A1EBE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C25 | sing | 1.53Å | 1.51Å | |
| C24 | N5 | sing | 1.47Å | 1.48Å | |
| N5 | C26 | sing | 1.47Å | 1.47Å | |
| N5 | C23 | sing | 1.47Å | 1.47Å | |
| C26 | C27 | sing | 1.53Å | 1.51Å | |
| C23 | N4 | sing | 1.47Å | 1.44Å | |
| O2 | C21 | doub | 1.21Å | 1.22Å | |
| N4 | C22 | sing | 1.47Å | 1.46Å | |
| C17 | C18 | doub | 1.36Å | 1.36Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.38Å | Aromatic |
| C18 | C19 | sing | 1.40Å | 1.42Å | Aromatic |
| C21 | C22 | sing | 1.51Å | 1.52Å | |
| C21 | C20 | sing | 1.47Å | 1.49Å | |
| C16 | C15 | doub | 1.36Å | 1.37Å | Aromatic |
| C19 | C20 | doub | 1.46Å | 1.42Å | Aromatic |
| C19 | C14 | sing | 1.42Å | 1.41Å | Aromatic |
| C20 | C28 | sing | 1.39Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.41Å | 1.41Å | Aromatic |
| C14 | N3 | doub | 1.34Å | 1.37Å | Aromatic |
| C28 | C13 | doub | 1.40Å | 1.40Å | Aromatic |
| N3 | C13 | sing | 1.31Å | 1.32Å | Aromatic |
| C13 | N2 | sing | 1.39Å | 1.37Å | |
| N2 | C12 | sing | 1.48Å | 1.47Å | |
| N2 | C11 | sing | 1.48Å | 1.47Å | |
| C2 | C1 | sing | 1.53Å | 1.48Å | |
| C12 | C10 | sing | 1.54Å | 1.55Å | |
| C11 | C10 | sing | 1.54Å | 1.55Å | |
| C10 | C4 | sing | 1.51Å | 1.48Å | |
| C1 | O1 | sing | 1.43Å | 1.46Å | |
| O1 | C | sing | 1.35Å | 1.33Å | |
| C4 | N | sing | 1.32Å | 1.38Å | Aromatic |
| C4 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C | C3 | sing | 1.42Å | 1.49Å | |
| C | O | doub | 1.22Å | 1.21Å | |
| N | C5 | doub | 1.33Å | 1.33Å | Aromatic |
| C3 | N1 | sing | 1.38Å | 1.40Å | Aromatic |
| C5 | N1 | sing | 1.37Å | 1.39Å | Aromatic |
| C5 | C9 | sing | 1.41Å | 1.41Å | Aromatic |
| N1 | C6 | sing | 1.36Å | 1.38Å | Aromatic |
| C9 | C8 | doub | 1.36Å | 1.36Å | Aromatic |
| C6 | C7 | doub | 1.35Å | 1.35Å | Aromatic |
| C8 | C7 | sing | 1.40Å | 1.41Å | Aromatic |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H5 | sing | 1.08Å | 1.08Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.08Å | 1.08Å | |
| C17 | H11 | sing | 1.08Å | 1.08Å | |
| C18 | H12 | sing | 1.08Å | 1.08Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.09Å | 1.10Å | |
| C27 | H21 | sing | 1.09Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.08Å | 1.08Å | |
| N4 | H25 | sing | 1.01Å | 1.00Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H30 | sing | 1.09Å | 1.10Å | |
| C15 | H31 | sing | 1.08Å | 1.08Å | |
| C10 | H32 | sing | 1.09Å | 1.10Å | |
| C8 | H33 | sing | 1.08Å | 1.08Å | |
| C6 | H34 | sing | 1.08Å | 1.08Å | |
| C1 | H35 | sing | 1.09Å | 1.10Å | |
| C1 | H36 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C24 | N5 | 114.8° | 109.5° |
| C25 | C24 | H17 | 108.1° | 109.5° |
| C25 | C24 | H18 | 108.1° | 109.5° |
