P8F
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N2 | C6 | sing | 1.35Å | 1.33Å | |
| C6 | O2 | doub | 1.22Å | 1.24Å | |
| C6 | C5 | sing | 1.47Å | 1.50Å | |
| O3 | C7 | doub | 1.21Å | 1.23Å | |
| C7 | C5 | sing | 1.46Å | 1.43Å | |
| C7 | C8 | sing | 1.52Å | 1.55Å | |
| C5 | C4 | doub | 1.37Å | 1.41Å | |
| O6 | C11 | doub | 1.22Å | 1.26Å | |
| C26 | C13 | sing | 1.51Å | 1.50Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | doub | 1.36Å | 1.37Å | Aromatic |
| C13 | C12 | sing | 1.41Å | 1.41Å | Aromatic |
| C11 | C12 | sing | 1.48Å | 1.46Å | |
| C11 | C10 | sing | 1.43Å | 1.45Å | |
| C14 | C15 | sing | 1.41Å | 1.41Å | Aromatic |
| O5 | C9 | sing | 1.35Å | 1.33Å | |
| C12 | C25 | doub | 1.39Å | 1.41Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.42Å | Aromatic |
| C15 | C24 | doub | 1.42Å | 1.44Å | Aromatic |
| C16 | C17 | doub | 1.36Å | 1.37Å | Aromatic |
| C25 | C24 | sing | 1.41Å | 1.44Å | Aromatic |
| C25 | O7 | sing | 1.35Å | 1.34Å | |
| C9 | C10 | doub | 1.33Å | 1.36Å | |
| C9 | C8 | sing | 1.51Å | 1.51Å | |
| C24 | C23 | sing | 1.40Å | 1.42Å | Aromatic |
| C10 | C27 | sing | 1.51Å | 1.53Å | |
| C17 | C18 | sing | 1.39Å | 1.43Å | Aromatic |
| C4 | O1 | sing | 1.34Å | 1.33Å | |
| C4 | C3 | sing | 1.50Å | 1.52Å | |
| C23 | C18 | doub | 1.36Å | 1.38Å | Aromatic |
| C8 | O4 | sing | 1.43Å | 1.42Å | |
| C8 | C29 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.51Å | 1.51Å | |
| C28 | C27 | sing | 1.53Å | 1.53Å | |
| C28 | C29 | sing | 1.53Å | 1.54Å | |
| C19 | N3 | sing | 1.47Å | 1.46Å | |
| C29 | C3 | sing | 1.52Å | 1.55Å | |
| C3 | N1 | sing | 1.47Å | 1.47Å | |
| N3 | C22 | sing | 1.47Å | 1.49Å | |
| N3 | C20 | sing | 1.48Å | 1.48Å | |
| C22 | C21 | sing | 1.53Å | 1.53Å | |
| N1 | C1 | sing | 1.47Å | 1.46Å | |
| N1 | C2 | sing | 1.47Å | 1.47Å | |
| C20 | C21 | sing | 1.54Å | 1.53Å | |
| C21 | F1 | sing | 1.40Å | 1.37Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| O1 | H10 | sing | 0.97Å | 0.95Å | |
| N2 | H12 | sing | 0.97Å | 1.00Å | |
| N2 | H13 | sing | 0.97Å | 1.00Å | |
| O4 | H14 | sing | 0.97Å | 0.95Å | |
| O5 | H15 | sing | 0.97Å | 0.95Å | |
| C14 | H16 | sing | 1.08Å | 1.08Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| C17 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.08Å | 1.08Å | |
| O7 | H28 | sing | 0.97Å | 0.95Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C28 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C29 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C6 | O2 | 123.0° | 119.9° |
