A1EPE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C26 | sing | 1.53Å | 1.49Å | |
| C26 | C17 | sing | 1.51Å | 1.55Å | |
| C17 | N5 | sing | 1.35Å | 1.40Å | |
| C17 | O2 | doub | 1.21Å | 1.18Å | |
| N5 | C13 | sing | 1.40Å | 1.46Å | |
| C13 | C14 | doub | 1.39Å | 1.41Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.37Å | 1.42Å | Aromatic |
| C12 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | C10 | sing | 1.41Å | 1.47Å | Aromatic |
| C9 | N4 | sing | 1.38Å | 1.49Å | Aromatic |
| C10 | C11 | sing | 1.47Å | 1.40Å | Aromatic |
| C16 | N4 | sing | 1.47Å | 1.48Å | |
| N4 | C8 | sing | 1.37Å | 1.38Å | Aromatic |
| C11 | C8 | doub | 1.35Å | 1.30Å | Aromatic |
| C11 | C6 | sing | 1.48Å | 1.57Å | |
| C6 | C7 | doub | 1.36Å | 1.34Å | Aromatic |
| C6 | C3 | sing | 1.47Å | 1.46Å | Aromatic |
| C7 | N3 | sing | 1.37Å | 1.34Å | Aromatic |
| C3 | N1 | doub | 1.33Å | 1.31Å | Aromatic |
| C3 | C4 | sing | 1.41Å | 1.50Å | Aromatic |
| N3 | C4 | sing | 1.38Å | 1.47Å | Aromatic |
| N1 | C2 | sing | 1.33Å | 1.37Å | Aromatic |
| C4 | N2 | doub | 1.33Å | 1.30Å | Aromatic |
| C2 | C5 | sing | 1.48Å | 1.51Å | |
| C2 | C1 | doub | 1.40Å | 1.44Å | Aromatic |
| C18 | C5 | sing | 1.41Å | 1.45Å | Aromatic |
| C18 | N6 | doub | 1.31Å | 1.35Å | Aromatic |
| N2 | C1 | sing | 1.32Å | 1.38Å | Aromatic |
| C5 | C19 | doub | 1.36Å | 1.39Å | Aromatic |
| N6 | N7 | sing | 1.40Å | 1.36Å | Aromatic |
| C21 | N8 | sing | 1.47Å | 1.33Å | |
| C21 | C20 | sing | 1.53Å | 1.54Å | |
| C19 | N7 | sing | 1.35Å | 1.39Å | Aromatic |
| C22 | N8 | sing | 1.47Å | 1.31Å | |
| C22 | C23 | sing | 1.53Å | 1.56Å | |
| N7 | C20 | sing | 1.46Å | 1.46Å | |
| N8 | C25 | sing | 1.47Å | 1.34Å | |
| C23 | O1 | sing | 1.43Å | 1.42Å | |
| C25 | C24 | sing | 1.53Å | 1.56Å | |
| O1 | C24 | sing | 1.43Å | 1.42Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C8 | H2 | sing | 1.08Å | 1.08Å | |
| C7 | H3 | sing | 1.08Å | 1.08Å | |
| C14 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.08Å | 1.08Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C18 | H13 | sing | 1.08Å | 1.08Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H20 | sing | 1.09Å | 1.10Å | |
| C24 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| C26 | H28 | sing | 1.09Å | 1.10Å | |
| N3 | H29 | sing | 0.97Å | 1.00Å | |
| N5 | H30 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | C26 | C17 | 104.3° | 109.5° |
| C26 | C27 | H24 | 109.5° | 109.5° |