| C24 | C25 | H28 | 109.5° | 109.4° |
| C24 | C25 | H29 | 109.4° | 109.5° |
| C24 | C25 | H30 | 109.4° | 109.5° |
| C24 | N5 | C26 | 111.6° | 111.0° |
| C24 | N5 | C23 | 114.8° | 111.0° |
| N5 | C24 | H17 | 108.1° | 109.4° |
| N5 | C24 | H18 | 108.1° | 109.5° |
| C26 | N5 | C23 | 113.6° | 111.0° |
| N5 | C26 | C27 | 114.1° | 109.4° |
| N5 | C26 | H19 | 108.3° | 109.5° |
| N5 | C26 | H20 | 108.3° | 109.4° |
| N5 | C23 | N4 | 112.7° | 109.5° |
| N5 | C23 | H15 | 108.6° | 109.5° |
| N5 | C23 | H16 | 108.7° | 109.5° |
| C27 | C26 | H19 | 108.3° | 109.5° |
| C27 | C26 | H20 | 108.3° | 109.5° |
| C26 | C27 | H21 | 109.5° | 109.5° |
| C26 | C27 | H22 | 109.5° | 109.5° |
| C26 | C27 | H23 | 109.5° | 109.5° |
| C23 | N4 | C22 | 113.5° | 111.0° |
| N4 | C23 | H15 | 108.7° | 109.4° |
| N4 | C23 | H16 | 108.7° | 109.5° |
| C23 | N4 | H25 | 108.5° | 111.1° |
| O2 | C21 | C22 | 119.1° | 120.1° |
| O2 | C21 | C20 | 123.0° | 120.0° |
| N4 | C22 | C21 | 111.2° | 109.5° |
| N4 | C22 | H13 | 109.0° | 109.4° |
| N4 | C22 | H14 | 109.0° | 109.5° |
| C22 | N4 | H25 | 108.4° | 111.0° |
| C18 | C17 | C16 | 120.6° | 120.8° |
| C17 | C18 | C19 | 120.8° | 119.6° |
| C18 | C17 | H11 | 119.7° | 119.6° |
| C17 | C18 | H12 | 119.6° | 120.2° |
| C17 | C16 | C15 | 120.7° | 121.1° |
| C17 | C16 | H10 | 119.6° | 119.5° |
| C16 | C17 | H11 | 119.7° | 119.6° |
| C18 | C19 | C20 | 124.4° | 121.5° |
| C18 | C19 | C14 | 118.4° | 119.9° |
| C19 | C18 | H12 | 119.6° | 120.2° |
| C22 | C21 | C20 | 117.9° | 120.0° |
| C21 | C22 | H13 | 109.1° | 109.5° |
| C21 | C22 | H14 | 109.0° | 109.5° |
| C21 | C20 | C19 | 122.5° | 121.4° |
| C21 | C20 | C28 | 118.5° | 121.3° |
| C16 | C15 | C14 | 120.4° | 119.7° |
| C15 | C16 | H10 | 119.7° | 119.4° |
| C16 | C15 | H31 | 119.8° | 120.1° |
| C20 | C19 | C14 | 117.2° | 118.6° |
| C19 | C20 | C28 | 119.0° | 117.3° |
| C19 | C14 | C15 | 119.2° | 118.9° |
| C19 | C14 | N3 | 122.6° | 120.0° |
| C20 | C28 | C13 | 119.8° | 119.4° |
| C20 | C28 | H24 | 120.1° | 120.3° |
| C15 | C14 | N3 | 118.2° | 121.1° |
| C14 | C15 | H31 | 119.8° | 120.2° |
| C14 | N3 | C13 | 118.5° | 122.4° |
| C28 | C13 | N3 | 122.9° | 122.3° |
| C28 | C13 | N2 | 120.4° | 118.8° |
| C13 | C28 | H24 | 120.1° | 120.3° |
| N3 | C13 | N2 | 116.7° | 118.8° |
| C13 | N2 | C12 | 128.8° | 111.0° |
| C13 | N2 | C11 | 127.6° | 111.0° |
| C12 | N2 | C11 | 94.9° | 90.7° |
| N2 | C12 | C10 | 88.2° | 86.2° |
| N2 | C12 | H8 | 114.5° | 113.8° |
| N2 | C12 | H9 | 114.5° | 113.9° |
| N2 | C11 | C10 | 88.3° | 86.2° |
| N2 | C11 | H6 | 114.5° | 113.7° |
| N2 | C11 | H7 | 114.5° | 113.8° |
| C2 | C1 | O1 | 108.3° | 109.5° |
| C1 | C2 | H1 | 109.5° | 109.5° |
| C1 | C2 | H2 | 109.5° | 109.5° |
| C1 | C2 | H3 | 109.5° | 109.5° |