| N2 | C6 | C5 | 118.2° | 120.0° |
| C6 | N2 | H12 | 120.0° | 120.1° |
| C6 | N2 | H13 | 120.0° | 120.0° |
| O2 | C6 | C5 | 118.8° | 120.0° |
| C6 | C5 | C7 | 121.3° | 119.8° |
| C6 | C5 | C4 | 120.0° | 119.9° |
| O3 | C7 | C5 | 125.4° | 120.6° |
| O3 | C7 | C8 | 120.1° | 120.6° |
| C5 | C7 | C8 | 114.4° | 118.8° |
| C7 | C5 | C4 | 118.5° | 120.3° |
| C7 | C8 | C9 | 109.6° | 107.6° |
| C7 | C8 | O4 | 109.4° | 110.5° |
| C7 | C8 | C29 | 106.7° | 108.0° |
| C5 | C4 | O1 | 124.0° | 118.8° |
| C5 | C4 | C3 | 121.4° | 122.3° |
| O6 | C11 | C12 | 119.6° | 120.5° |
| O6 | C11 | C10 | 122.6° | 120.6° |
| C13 | C26 | C27 | 108.3° | 110.0° |
| C26 | C13 | C14 | 121.9° | 119.5° |
| C26 | C13 | C12 | 118.5° | 119.8° |
| C13 | C26 | H29 | 109.8° | 109.4° |
| C13 | C26 | H30 | 109.7° | 109.4° |
| C26 | C27 | C10 | 108.4° | 110.1° |
| C26 | C27 | C28 | 111.1° | 109.6° |
| C27 | C26 | H29 | 109.7° | 109.4° |
| C27 | C26 | H30 | 109.8° | 109.4° |
| C26 | C27 | H31 | 108.5° | 109.2° |
| C14 | C13 | C12 | 119.5° | 120.6° |
| C13 | C14 | C15 | 122.5° | 120.4° |
| C13 | C14 | H16 | 118.7° | 119.8° |
| C13 | C12 | C11 | 120.0° | 119.6° |
| C13 | C12 | C25 | 120.3° | 120.5° |
| C12 | C11 | C10 | 117.8° | 118.9° |
| C11 | C12 | C25 | 119.8° | 119.9° |
| C11 | C10 | C9 | 120.4° | 118.7° |
| C11 | C10 | C27 | 117.0° | 118.1° |
| C14 | C15 | C16 | 121.6° | 121.0° |
| C14 | C15 | C24 | 119.1° | 119.7° |
| C15 | C14 | H16 | 118.8° | 119.8° |
| O5 | C9 | C10 | 124.3° | 118.0° |
| O5 | C9 | C8 | 113.0° | 117.9° |
| C9 | O5 | H15 | 109.5° | 117.0° |
| C12 | C25 | C24 | 120.3° | 119.3° |
| C12 | C25 | O7 | 120.2° | 120.3° |
| C16 | C15 | C24 | 119.2° | 119.3° |
| C15 | C16 | C17 | 120.5° | 119.7° |
| C15 | C16 | H17 | 119.7° | 120.2° |
| C15 | C24 | C25 | 118.2° | 119.4° |
| C15 | C24 | C23 | 118.6° | 119.4° |
| C16 | C17 | C18 | 121.1° | 121.0° |
| C17 | C16 | H17 | 119.8° | 120.1° |
| C16 | C17 | H18 | 119.4° | 119.5° |
| C24 | C25 | O7 | 119.5° | 120.3° |
| C25 | C24 | C23 | 123.1° | 121.1° |
| C25 | O7 | H28 | 109.5° | 114.0° |
| C10 | C9 | C8 | 122.7° | 124.0° |
| C9 | C10 | C27 | 122.4° | 123.1° |
| C9 | C8 | O4 | 109.9° | 110.5° |
| C9 | C8 | C29 | 111.2° | 109.2° |
| C24 | C23 | C18 | 121.6° | 119.7° |
| C24 | C23 | H27 | 119.2° | 120.2° |
| C10 | C27 | C28 | 111.8° | 110.3° |