| C26 | C27 | H25 | 109.4° | 109.4° |
| C26 | C27 | H26 | 109.5° | 109.5° |
| C27 | C26 | H27 | 110.8° | 109.4° |
| C27 | C26 | H28 | 110.7° | 109.5° |
| C26 | C17 | N5 | 111.8° | 120.0° |
| C26 | C17 | O2 | 123.9° | 120.0° |
| C17 | C26 | H27 | 110.7° | 109.5° |
| C17 | C26 | H28 | 110.8° | 109.5° |
| N5 | C17 | O2 | 124.3° | 120.0° |
| C17 | N5 | C13 | 126.9° | 120.0° |
| C17 | N5 | H30 | 116.6° | 120.0° |
| N5 | C13 | C14 | 115.2° | 119.8° |
| N5 | C13 | C12 | 120.8° | 119.7° |
| C13 | N5 | H30 | 116.6° | 120.0° |
| C14 | C13 | C12 | 123.6° | 120.5° |
| C13 | C14 | C15 | 120.2° | 120.5° |
| C13 | C14 | H4 | 119.9° | 119.8° |
| C13 | C12 | C9 | 115.3° | 119.7° |
| C13 | C12 | H12 | 122.4° | 120.2° |
| C14 | C15 | C10 | 119.2° | 119.9° |
| C15 | C14 | H4 | 119.9° | 119.8° |
| C14 | C15 | H5 | 120.4° | 120.1° |
| C12 | C9 | C10 | 123.7° | 119.4° |
| C12 | C9 | N4 | 134.4° | 133.2° |
| C9 | C12 | H12 | 122.3° | 120.2° |
| C15 | C10 | C9 | 117.8° | 120.1° |
| C15 | C10 | C11 | 138.6° | 133.8° |
| C10 | C15 | H5 | 120.4° | 120.0° |
| C10 | C9 | N4 | 101.8° | 107.4° |
| C9 | C10 | C11 | 103.5° | 106.1° |
| C9 | N4 | C16 | 118.9° | 125.0° |
| C9 | N4 | C8 | 112.3° | 110.0° |
| C10 | C11 | C8 | 118.8° | 106.8° |
| C10 | C11 | C6 | 119.6° | 126.6° |
| C16 | N4 | C8 | 128.8° | 125.0° |
| N4 | C16 | H6 | 109.5° | 109.5° |
| N4 | C16 | H7 | 109.5° | 109.5° |
| N4 | C16 | H8 | 109.4° | 109.5° |
| N4 | C8 | C11 | 103.5° | 109.7° |
| N4 | C8 | H2 | 128.2° | 125.1° |
| C8 | C11 | C6 | 121.5° | 126.6° |
| C11 | C8 | H2 | 128.3° | 125.2° |
| C11 | C6 | C7 | 123.3° | 126.6° |
| C11 | C6 | C3 | 119.5° | 126.7° |
| C7 | C6 | C3 | 117.1° | 106.7° |
| C6 | C7 | N3 | 102.1° | 109.8° |
| C6 | C7 | H3 | 129.0° | 125.1° |
| C6 | C3 | N1 | 135.2° | 133.8° |
| C6 | C3 | C4 | 102.3° | 106.1° |
| C7 | N3 | C4 | 117.6° | 110.2° |
| N3 | C7 | H3 | 129.0° | 125.1° |
| C7 | N3 | H29 | 121.2° | 124.9° |
| N1 | C3 | C4 | 122.5° | 120.1° |
| C3 | N1 | C2 | 114.6° | 119.6° |
| C3 | C4 | N3 | 101.0° | 107.3° |
| C3 | C4 | N2 | 122.1° | 119.6° |
| N3 | C4 | N2 | 136.9° | 133.1° |
| C4 | N3 | H29 | 121.2° | 124.9° |
| N1 | C2 | C5 | 117.4° | 120.0° |
| N1 | C2 | C1 | 124.4° | 120.1° |
| C4 | N2 | C1 | 117.0° | 120.1° |
| C5 | C2 | C1 | 118.2° | 120.0° |
| C2 | C5 | C18 | 126.1° | 126.2° |
| C2 | C5 | C19 | 126.3° | 126.2° |
| C2 | C1 | N2 | 119.4° | 120.5° |
| C2 | C1 | H1 | 120.3° | 119.7° |
