0° |
| C17 | C18 | H18 | 107.1° | 109.5° |
| C17 | C18 | H18A | 105.3° | 109.5° |
| C18 | C17 | H17 | 109.9° | 109.5° |
| C18 | C17 | H17A | 110.1° | 109.5° |
| H18 | C18 | H18A | 115.5° | 109.5° |
| H17 | C17 | H17A | 108.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | N1 | HN1 | HN1A | 120.0° | 179.8° |
| N1 | C | N | N2 | 179.7° | 179.6° |
| N1 | C | N | C5 | 179.8° | 179.9° |
| N1 | C | N2 | C1 | 179.1° | 179.9° |
| HN1 | N1 | C | N | 83.1° | 0.1° |
| HN1 | N1 | C | N2 | 97.2° | 179.7° |
| HN1A | N1 | C | N | 156.9° | 179.7° |
| HN1A | N1 | C | N2 | 22.8° | 0.1° |
| N4 | C2 | C5 | C1 | 179.6° | 179.7° |
| N4 | C2 | C1 | N3 | 0.2° | 0.1° |
| C2 | N4 | C3 | C4 | 0.6° | 0.1° |
| N4 | C2 | C5 | N5 | 0.5° | 0.1° |
| C2 | N4 | C3 | C6 | 178.6° | 180.0° |
| N4 | C2 | C5 | N | 179.6° | 180.0° |
| N4 | C2 | C1 | N2 | 179.8° | 180.0° |
| C5 | C2 | C1 | N3 | 179.4° | 179.7° |
| C2 | C5 | N5 | C4 | 0.8° | 0.1° |
| C2 | C5 | N5 | N | 179.0° | 179.9° |
| C2 | C5 | N | C | 0.5° | 0.0° |
| C5 | C2 | N4 | C3 | 0.4° | 0.0° |
| C5 | C2 | C1 | N2 | 0.2° | 0.4° |
| C2 | C1 | N3 | N2 | 179.6° | 179.9° |
| C2 | C1 | N3 | HN3 | 92.8° | 0.0° |
| C2 | C1 | N3 | HN3A | 147.1° | 180.0° |
| C1 | C2 | C5 | N5 | 179.9° | 179.7° |
| C2 | C1 | N2 | C | 0.8° | 0.1° |
| C1 | C2 | C5 | N | 0.9° | 0.3° |
| C1 | C2 | N4 | C3 | 180.0° | 179.7° |
| C1 | N3 | HN3 | HN3A | 120.0° | 180.0° |
| N3 | C1 | N2 | C | 179.6° | 180.0° |
| HN3 | N3 | C1 | N2 | 86.8° | 179.9° |
| HN3A | N3 | C1 | N2 | 33.2° | 0.1° |
| N5 | C4 | C3 | H4 | 180.0° | 179.9° |
| N5 | C4 | C3 | C6 | 178.6° | 180.0° |
| C4 | N5 | C5 | N | 179.8° | 180.0° |
| N5 | C4 | C3 | N4 | 0.8° | 0.2° |
| C3 | C4 | N5 | C5 | 1.0° | 0.2° |
| C4 | C3 | C6 | N6 | 29.4° | 95.0° |
| C4 | C3 | C6 | N4 | 177.8° | 179.9° |
| C4 | C3 | C6 | H6 | 149.4° | 24.9° |
| C4 | C3 | C6 | H6A | 83.8° | 145.0° |
| H4 | C4 | N5 | C5 | 179.0° | 179.9° |
| H4 | C4 | C3 | C6 | 1.4° | 0.1° |
| H4 | C4 | C3 | N4 | 179.2° | 180.0° |
| N5 | C5 | N | C | 179.5° | 179.9° |
| N6 | C6 | C3 | H6 | 120.0° | 120.0° |
| N6 | C6 | C3 | H6A | 113.2° | 120.0° |
| N6 | C6 | H6 | H6A | 114.5° | 120.0° |
| C6 | N6 | C7 | C11 | 125.3° | 180.0° |
| C6 | N6 | C7 | H7 | 91.8° | 90.0° |
| C6 | N6 | C7 | H7A | 28.2° | 150.0° |
| C6 | N6 | C11 | C12 | 129.5° | 180.0° |
| C6 | N6 | C11 | C10 | 52.6° | 0.0° |
| N6 | C6 | C3 | N4 | 152.8° | 85.1° |
| C6 | N6 | C7 | H7B | 148.2° | 30.0° |
| C3 | C6 | H6 | H6A | 114.5° | 120.0° |
| C3 | C6 | N6 | C7 | 41.7° | 90.0° |
| C3 | C6 | N6 | C11 | 84.5° | 90.0° |
| H6 | C6 | N6 | C7 | 78.3° | 150.0° |
| H6 | C6 | N6 | C11 | 155.5° | 30.0° |