| C10 | C27 | H31 | 108.5° | 109.2° |
| C17 | C18 | C23 | 119.0° | 120.9° |
| C17 | C18 | C19 | 119.7° | 119.6° |
| C18 | C17 | H18 | 119.5° | 119.5° |
| O1 | C4 | C3 | 114.5° | 118.9° |
| C4 | O1 | H10 | 109.5° | 117.0° |
| C4 | C3 | C29 | 112.3° | 112.1° |
| C4 | C3 | N1 | 112.1° | 109.0° |
| C4 | C3 | H8 | 105.5° | 109.0° |
| C23 | C18 | C19 | 121.3° | 119.5° |
| C18 | C23 | H27 | 119.2° | 120.2° |
| O4 | C8 | C29 | 110.1° | 111.0° |
| C8 | O4 | H14 | 109.5° | 114.0° |
| C8 | C29 | C28 | 108.9° | 109.3° |
| C8 | C29 | C3 | 113.3° | 111.7° |
| C8 | C29 | H34 | 107.7° | 108.1° |
| C18 | C19 | N3 | 114.1° | 109.5° |
| C18 | C19 | H19 | 108.3° | 109.5° |
| C18 | C19 | H20 | 108.3° | 109.4° |
| C27 | C28 | C29 | 111.5° | 108.1° |
| C28 | C27 | H31 | 108.5° | 108.5° |
| C27 | C28 | H32 | 109.0° | 109.7° |
| C27 | C28 | H33 | 108.9° | 109.7° |
| C28 | C29 | C3 | 111.6° | 111.9° |
| C29 | C28 | H32 | 108.9° | 109.8° |
| C29 | C28 | H33 | 108.9° | 109.7° |
| C28 | C29 | H34 | 107.7° | 108.1° |
| C19 | N3 | C22 | 115.7° | 111.0° |
| C19 | N3 | C20 | 117.4° | 111.0° |
| N3 | C19 | H19 | 108.3° | 109.5° |
| N3 | C19 | H20 | 108.3° | 109.5° |
| C29 | C3 | N1 | 114.9° | 109.0° |
| C29 | C3 | H8 | 105.1° | 108.9° |
| C3 | C29 | H34 | 107.5° | 107.6° |
| C3 | N1 | C1 | 118.7° | 111.0° |
| C3 | N1 | C2 | 114.4° | 111.0° |
| N1 | C3 | H8 | 106.0° | 108.9° |
| C22 | N3 | C20 | 90.8° | 87.8° |
| N3 | C22 | C21 | 88.3° | 87.9° |
| N3 | C22 | H25 | 114.5° | 113.5° |
| N3 | C22 | H26 | 114.5° | 113.5° |
| N3 | C20 | C21 | 88.4° | 87.9° |
| N3 | C20 | H22 | 114.4° | 113.5° |
| N3 | C20 | H23 | 114.5° | 113.5° |
| C22 | C21 | C20 | 87.7° | 83.6° |
| C22 | C21 | F1 | 114.5° | 114.2° |
| C22 | C21 | H24 | 112.0° | 114.4° |
| C21 | C22 | H25 | 114.5° | 113.5° |
| C21 | C22 | H26 | 114.4° | 113.5° |
| C1 | N1 | C2 | 108.3° | 111.0° |
| N1 | C1 | H1 | 109.5° | 109.4° |
| N1 | C1 | H2 | 109.5° | 109.5° |
| N1 | C1 | H3 | 109.5° | 109.5° |
| N1 | C2 | H5 | 109.5° | 109.5° |
| N1 | C2 | H6 | 109.5° | 109.4° |
| N1 | C2 | H7 | 109.4° | 109.5° |
| C20 | C21 | F1 | 113.4° | 114.2° |
| C21 | C20 | H22 | 114.5° | 113.5° |
| C21 | C20 | H23 | 114.4° | 113.5° |
| C20 | C21 | H24 | 112.0° | 114.2° |
| F1 | C21 | H24 | 114.6° | 113.2° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H1 | C1 | H3 | 109.4° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H5 | C2 | H6 | 109.5° | 109.5° |