| C5 | C18 | N6 | 107.0° | 108.1° |
| C18 | C5 | C19 | 107.5° | 107.6° |
| C5 | C18 | H13 | 126.5° | 126.0° |
| C18 | N6 | N7 | 108.8° | 108.5° |
| N6 | C18 | H13 | 126.5° | 126.0° |
| N2 | C1 | H1 | 120.3° | 119.8° |
| C5 | C19 | N7 | 105.8° | 107.6° |
| C5 | C19 | H9 | 127.1° | 126.2° |
| N6 | N7 | C19 | 110.8° | 108.2° |
| N6 | N7 | C20 | 125.0° | 125.9° |
| N8 | C21 | C20 | 106.3° | 109.4° |
| C21 | N8 | C22 | 110.0° | 110.9° |
| C21 | N8 | C25 | 111.5° | 111.0° |
| N8 | C21 | H14 | 110.3° | 109.5° |
| N8 | C21 | H15 | 110.2° | 109.5° |
| C21 | C20 | N7 | 114.3° | 109.5° |
| C21 | C20 | H10 | 108.3° | 109.5° |
| C21 | C20 | H11 | 108.2° | 109.5° |
| C20 | C21 | H14 | 110.3° | 109.5° |
| C20 | C21 | H15 | 110.3° | 109.5° |
| C19 | N7 | C20 | 124.3° | 125.9° |
| N7 | C19 | H9 | 127.1° | 126.2° |
| N8 | C22 | C23 | 111.3° | 109.2° |
| C22 | N8 | C25 | 113.1° | 110.8° |
| N8 | C22 | H16 | 109.0° | 109.5° |
| N8 | C22 | H17 | 109.0° | 109.5° |
| C22 | C23 | O1 | 109.8° | 109.2° |
| C23 | C22 | H16 | 109.0° | 109.5° |
| C23 | C22 | H17 | 109.0° | 109.5° |
| C22 | C23 | H18 | 109.4° | 109.5° |
| C22 | C23 | H19 | 109.4° | 109.5° |
| N7 | C20 | H10 | 108.3° | 109.5° |
| N7 | C20 | H11 | 108.3° | 109.5° |
| N8 | C25 | C24 | 112.0° | 109.2° |
| N8 | C25 | H22 | 108.8° | 109.5° |
| N8 | C25 | H23 | 108.8° | 109.6° |
| C23 | O1 | C24 | 110.5° | 113.7° |
| O1 | C23 | H18 | 109.4° | 109.5° |
| O1 | C23 | H19 | 109.4° | 109.6° |
| C25 | C24 | O1 | 110.2° | 109.3° |
| C25 | C24 | H20 | 109.3° | 109.5° |
| C25 | C24 | H21 | 109.3° | 109.5° |
| C24 | C25 | H22 | 108.8° | 109.5° |
| C24 | C25 | H23 | 108.9° | 109.5° |
| O1 | C24 | H20 | 109.3° | 109.5° |
| O1 | C24 | H21 | 109.3° | 109.5° |
| H6 | C16 | H7 | 109.4° | 109.5° |
| H6 | C16 | H8 | 109.5° | 109.4° |
| H7 | C16 | H8 | 109.5° | 109.5° |
| H10 | C20 | H11 | 109.5° | 109.4° |
| H14 | C21 | H15 | 109.4° | 109.5° |
| H16 | C22 | H17 | 109.5° | 109.6° |
| H18 | C23 | H19 | 109.5° | 109.5° |
| H20 | C24 | H21 | 109.5° | 109.5° |
| H22 | C25 | H23 | 109.5° | 109.5° |
| H24 | C27 | H25 | 109.5° | 109.5° |
| H24 | C27 | H26 | 109.5° | 109.5° |
| H25 | C27 | H26 | 109.5° | 109.5° |
| H27 | C26 | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | C26 | C17 | H27 | 119.2° | 120.0° |
| C27 | C26 | C17 | H28 | 119.2° | 120.0° |
| C27 | C26 | C17 | N5 | 170.3° | 180.0° |
| C27 | C26 | C17 | O2 | 8.0° | 0.0° |
| C26 | C27 | H24 | H25 | 120.0° | 120.0° |