| H6 | C6 | C3 | N4 | 32.8° | 154.9° |
| H6A | C6 | N6 | C7 | 154.9° | 30.0° |
| H6A | C6 | N6 | C11 | 28.7° | 150.0° |
| H6A | C6 | C3 | N4 | 94.0° | 34.9° |
| N6 | C7 | H7 | H7A | 120.0° | 120.0° |
| N6 | C7 | H7 | H7B | 120.0° | 120.0° |
| N6 | C7 | H7A | H7B | 120.0° | 120.0° |
| C7 | N6 | C11 | C12 | 5.6° | 0.0° |
| C7 | N6 | C11 | C10 | 176.5° | 180.0° |
| H7 | C7 | H7A | H7B | 120.0° | 120.0° |
| H7 | C7 | N6 | C11 | 142.9° | 89.9° |
| H7A | C7 | N6 | C11 | 97.0° | 30.0° |
| C8 | C9 | C10 | H9 | 180.0° | 179.7° |
| C8 | C9 | C10 | C11 | 2.6° | 0.0° |
| C9 | C8 | C13 | C12 | 0.5° | 0.0° |
| C9 | C8 | C13 | C14 | 174.8° | 180.0° |
| C9 | C8 | C13 | H13 | 179.6° | 180.0° |
| C9 | C8 | C14 | O | 34.4° | 0.0° |
| C9 | C8 | C14 | N7 | 153.1° | 180.0° |
| C8 | C9 | C10 | H10 | 177.4° | 180.0° |
| C9 | C10 | C11 | C12 | 2.4° | 0.0° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | N6 | 179.6° | 180.0° |
| C10 | C9 | C8 | C13 | 1.6° | 0.0° |
| C10 | C9 | C8 | C14 | 176.1° | 180.0° |
| H9 | C9 | C10 | C11 | 177.4° | 179.7° |
| H9 | C9 | C8 | C13 | 178.4° | 179.7° |
| H9 | C9 | C8 | C14 | 3.9° | 0.3° |
| H9 | C9 | C10 | H10 | 2.6° | 0.3° |
| C12 | C11 | C10 | N6 | 178.0° | 180.0° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C8 | 0.3° | 0.0° |
| C11 | C12 | C13 | H13 | 179.7° | 180.0° |
| C12 | C11 | C10 | H10 | 177.6° | 180.0° |
| C10 | C11 | C12 | C13 | 1.3° | 0.0° |
| C10 | C11 | C12 | H12 | 178.7° | 180.0° |
| N6 | C11 | C12 | C13 | 179.3° | 180.0° |
| N6 | C11 | C12 | H12 | 0.7° | 0.0° |
| N6 | C11 | C10 | H10 | 0.4° | 0.0° |
| C11 | N6 | C7 | H7B | 23.0° | 150.1° |
| C12 | C13 | C8 | H13 | 180.0° | 179.9° |
| C12 | C13 | C8 | C14 | 175.2° | 180.0° |
| H12 | C12 | C13 | C8 | 179.7° | 180.0° |
| H12 | C12 | C13 | H13 | 0.3° | 0.0° |
| C13 | C8 | C14 | O | 140.2° | 180.0° |
| C13 | C8 | C14 | N7 | 32.3° | 0.0° |
| H13 | C13 | C8 | C14 | 4.8° | 0.0° |
| O | C14 | N7 | C8 | 172.1° | 180.0° |
| O | C14 | N7 | C15 | 3.1° | 0.0° |
| O | C14 | N7 | HN7 | 176.9° | 180.0° |
| C14 | N7 | C15 | C16 | 47.4° | 85.0° |
| C14 | N7 | C15 | C17 | 172.5° | 155.0° |
| C14 | N7 | C15 | HN7 | 180.0° | 180.0° |
| C14 | N7 | C15 | H15 | 65.2° | 35.0° |
| C8 | C14 | N7 | C15 | 175.2° | 180.0° |
| C8 | C14 | N7 | HN7 | 4.8° | 0.0° |
| C16 | C15 | C17 | N7 | 128.4° | 120.0° |
| C16 | C15 | C17 | H15 | 113.2° | 120.1° |
| C16 | C15 | N7 | H15 | 112.6° | 120.1° |
| C15 | C16 | O1 | O2 | 176.6° | 179.9° |
| C16 | C15 | C17 | C18 | 40.0° | 175.0° |
| C16 | C15 | C17 | H17 | 80.0° | 55.0° |
| C16 | C15 | C17 | H17A | 160.5° | 64.9° |