| H5 | C2 | H7 | 109.5° | 109.4° |
| H6 | C2 | H7 | 109.5° | 109.5° |
| H12 | N2 | H13 | 120.0° | 120.0° |
| H19 | C19 | H20 | 109.5° | 109.5° |
| H22 | C20 | H23 | 109.5° | 112.9° |
| H25 | C22 | H26 | 109.5° | 112.8° |
| H29 | C26 | H30 | 109.5° | 109.3° |
| H32 | C28 | H33 | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C6 | O2 | C5 | 176.4° | 180.0° |
| N2 | C6 | C5 | C7 | 13.6° | 100.8° |
| N2 | C6 | C5 | C4 | 170.4° | 79.1° |
| C6 | N2 | H12 | H13 | 180.0° | 179.9° |
| O2 | C6 | C5 | C7 | 163.0° | 79.2° |
| O2 | C6 | C5 | C4 | 13.0° | 100.9° |
| O2 | C6 | N2 | H12 | 0.0° | 4.8° |
| O2 | C6 | N2 | H13 | 180.0° | 175.2° |
| C6 | C5 | C7 | O3 | 21.4° | 11.8° |
| C6 | C5 | C7 | C4 | 176.0° | 179.9° |
| C6 | C5 | C7 | C8 | 159.1° | 168.3° |
| C6 | C5 | C4 | O1 | 19.9° | 1.3° |
| C6 | C5 | C4 | C3 | 158.3° | 178.6° |
| C5 | C6 | N2 | H12 | 176.4° | 175.2° |
| C5 | C6 | N2 | H13 | 3.6° | 4.8° |
| O3 | C7 | C5 | C8 | 179.5° | 179.9° |
| O3 | C7 | C5 | C4 | 162.5° | 168.1° |
| O3 | C7 | C8 | C9 | 2.0° | 22.7° |
| O3 | C7 | C8 | O4 | 118.5° | 98.1° |
| O3 | C7 | C8 | C29 | 122.5° | 140.4° |
| C5 | C7 | C8 | C9 | 177.5° | 157.2° |
| C7 | C5 | C4 | O1 | 156.2° | 178.6° |
| C7 | C5 | C4 | C3 | 25.6° | 1.5° |
| C5 | C7 | C8 | O4 | 62.0° | 82.0° |
| C5 | C7 | C8 | C29 | 57.0° | 39.5° |
| C8 | C7 | C5 | C4 | 17.0° | 11.8° |
| C7 | C8 | C9 | O5 | 85.9° | 79.8° |
| C7 | C8 | C9 | C10 | 92.0° | 100.1° |
| C7 | C8 | C9 | O4 | 120.2° | 120.7° |
| C7 | C8 | C9 | C29 | 117.7° | 116.9° |
| C7 | C8 | O4 | C29 | 116.9° | 119.7° |
| C7 | C8 | C29 | C28 | 67.8° | 66.0° |
| C7 | C8 | C29 | C3 | 56.9° | 58.4° |
| C7 | C8 | O4 | H14 | 180.0° | 64.2° |
| C7 | C8 | C29 | H34 | 175.7° | 176.6° |
| C5 | C4 | O1 | C3 | 178.3° | 179.9° |
| C5 | C4 | C3 | C29 | 23.7° | 20.8° |
| C5 | C4 | C3 | N1 | 154.8° | 99.9° |
| C5 | C4 | C3 | H8 | 90.3° | 141.4° |
| C5 | C4 | O1 | H10 | 12.5° | 4.7° |
| O6 | C11 | C12 | C13 | 161.7° | 167.2° |
| O6 | C11 | C12 | C10 | 178.3° | 180.0° |
| O6 | C11 | C12 | C25 | 19.7° | 11.6° |
| O6 | C11 | C10 | C9 | 1.2° | 8.6° |
| O6 | C11 | C10 | C27 | 174.3° | 170.3° |
| C13 | C26 | C27 | H29 | 119.8° | 120.2° |
| C13 | C26 | C27 | H30 | 119.8° | 120.1° |
| C26 | C13 | C14 | C12 | 178.9° | 179.4° |
| C26 | C13 | C12 | C11 | 0.0° | 1.6° |
| C26 | C13 | C14 | C15 | 179.3° | 178.5° |
| C26 | C13 | C12 | C25 | 178.6° | 177.2° |
| C13 | C26 | C27 | C10 | 61.2° | 54.9° |