| C26 | C27 | H24 | H26 | 120.0° | 120.0° |
| C26 | C27 | H25 | H26 | 120.0° | 120.0° |
| C27 | C26 | H27 | H28 | 122.4° | 120.0° |
| C26 | C17 | N5 | O2 | 178.3° | 180.0° |
| C26 | C17 | N5 | C13 | 176.0° | 175.4° |
| C17 | C26 | C27 | H24 | 180.0° | 180.0° |
| C17 | C26 | C27 | H25 | 60.0° | 60.0° |
| C17 | C26 | C27 | H26 | 60.0° | 60.0° |
| C17 | C26 | H27 | H28 | 122.4° | 120.0° |
| C26 | C17 | N5 | H30 | 4.0° | 4.5° |
| C17 | N5 | C13 | H30 | 180.0° | 179.9° |
| C17 | N5 | C13 | C14 | 156.7° | 144.8° |
| C17 | N5 | C13 | C12 | 29.7° | 35.2° |
| N5 | C17 | C26 | H27 | 51.2° | 60.0° |
| N5 | C17 | C26 | H28 | 70.5° | 60.0° |
| O2 | C17 | N5 | C13 | 5.7° | 4.6° |
| O2 | C17 | C26 | H27 | 127.1° | 120.0° |
| O2 | C17 | C26 | H28 | 111.2° | 120.0° |
| O2 | C17 | N5 | H30 | 174.3° | 175.5° |
| N5 | C13 | C14 | C12 | 173.4° | 180.0° |
| N5 | C13 | C14 | C15 | 177.5° | 180.0° |
| N5 | C13 | C12 | C9 | 176.8° | 180.0° |
| N5 | C13 | C14 | H4 | 2.5° | 0.0° |
| N5 | C13 | C12 | H12 | 3.2° | 0.0° |
| C13 | C14 | C15 | H4 | 180.0° | 179.9° |
| C14 | C13 | C12 | C9 | 3.7° | 0.1° |
| C13 | C14 | C15 | C10 | 1.6° | 0.0° |
| C13 | C14 | C15 | H5 | 178.4° | 179.9° |
| C14 | C13 | C12 | H12 | 176.3° | 180.0° |
| C14 | C13 | N5 | H30 | 23.3° | 35.1° |
| C12 | C13 | C14 | C15 | 4.1° | 0.1° |
| C13 | C12 | C9 | H12 | 180.0° | 179.9° |
| C13 | C12 | C9 | C10 | 1.2° | 0.0° |
| C13 | C12 | C9 | N4 | 179.3° | 180.0° |
| C12 | C13 | C14 | H4 | 175.9° | 180.0° |
| C12 | C13 | N5 | H30 | 150.4° | 144.9° |
| C14 | C15 | C10 | H5 | 180.0° | 179.9° |
| C14 | C15 | C10 | C9 | 0.8° | 0.1° |
| C14 | C15 | C10 | C11 | 177.8° | 179.9° |
| C12 | C9 | C10 | C15 | 1.0° | 0.1° |
| C12 | C9 | C10 | N4 | 179.7° | 180.0° |
| C12 | C9 | C10 | C11 | 179.0° | 179.9° |
| C12 | C9 | N4 | C16 | 0.8° | 0.0° |
| C12 | C9 | N4 | C8 | 179.4° | 179.9° |
| C15 | C10 | C9 | C11 | 178.0° | 179.9° |
| C15 | C10 | C9 | N4 | 178.7° | 179.9° |
| C15 | C10 | C11 | C8 | 178.5° | 180.0° |
| C15 | C10 | C11 | C6 | 3.9° | 0.0° |
| C10 | C15 | C14 | H4 | 178.4° | 179.9° |
| C10 | C9 | N4 | C16 | 179.6° | 180.0° |
| C10 | C9 | N4 | C8 | 0.2° | 0.1° |
| C9 | C10 | C11 | C8 | 1.2° | 0.2° |
| C9 | C10 | C11 | C6 | 178.7° | 179.9° |
| C9 | C10 | C15 | H5 | 179.2° | 180.0° |
| C10 | C9 | C12 | H12 | 178.8° | 179.9° |
| N4 | C9 | C10 | C11 | 0.7° | 0.1° |
| C9 | N4 | C16 | C8 | 179.7° | 179.9° |
| C9 | N4 | C8 | C11 | 0.5° | 0.2° |