| C16 | C15 | N7 | HN7 | 132.6° | 95.0° |
| C15 | C16 | O1 | H29 | 176.6° | 180.0° |
| C17 | C15 | N7 | H15 | 122.2° | 120.0° |
| C17 | C15 | C16 | O1 | 96.3° | 60.1° |
| C17 | C15 | C16 | O2 | 80.5° | 120.0° |
| C15 | C17 | C18 | P | 165.1° | 179.9° |
| C15 | C17 | C18 | H17 | 120.0° | 119.9° |
| C15 | C17 | C18 | H17A | 120.5° | 120.1° |
| C15 | C17 | C18 | H18 | 74.9° | 60.0° |
| C15 | C17 | C18 | H18A | 48.5° | 60.0° |
| C15 | C17 | H17 | H17A | 120.5° | 120.0° |
| C17 | C15 | N7 | HN7 | 7.4° | 25.0° |
| N7 | C15 | C16 | O1 | 142.4° | 180.0° |
| N7 | C15 | C16 | O2 | 40.8° | 0.1° |
| N7 | C15 | C17 | C18 | 168.5° | 65.0° |
| N7 | C15 | C17 | H17 | 48.5° | 175.0° |
| N7 | C15 | C17 | H17A | 71.1° | 55.0° |
| H15 | C15 | C16 | O1 | 25.2° | 60.0° |
| H15 | C15 | C16 | O2 | 157.9° | 119.9° |
| H15 | C15 | C17 | C18 | 73.2° | 54.9° |
| H15 | C15 | C17 | H17 | 166.8° | 65.0° |
| H15 | C15 | C17 | H17A | 47.3° | 175.0° |
| H15 | C15 | N7 | HN7 | 114.8° | 145.0° |
| O2 | C16 | O1 | H29 | 0.0° | 0.1° |
| N | C | N2 | C1 | 1.2° | 0.3° |
| N2 | C | N | C5 | 0.5° | 0.3° |
| O8 | P | O7 | C19 | 118.7° | 120.0° |
| O8 | P | O7 | C18 | 120.4° | 120.0° |
| O8 | P | C19 | C18 | 123.2° | 120.0° |
| O8 | P | C19 | C20 | 18.9° | 55.1° |
| O8 | P | C19 | H19 | 138.9° | 175.0° |
| O8 | P | C19 | H19A | 97.6° | 64.9° |
| O8 | P | C18 | C17 | 53.8° | 55.0° |
| O8 | P | C18 | H18 | 173.8° | 65.0° |
| O8 | P | C18 | H18A | 62.7° | 175.0° |
| O8 | P | O7 | H28 | 22.2° | 180.0° |
| O7 | P | C19 | C18 | 121.8° | 120.0° |
| O7 | P | C19 | C20 | 96.0° | 65.0° |
| O7 | P | C19 | H19 | 24.0° | 54.9° |
| O7 | P | C19 | H19A | 147.4° | 175.0° |
| O7 | P | C18 | C17 | 170.6° | 65.0° |
| O7 | P | C18 | H18 | 69.4° | 175.0° |
| O7 | P | C18 | H18A | 54.1° | 55.0° |
| P | C19 | C20 | H19 | 120.0° | 120.0° |
| P | C19 | C20 | H19A | 116.6° | 120.1° |
| P | C19 | H19 | H19A | 117.0° | 120.1° |
| P | C19 | C20 | C24 | 67.2° | 75.0° |
| P | C19 | C20 | C21 | 165.5° | 165.0° |
| P | C19 | C20 | H20 | 50.4° | 45.0° |
| C19 | P | C18 | C17 | 69.2° | 175.0° |
| C19 | P | C18 | H18 | 50.7° | 55.0° |
| C19 | P | C18 | H18A | 174.2° | 65.0° |
| C19 | P | O7 | H28 | 96.4° | 60.0° |
| C18 | P | C19 | C20 | 142.1° | 175.0° |
| C18 | P | C19 | H19 | 97.9° | 65.0° |
| C18 | P | C19 | H19A | 25.6° | 55.0° |
| P | C18 | C17 | H18 | 120.0° | 120.0° |
| P | C18 | C17 | H18A | 116.6° | 120.0° |
| P | C18 | H18 | H18A | 117.0° | 120.0° |
| P | C18 | C17 | H17 | 74.9° | 60.0° |
| P | C18 | C17 | H17A | 44.6° | 60.0° |
| C18 | P | O7 | H28 | 142.7° | 60.0° |
| C20 | C19 | H19 | H19A | 116.9° | 120.0° |