| C13 | C26 | C27 | C28 | 175.6° | 176.3° |
| C26 | C13 | C14 | H16 | 0.7° | 1.4° |
| C13 | C26 | H29 | H30 | 120.5° | 119.7° |
| C13 | C26 | C27 | H31 | 56.4° | 65.0° |
| C27 | C26 | C13 | C14 | 137.9° | 144.9° |
| C27 | C26 | C13 | C12 | 41.0° | 35.8° |
| C26 | C27 | C10 | C11 | 44.4° | 43.8° |
| C26 | C27 | C10 | C9 | 140.1° | 137.3° |
| C26 | C27 | C10 | C28 | 122.7° | 121.0° |
| C26 | C27 | C10 | H31 | 117.6° | 119.9° |
| C26 | C27 | C28 | H31 | 119.2° | 119.2° |
| C26 | C27 | C28 | C29 | 166.0° | 170.9° |
| C27 | C26 | H29 | H30 | 120.5° | 119.8° |
| C26 | C27 | C28 | H32 | 73.7° | 69.4° |
| C26 | C27 | C28 | H33 | 45.7° | 51.3° |
| C14 | C13 | C12 | C11 | 179.0° | 179.0° |
| C13 | C14 | C15 | H16 | 180.0° | 180.0° |
| C14 | C13 | C12 | C25 | 0.4° | 2.2° |
| C13 | C14 | C15 | C16 | 179.0° | 179.4° |
| C13 | C14 | C15 | C24 | 0.7° | 0.6° |
| C14 | C13 | C26 | H29 | 18.1° | 24.7° |
| C14 | C13 | C26 | H30 | 102.3° | 95.0° |
| C13 | C12 | C11 | C25 | 178.6° | 178.8° |
| C13 | C12 | C11 | C10 | 20.0° | 12.8° |
| C12 | C13 | C14 | C15 | 0.4° | 0.8° |
| C13 | C12 | C25 | C24 | 0.8° | 2.0° |
| C13 | C12 | C25 | O7 | 179.8° | 178.0° |
| C12 | C13 | C14 | H16 | 179.6° | 179.2° |
| C12 | C13 | C26 | H29 | 160.8° | 155.9° |
| C12 | C13 | C26 | H30 | 78.8° | 84.4° |
| C11 | C12 | C25 | C24 | 179.4° | 179.3° |
| C11 | C12 | C25 | O7 | 1.2° | 0.7° |
| C12 | C11 | C10 | C9 | 179.5° | 171.4° |
| C12 | C11 | C10 | C27 | 3.9° | 9.7° |
| C11 | C10 | C9 | O5 | 1.1° | 1.7° |
| C10 | C11 | C12 | C25 | 158.6° | 168.4° |
| C11 | C10 | C9 | C27 | 175.3° | 178.8° |
| C11 | C10 | C9 | C8 | 176.6° | 178.4° |
| C11 | C10 | C27 | C28 | 167.2° | 164.8° |
| C11 | C10 | C27 | H31 | 73.2° | 76.1° |
| C14 | C15 | C16 | C24 | 179.7° | 180.0° |
| C14 | C15 | C16 | C17 | 179.7° | 179.6° |
| C14 | C15 | C24 | C25 | 0.2° | 0.8° |
| C14 | C15 | C24 | C23 | 179.1° | 179.4° |
| C14 | C15 | C16 | H17 | 0.3° | 0.4° |
| O5 | C9 | C10 | C8 | 177.7° | 180.0° |
| O5 | C9 | C10 | C27 | 174.2° | 179.5° |
| O5 | C9 | C8 | O4 | 34.3° | 40.9° |
| O5 | C9 | C8 | C29 | 156.4° | 163.2° |
| C12 | C25 | C24 | C15 | 0.5° | 0.5° |
| C12 | C25 | C24 | O7 | 179.4° | 180.0° |
| C12 | C25 | C24 | C23 | 179.8° | 179.3° |
| C12 | C25 | O7 | H28 | 7.3° | 90.0° |
| C15 | C16 | C17 | H17 | 180.0° | 180.0° |
| C16 | C15 | C24 | C25 | 179.4° | 179.2° |
| C16 | C15 | C24 | C23 | 1.2° | 0.6° |