| C9 | N4 | C8 | H2 | 179.5° | 180.0° |
| C9 | N4 | C16 | H6 | 180.0° | 90.0° |
| C9 | N4 | C16 | H7 | 60.0° | 150.0° |
| C9 | N4 | C16 | H8 | 60.0° | 30.0° |
| N4 | C9 | C12 | H12 | 0.7° | 0.1° |
| C10 | C11 | C8 | N4 | 1.0° | 0.3° |
| C10 | C11 | C8 | C6 | 177.5° | 179.9° |
| C10 | C11 | C6 | C7 | 29.2° | 115.0° |
| C10 | C11 | C6 | C3 | 153.8° | 64.9° |
| C10 | C11 | C8 | H2 | 178.9° | 180.0° |
| C11 | C10 | C15 | H5 | 2.2° | 0.2° |
| C16 | N4 | C8 | C11 | 179.8° | 179.8° |
| C16 | N4 | C8 | H2 | 0.2° | 0.1° |
| N4 | C16 | H6 | H7 | 120.0° | 120.0° |
| N4 | C16 | H6 | H8 | 120.0° | 120.0° |
| N4 | C16 | H7 | H8 | 120.0° | 120.0° |
| N4 | C8 | C11 | H2 | 180.0° | 179.7° |
| N4 | C8 | C11 | C6 | 178.6° | 179.8° |
| C8 | N4 | C16 | H6 | 0.3° | 90.1° |
| C8 | N4 | C16 | H7 | 120.3° | 29.9° |
| C8 | N4 | C16 | H8 | 119.7° | 149.9° |
| C8 | C11 | C6 | C7 | 148.3° | 65.1° |
| C8 | C11 | C6 | C3 | 28.7° | 115.0° |
| C11 | C6 | C7 | C3 | 177.0° | 180.0° |
| C11 | C6 | C7 | N3 | 177.9° | 179.8° |
| C11 | C6 | C3 | N1 | 2.9° | 0.1° |
| C11 | C6 | C3 | C4 | 178.6° | 179.7° |
| C6 | C11 | C8 | H2 | 1.4° | 0.1° |
| C11 | C6 | C7 | H3 | 2.0° | 0.0° |
| C6 | C7 | N3 | H3 | 180.0° | 179.8° |
| C7 | C6 | C3 | N1 | 180.0° | 180.0° |
| C7 | C6 | C3 | C4 | 1.5° | 0.2° |
| C6 | C7 | N3 | C4 | 0.1° | 0.1° |
| C6 | C7 | N3 | H29 | 180.0° | 180.0° |
| C3 | C6 | C7 | N3 | 0.9° | 0.2° |
| C6 | C3 | N1 | C4 | 178.2° | 179.8° |
| C6 | C3 | C4 | N3 | 1.2° | 0.2° |
| C6 | C3 | N1 | C2 | 179.8° | 180.0° |
| C6 | C3 | C4 | N2 | 180.0° | 179.9° |
| C3 | C6 | C7 | H3 | 179.1° | 180.0° |
| C7 | N3 | C4 | C3 | 0.9° | 0.1° |
| C7 | N3 | C4 | H29 | 180.0° | 179.9° |
| C7 | N3 | C4 | N2 | 179.3° | 179.8° |
| N1 | C3 | C4 | N3 | 180.0° | 180.0° |
| N1 | C3 | C4 | N2 | 1.3° | 0.2° |
| C3 | N1 | C2 | C5 | 178.8° | 180.0° |
| C3 | N1 | C2 | C1 | 0.7° | 0.1° |
| C3 | C4 | N3 | N2 | 178.4° | 179.7° |
| C4 | C3 | N1 | C2 | 1.5° | 0.2° |
| C3 | C4 | N2 | C1 | 0.0° | 0.0° |
| C3 | C4 | N3 | H29 | 179.1° | 179.9° |
| N3 | C4 | N2 | C1 | 178.1° | 179.6° |
| C4 | N3 | C7 | H3 | 180.0° | 179.9° |
| N1 | C2 | C5 | C1 | 179.5° | 179.9° |
| N1 | C2 | C5 | C18 | 11.4° | 4.7° |
| N1 | C2 | C1 | N2 | 0.6° | 0.4° |
| N1 | C2 | C5 | C19 | 174.0° | 175.0° |
| N1 | C2 | C1 | H1 | 179.4° | 180.0° |
| C4 | N2 | C1 | C2 | 0.9° | 0.3° |
| C4 | N2 | C1 | H1 | 179.1° | 180.0° |
| N2 | C4 | N3 | H29 | 0.7° | 0.2° |
| C2 | C5 | C18 | C19 | 175.5° | 179.7° |