| C19 | C20 | C24 | C21 | 128.8° | 120.0° |
| C19 | C20 | C24 | H20 | 115.7° | 120.0° |
| C19 | C20 | C21 | H20 | 115.3° | 120.0° |
| C19 | C20 | C24 | O6 | 34.2° | 0.0° |
| C19 | C20 | C24 | O5 | 150.4° | 180.0° |
| C19 | C20 | C21 | C22 | 58.6° | 175.0° |
| C19 | C20 | C21 | H21 | 178.6° | 55.0° |
| C19 | C20 | C21 | H21A | 61.2° | 65.0° |
| H19 | C19 | C20 | C24 | 172.8° | 165.0° |
| H19 | C19 | C20 | C21 | 45.4° | 45.0° |
| H19 | C19 | C20 | H20 | 69.6° | 75.0° |
| H19A | C19 | C20 | C24 | 49.3° | 45.0° |
| H19A | C19 | C20 | C21 | 78.0° | 75.0° |
| H19A | C19 | C20 | H20 | 167.0° | 165.0° |
| C24 | C20 | C21 | H20 | 117.6° | 120.0° |
| C20 | C24 | O6 | O5 | 175.4° | 179.9° |
| C24 | C20 | C21 | C22 | 68.5° | 65.0° |
| C24 | C20 | C21 | H21 | 51.4° | 175.0° |
| C24 | C20 | C21 | H21A | 171.7° | 55.0° |
| C20 | C24 | O5 | H30 | 175.4° | 180.0° |
| C21 | C20 | C24 | O6 | 94.6° | 120.0° |
| C21 | C20 | C24 | O5 | 80.8° | 60.0° |
| C20 | C21 | C22 | H21 | 120.0° | 120.0° |
| C20 | C21 | C22 | H21A | 119.7° | 120.0° |
| C20 | C21 | H21 | H21A | 119.7° | 120.0° |
| C20 | C21 | C22 | C23 | 173.1° | 180.0° |
| C20 | C21 | C22 | H22 | 66.9° | 60.0° |
| C20 | C21 | C22 | H22A | 54.5° | 60.0° |
| H20 | C20 | C24 | O6 | 149.9° | 120.0° |
| H20 | C20 | C24 | O5 | 34.6° | 59.9° |
| H20 | C20 | C21 | C22 | 173.9° | 55.0° |
| H20 | C20 | C21 | H21 | 66.2° | 65.0° |
| H20 | C20 | C21 | H21A | 54.1° | 175.0° |
| O6 | C24 | O5 | H30 | 0.0° | 0.1° |
| C22 | C21 | H21 | H21A | 119.8° | 120.0° |
| C21 | C22 | C23 | H22 | 120.0° | 119.9° |
| C21 | C22 | C23 | H22A | 118.7° | 120.0° |
| C21 | C22 | H22 | H22A | 118.7° | 120.0° |
| C21 | C22 | C23 | O4 | 28.1° | 180.0° |
| C21 | C22 | C23 | O3 | 158.4° | 0.0° |
| H21 | C21 | C22 | C23 | 53.1° | 60.0° |
| H21 | C21 | C22 | H22 | 173.1° | 179.9° |
| H21 | C21 | C22 | H22A | 65.5° | 60.0° |
| H21A | C21 | C22 | C23 | 67.1° | 60.0° |
| H21A | C21 | C22 | H22 | 52.8° | 60.0° |
| H21A | C21 | C22 | H22A | 174.2° | 180.0° |
| C23 | C22 | H22 | H22A | 118.7° | 120.0° |
| C22 | C23 | O4 | O3 | 173.2° | 180.0° |
| C22 | C23 | O4 | H27 | 173.2° | 180.0° |
| H22 | C22 | C23 | O4 | 148.1° | 60.0° |
| H22 | C22 | C23 | O3 | 38.5° | 120.0° |
| H22A | C22 | C23 | O4 | 90.6° | 60.0° |
| H22A | C22 | C23 | O3 | 82.9° | 120.0° |
| O3 | C23 | O4 | H27 | 0.0° | 0.0° |
| C17 | C18 | H18 | H18A | 116.9° | 120.0° |
| C18 | C17 | H17 | H17A | 120.5° | 120.0° |
| H18 | C18 | C17 | H17 | 45.1° | 59.9° |
| H18 | C18 | C17 | H17A | 164.6° | 179.9° |
| H18A | C18 | C17 | H17 | 168.5° | 179.9° |
| H18A | C18 | C17 | H17A | 72.0° | 60.0° |