| C15 | C16 | C17 | C18 | 0.3° | 0.0° |
| C16 | C15 | C14 | H16 | 1.0° | 0.7° |
| C15 | C16 | C17 | H18 | 179.6° | 180.0° |
| C24 | C15 | C16 | C17 | 0.6° | 0.4° |
| C15 | C24 | C25 | C23 | 179.3° | 179.8° |
| C15 | C24 | C25 | O7 | 179.9° | 179.5° |
| C15 | C24 | C23 | C18 | 0.9° | 0.4° |
| C24 | C15 | C14 | H16 | 179.3° | 179.3° |
| C24 | C15 | C16 | H17 | 179.4° | 179.6° |
| C15 | C24 | C23 | H27 | 179.1° | 179.6° |
| C16 | C17 | C18 | H18 | 180.0° | 179.9° |
| C16 | C17 | C18 | C23 | 0.7° | 0.2° |
| C16 | C17 | C18 | C19 | 179.3° | 179.8° |
| C25 | C24 | C23 | C18 | 179.8° | 179.4° |
| C25 | C24 | C23 | H27 | 0.3° | 0.7° |
| C24 | C25 | O7 | H28 | 172.1° | 90.0° |
| O7 | C25 | C24 | C23 | 0.8° | 0.7° |
| C10 | C9 | C8 | O4 | 147.8° | 139.1° |
| C10 | C9 | C8 | C29 | 25.6° | 16.8° |
| C9 | C10 | C27 | C28 | 17.4° | 16.4° |
| C10 | C9 | O5 | H15 | 0.5° | 124.3° |
| C9 | C10 | C27 | H31 | 102.2° | 102.7° |
| C8 | C9 | C10 | C27 | 8.1° | 0.5° |
| C9 | C8 | O4 | C29 | 122.7° | 121.3° |
| C9 | C8 | C29 | C28 | 51.6° | 50.7° |
| C9 | C8 | C29 | C3 | 176.4° | 175.1° |
| C9 | C8 | O4 | H14 | 59.6° | 54.8° |
| C8 | C9 | O5 | H15 | 177.4° | 55.8° |
| C9 | C8 | C29 | H34 | 64.9° | 66.7° |
| C24 | C23 | C18 | C17 | 0.0° | 0.0° |
| C24 | C23 | C18 | H27 | 180.0° | 180.0° |
| C24 | C23 | C18 | C19 | 178.6° | 180.0° |
| C10 | C27 | C28 | H31 | 119.6° | 119.6° |
| C10 | C27 | C28 | C29 | 44.8° | 49.6° |
| C10 | C27 | C26 | H29 | 179.0° | 175.0° |
| C10 | C27 | C26 | H30 | 58.6° | 65.2° |
| C10 | C27 | C28 | H32 | 165.1° | 169.3° |
| C10 | C27 | C28 | H33 | 75.5° | 69.9° |
| C17 | C18 | C23 | C19 | 178.6° | 180.0° |
| C17 | C18 | C19 | N3 | 110.3° | 90.0° |
| C18 | C17 | C16 | H17 | 179.7° | 180.0° |
| C17 | C18 | C19 | H19 | 129.0° | 150.0° |
| C17 | C18 | C19 | H20 | 10.4° | 30.0° |
| C17 | C18 | C23 | H27 | 180.0° | 180.0° |
| O1 | C4 | C3 | C29 | 158.0° | 159.2° |
| O1 | C4 | C3 | N1 | 26.9° | 80.1° |
| O1 | C4 | C3 | H8 | 88.0° | 38.6° |
| C4 | C3 | C29 | C8 | 19.5° | 50.0° |
| C4 | C3 | C29 | C28 | 103.7° | 72.9° |
| C4 | C3 | C29 | N1 | 129.6° | 120.7° |
| C4 | C3 | C29 | H8 | 114.3° | 120.6° |
| C4 | C3 | N1 | H8 | 114.6° | 118.7° |
| C4 | C3 | N1 | C1 | 67.5° | 172.6° |
| C4 | C3 | N1 | C2 | 162.6° | 48.7° |
| C3 | C4 | O1 | H10 | 165.7° | 175.4° |
| C4 | C3 | C29 | H34 | 138.4° | 168.5° |
| C23 | C18 | C19 | N3 | 71.2° | 90.0° |
| C23 | C18 | C17 | H18 | 179.3° | 179.9° |