| C2 | C5 | C18 | N6 | 178.8° | 180.0° |
| C5 | C2 | C1 | N2 | 179.9° | 179.7° |
| C2 | C5 | C19 | N7 | 177.5° | 180.0° |
| C5 | C2 | C1 | H1 | 0.1° | 0.1° |
| C2 | C5 | C19 | H9 | 2.5° | 0.1° |
| C2 | C5 | C18 | H13 | 1.3° | 0.0° |
| C1 | C2 | C5 | C18 | 168.1° | 175.3° |
| C2 | C1 | N2 | H1 | 180.0° | 179.6° |
| C1 | C2 | C5 | C19 | 6.5° | 5.1° |
| C5 | C18 | N6 | H13 | 180.0° | 179.9° |
| C5 | C18 | N6 | N7 | 3.3° | 0.1° |
| C18 | C5 | C19 | N7 | 2.1° | 0.3° |
| C18 | C5 | C19 | H9 | 178.0° | 179.8° |
| N6 | C18 | C5 | C19 | 3.3° | 0.2° |
| C18 | N6 | N7 | C19 | 2.0° | 0.1° |
| C18 | N6 | N7 | C20 | 177.3° | 179.8° |
| C5 | C19 | N7 | N6 | 0.1° | 0.2° |
| C5 | C19 | N7 | H9 | 180.0° | 179.9° |
| C5 | C19 | N7 | C20 | 179.4° | 179.9° |
| C19 | C5 | C18 | H13 | 176.7° | 179.7° |
| N6 | N7 | C20 | C21 | 71.5° | 54.7° |
| N6 | N7 | C19 | C20 | 179.3° | 179.7° |
| N6 | N7 | C19 | H9 | 179.9° | 179.9° |
| N6 | N7 | C20 | H10 | 167.8° | 174.7° |
| N6 | N7 | C20 | H11 | 49.2° | 65.3° |
| N7 | N6 | C18 | H13 | 176.8° | 179.8° |
| N8 | C21 | C20 | H14 | 119.5° | 120.0° |
| N8 | C21 | C20 | H15 | 119.5° | 120.0° |
| C21 | N8 | C22 | C25 | 125.5° | 123.7° |
| C21 | N8 | C22 | C23 | 175.1° | 177.6° |
| N8 | C21 | C20 | N7 | 174.4° | 180.0° |
| C21 | N8 | C25 | C24 | 177.1° | 177.7° |
| N8 | C21 | C20 | H10 | 64.8° | 60.0° |
| N8 | C21 | C20 | H11 | 53.7° | 59.9° |
| N8 | C21 | H14 | H15 | 121.4° | 120.0° |
| C21 | N8 | C22 | H16 | 64.6° | 57.7° |
| C21 | N8 | C22 | H17 | 54.8° | 62.5° |
| C21 | N8 | C25 | H22 | 56.8° | 62.4° |
| C21 | N8 | C25 | H23 | 62.5° | 57.7° |
| C21 | C20 | N7 | C19 | 109.2° | 125.0° |
| C20 | C21 | N8 | C22 | 172.9° | 170.0° |
| C21 | C20 | N7 | H10 | 120.7° | 120.0° |
| C21 | C20 | N7 | H11 | 120.7° | 120.1° |
| C20 | C21 | N8 | C25 | 60.8° | 66.4° |
| C21 | C20 | H10 | H11 | 117.8° | 120.0° |
| C20 | C21 | H14 | H15 | 121.5° | 120.0° |
| C19 | N7 | C20 | H10 | 11.5° | 4.9° |
| C19 | N7 | C20 | H11 | 130.1° | 115.0° |
| N8 | C22 | C23 | H16 | 120.3° | 119.9° |
| N8 | C22 | C23 | H17 | 120.3° | 119.9° |
| N8 | C22 | C23 | O1 | 56.8° | 56.9° |
| C22 | N8 | C25 | C24 | 58.3° | 58.6° |
| C22 | N8 | C21 | H14 | 53.4° | 70.0° |
| C22 | N8 | C21 | H15 | 67.6° | 50.1° |
| N8 | C22 | H16 | H17 | 119.2° | 120.2° |
| N8 | C22 | C23 | H18 | 176.9° | 63.1° |
| N8 | C22 | C23 | H19 | 63.3° | 176.8° |
| C22 | N8 | C25 | H22 | 178.6° | 61.3° |
| C22 | N8 | C25 | H23 | 62.1° | 178.6° |