| C23 | C18 | C19 | H19 | 49.5° | 30.0° |
| C23 | C18 | C19 | H20 | 168.2° | 150.0° |
| O4 | C8 | C29 | C28 | 173.6° | 172.8° |
| O4 | C8 | C29 | C3 | 61.6° | 62.9° |
| O4 | C8 | C29 | H34 | 57.1° | 55.3° |
| C8 | C29 | C28 | C27 | 63.5° | 69.4° |
| C8 | C29 | C28 | C3 | 125.7° | 124.3° |
| C8 | C29 | C28 | H34 | 116.5° | 117.4° |
| C8 | C29 | C3 | H34 | 118.9° | 118.5° |
| C8 | C29 | C3 | N1 | 110.1° | 70.7° |
| C8 | C29 | C3 | H8 | 133.8° | 170.6° |
| C29 | C8 | O4 | H14 | 63.1° | 176.0° |
| C8 | C29 | C28 | H32 | 176.2° | 171.0° |
| C8 | C29 | C28 | H33 | 56.8° | 50.2° |
| C18 | C19 | N3 | H19 | 120.7° | 120.0° |
| C18 | C19 | N3 | H20 | 120.7° | 120.0° |
| C18 | C19 | N3 | C22 | 163.0° | 170.0° |
| C18 | C19 | N3 | C20 | 57.5° | 94.0° |
| C19 | C18 | C17 | H18 | 0.7° | 0.1° |
| C18 | C19 | H19 | H20 | 117.9° | 120.0° |
| C19 | C18 | C23 | H27 | 1.4° | 0.1° |
| C27 | C28 | C29 | H32 | 120.3° | 119.6° |
| C27 | C28 | C29 | H33 | 120.3° | 119.6° |
| C27 | C28 | C29 | C3 | 170.8° | 166.4° |
| C28 | C27 | C26 | H29 | 55.8° | 63.6° |
| C28 | C27 | C26 | H30 | 64.6° | 56.1° |
| C27 | C28 | H32 | H33 | 119.1° | 120.7° |
| C27 | C28 | C29 | H34 | 53.0° | 48.1° |
| C28 | C29 | C3 | H34 | 117.9° | 118.6° |
| C28 | C29 | C3 | N1 | 126.6° | 166.4° |
| C28 | C29 | C3 | H8 | 10.5° | 47.7° |
| C29 | C28 | C27 | H31 | 74.8° | 69.9° |
| C29 | C28 | H32 | H33 | 119.0° | 120.6° |
| C19 | N3 | C22 | C20 | 121.1° | 111.7° |
| C19 | N3 | C22 | C21 | 104.4° | 138.7° |
| C19 | N3 | C20 | C21 | 103.0° | 138.7° |
| N3 | C19 | H19 | H20 | 117.9° | 120.0° |
| C19 | N3 | C20 | H22 | 13.2° | 24.0° |
| C19 | N3 | C20 | H23 | 140.7° | 106.5° |
| C19 | N3 | C22 | H25 | 139.4° | 106.5° |
| C19 | N3 | C22 | H26 | 11.8° | 23.9° |
| C29 | C3 | N1 | H8 | 115.6° | 118.6° |
| C29 | C3 | N1 | C1 | 62.3° | 64.7° |
| C29 | C3 | N1 | C2 | 67.7° | 171.3° |
| C3 | C29 | C28 | H32 | 50.5° | 46.7° |
| C3 | C29 | C28 | H33 | 68.9° | 74.0° |
| C3 | N1 | C1 | C2 | 132.7° | 124.0° |
| C3 | N1 | C1 | H1 | 180.0° | 177.1° |
| C3 | N1 | C1 | H2 | 60.0° | 63.0° |
| C3 | N1 | C1 | H3 | 60.0° | 57.1° |
| C3 | N1 | C2 | H5 | 180.0° | 56.7° |
| C3 | N1 | C2 | H6 | 60.0° | 63.3° |
| C3 | N1 | C2 | H7 | 60.0° | 176.7° |
| N1 | C3 | C29 | H34 | 8.8° | 47.8° |
| N3 | C22 | C21 | H25 | 116.2° | 114.7° |
| N3 | C22 | C21 | H26 | 116.2° | 114.8° |
| C22 | N3 | C20 | C21 | 16.7° | 27.0° |