| C23 | C22 | N8 | C25 | 59.5° | 58.7° |
| C22 | C23 | O1 | H18 | 120.1° | 119.9° |
| C22 | C23 | O1 | H19 | 120.0° | 119.9° |
| C22 | C23 | O1 | C24 | 53.3° | 58.7° |
| C23 | C22 | H16 | H17 | 119.1° | 120.1° |
| C22 | C23 | H18 | H19 | 119.8° | 120.1° |
| C20 | N7 | C19 | H9 | 0.6° | 0.1° |
| N7 | C20 | H10 | H11 | 117.8° | 120.0° |
| N7 | C20 | C21 | H14 | 54.9° | 60.0° |
| N7 | C20 | C21 | H15 | 66.0° | 60.0° |
| N8 | C25 | C24 | H22 | 120.3° | 119.9° |
| N8 | C25 | C24 | H23 | 120.4° | 120.0° |
| N8 | C25 | C24 | O1 | 53.5° | 56.9° |
| C25 | N8 | C21 | H14 | 179.7° | 53.6° |
| C25 | N8 | C21 | H15 | 58.8° | 173.6° |
| C25 | N8 | C22 | H16 | 60.8° | 178.5° |
| C25 | N8 | C22 | H17 | 179.7° | 61.3° |
| N8 | C25 | C24 | H20 | 66.6° | 176.8° |
| N8 | C25 | C24 | H21 | 173.7° | 63.1° |
| N8 | C25 | H22 | H23 | 118.9° | 120.2° |
| C23 | O1 | C24 | C25 | 52.1° | 58.7° |
| O1 | C23 | C22 | H16 | 63.5° | 176.8° |
| O1 | C23 | C22 | H17 | 177.1° | 63.1° |
| O1 | C23 | H18 | H19 | 119.8° | 120.2° |
| C23 | O1 | C24 | H20 | 68.0° | 178.6° |
| C23 | O1 | C24 | H21 | 172.2° | 61.3° |
| C25 | C24 | O1 | H20 | 120.1° | 119.9° |
| C25 | C24 | O1 | H21 | 120.1° | 120.0° |
| C25 | C24 | H20 | H21 | 119.7° | 120.1° |
| C24 | C25 | H22 | H23 | 118.9° | 120.1° |
| C24 | O1 | C23 | H18 | 173.4° | 61.2° |
| C24 | O1 | C23 | H19 | 66.7° | 178.6° |
| O1 | C24 | H20 | H21 | 119.6° | 120.1° |
| O1 | C24 | C25 | H22 | 173.9° | 63.1° |
| O1 | C24 | C25 | H23 | 66.8° | 176.9° |
| H3 | C7 | N3 | H29 | 0.0° | 0.2° |
| H4 | C14 | C15 | H5 | 1.6° | 0.0° |
| H6 | C16 | H7 | H8 | 120.0° | 120.0° |
| H10 | C20 | C21 | H14 | 175.6° | 60.0° |
| H10 | C20 | C21 | H15 | 54.7° | 180.0° |
| H11 | C20 | C21 | H14 | 65.8° | 179.9° |
| H11 | C20 | C21 | H15 | 173.3° | 60.0° |
| H16 | C22 | C23 | H18 | 56.6° | 56.8° |
| H16 | C22 | C23 | H19 | 176.4° | 63.3° |
| H17 | C22 | C23 | H18 | 62.9° | 177.0° |
| H17 | C22 | C23 | H19 | 57.0° | 56.9° |
| H20 | C24 | C25 | H22 | 53.8° | 56.9° |
| H20 | C24 | C25 | H23 | 173.1° | 63.2° |
| H21 | C24 | C25 | H22 | 66.0° | 176.9° |
| H21 | C24 | C25 | H23 | 53.3° | 56.9° |
| H24 | C27 | H25 | H26 | 120.0° | 120.0° |
| H24 | C27 | C26 | H27 | 60.8° | 60.0° |
| H24 | C27 | C26 | H28 | 60.8° | 60.0° |
| H25 | C27 | C26 | H27 | 59.2° | 180.0° |
| H25 | C27 | C26 | H28 | 179.2° | 60.0° |
| H26 | C27 | C26 | H27 | 179.2° | 60.0° |
| H26 | C27 | C26 | H28 | 59.2° | 180.0° |