| N3 | C22 | C21 | F1 | 130.9° | 87.6° |
| C22 | N3 | C19 | H19 | 76.4° | 50.0° |
| C22 | N3 | C19 | H20 | 42.3° | 70.0° |
| C22 | N3 | C20 | H22 | 132.9° | 87.7° |
| C22 | N3 | C20 | H23 | 99.5° | 141.8° |
| N3 | C22 | C21 | H24 | 96.5° | 139.7° |
| N3 | C22 | H25 | H26 | 130.1° | 130.7° |
| N3 | C20 | C21 | H22 | 116.2° | 114.7° |
| N3 | C20 | C21 | H23 | 116.2° | 114.7° |
| N3 | C20 | C21 | F1 | 132.0° | 87.6° |
| C20 | N3 | C19 | H19 | 178.2° | 146.0° |
| C20 | N3 | C19 | H20 | 63.1° | 26.0° |
| N3 | C20 | H22 | H23 | 130.0° | 130.8° |
| N3 | C20 | C21 | H24 | 96.5° | 139.9° |
| C20 | N3 | C22 | H25 | 99.5° | 141.8° |
| C20 | N3 | C22 | H26 | 132.9° | 87.8° |
| C22 | C21 | C20 | F1 | 115.7° | 113.7° |
| C22 | C21 | C20 | H24 | 112.8° | 113.9° |
| C22 | C21 | F1 | H24 | 131.3° | 133.2° |
| C22 | C21 | C20 | H22 | 132.5° | 88.7° |
| C22 | C21 | C20 | H23 | 100.0° | 140.8° |
| C21 | C22 | H25 | H26 | 130.0° | 130.9° |
| N1 | C1 | H1 | H2 | 120.0° | 120.0° |
| N1 | C1 | H1 | H3 | 120.0° | 120.0° |
| N1 | C1 | H2 | H3 | 120.0° | 120.1° |
| C1 | N1 | C2 | H5 | 45.0° | 67.2° |
| C1 | N1 | C2 | H6 | 74.9° | 172.7° |
| C1 | N1 | C2 | H7 | 165.1° | 52.7° |
| C1 | N1 | C3 | H8 | 177.9° | 53.9° |
| C2 | N1 | C1 | H1 | 47.3° | 53.1° |
| C2 | N1 | C1 | H2 | 167.3° | 173.0° |
| C2 | N1 | C1 | H3 | 72.7° | 66.9° |
| N1 | C2 | H5 | H6 | 120.0° | 120.0° |
| N1 | C2 | H5 | H7 | 120.0° | 120.0° |
| N1 | C2 | H6 | H7 | 119.9° | 120.0° |
| C2 | N1 | C3 | H8 | 48.0° | 70.1° |
| C20 | C21 | F1 | H24 | 130.2° | 132.9° |
| C21 | C20 | H22 | H23 | 130.0° | 130.9° |
| C20 | C21 | C22 | H25 | 100.0° | 140.8° |
| C20 | C21 | C22 | H26 | 132.5° | 88.7° |
| F1 | C21 | C20 | H22 | 111.8° | 157.6° |
| F1 | C21 | C20 | H23 | 15.7° | 27.1° |
| F1 | C21 | C22 | H25 | 14.7° | 27.1° |
| F1 | C21 | C22 | H26 | 112.9° | 157.6° |
| H1 | C1 | H2 | H3 | 119.9° | 120.0° |
| H5 | C2 | H6 | H7 | 120.0° | 120.0° |
| H8 | C3 | C29 | H34 | 107.3° | 70.9° |
| H17 | C16 | C17 | H18 | 0.4° | 0.1° |
| H22 | C20 | C21 | H24 | 19.7° | 25.2° |
| H23 | C20 | C21 | H24 | 147.2° | 105.4° |
| H24 | C21 | C22 | H25 | 147.2° | 105.5° |
| H24 | C21 | C22 | H26 | 19.7° | 25.0° |
| H29 | C26 | C27 | H31 | 63.4° | 55.1° |
| H30 | C26 | C27 | H31 | 176.2° | 174.8° |
| H31 | C27 | C28 | H32 | 45.5° | 49.8° |
| H31 | C27 | C28 | H33 | 164.9° | 170.5° |
| H32 | C28 | C29 | H34 | 67.3° | 71.6° |
| H33 | C28 | C29 | H34 | 173.3° | 167.7° |