| C2 | C1 | H35 | 109.8° | 109.5° |
| C2 | C1 | H36 | 109.8° | 109.5° |
| C12 | C10 | C11 | 88.4° | 86.3° |
| C12 | C10 | C4 | 115.3° | 113.7° |
| C10 | C12 | H8 | 114.5° | 113.8° |
| C10 | C12 | H9 | 114.5° | 113.7° |
| C12 | C10 | H32 | 110.8° | 113.7° |
| C11 | C10 | C4 | 117.6° | 113.8° |
| C10 | C11 | H6 | 114.5° | 113.8° |
| C10 | C11 | H7 | 114.5° | 113.7° |
| C11 | C10 | H32 | 110.8° | 113.7° |
| C10 | C4 | N | 118.6° | 125.9° |
| C10 | C4 | C3 | 130.1° | 125.9° |
| C4 | C10 | H32 | 111.8° | 113.0° |
| C1 | O1 | C | 116.5° | 117.0° |
| O1 | C1 | H35 | 109.8° | 109.4° |
| O1 | C1 | H36 | 109.8° | 109.4° |
| O1 | C | C3 | 111.8° | 120.0° |
| O1 | C | O | 123.8° | 120.0° |
| N | C4 | C3 | 111.2° | 108.2° |
| C4 | N | C5 | 105.8° | 109.8° |
| C4 | C3 | C | 132.9° | 126.8° |
| C4 | C3 | N1 | 104.9° | 106.4° |
| C3 | C | O | 124.3° | 120.0° |
| C | C3 | N1 | 122.2° | 126.8° |
| N | C5 | N1 | 111.2° | 108.6° |
| N | C5 | C9 | 130.6° | 131.8° |
| C3 | N1 | C5 | 106.8° | 106.9° |
| C3 | N1 | C6 | 131.0° | 132.4° |
| N1 | C5 | C9 | 118.2° | 119.6° |
| C5 | N1 | C6 | 122.1° | 120.7° |
| C5 | C9 | C8 | 119.3° | 119.4° |
| C5 | C9 | H5 | 120.3° | 120.3° |
| N1 | C6 | C7 | 119.2° | 120.7° |
| N1 | C6 | H34 | 120.4° | 119.7° |
| C9 | C8 | C7 | 120.9° | 119.6° |
| C8 | C9 | H5 | 120.4° | 120.3° |
| C9 | C8 | H33 | 119.5° | 120.2° |
| C6 | C7 | C8 | 120.2° | 120.1° |
| C6 | C7 | H4 | 119.9° | 120.0° |
| C7 | C6 | H34 | 120.4° | 119.6° |
| C8 | C7 | H4 | 119.9° | 119.9° |
| C7 | C8 | H33 | 119.6° | 120.2° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| H1 | C2 | H3 | 109.5° | 109.5° |
| H2 | C2 | H3 | 109.5° | 109.4° |
| H6 | C11 | H7 | 109.5° | 113.0° |
| H8 | C12 | H9 | 109.5° | 112.9° |
| H13 | C22 | H14 | 109.4° | 109.4° |
| H15 | C23 | H16 | 109.5° | 109.4° |
| H17 | C24 | H18 | 109.5° | 109.5° |
| H19 | C26 | H20 | 109.5° | 109.5° |
| H21 | C27 | H22 | 109.5° | 109.5° |
| H21 | C27 | H23 | 109.4° | 109.4° |
| H22 | C27 | H23 | 109.4° | 109.5° |
| H28 | C25 | H29 | 109.4° | 109.5° |
| H28 | C25 | H30 | 109.5° | 109.5° |
| H29 | C25 | H30 | 109.5° | 109.5° |
| H35 | C1 | H36 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C24 | N5 | H17 | 120.8° | 120.0° |
| C25 | C24 | N5 | H18 | 120.8° | 120.1° |
| C25 | C24 | N5 | C26 | 119.3° | 66.1° |
| C25 | C24 | N5 | C23 | 11.7° | 170.0° |
| C25 | C24 | H17 | H18 | 117.6° | 120.1° |
| C24 | C25 | H28 | H29 | 120.0° | 120.0° |
| C24 | C25 | H28 | H30 | 120.0° | 120.0° |
| C24 | C25 | H29 | H30 | 120.0° | 120.0° |
| C24 | N5 | C26 | C23 | 131.6° | 123.9° |
| C24 | N5 | C26 | C27 | 130.8° | 163.7° |
| C24 | N5 | C23 | N4 | 148.0° | 86.8° |
| C24 | N5 | C23 | H15 | 27.5° | 33.2° |
| C24 | N5 | C23 | H16 | 91.5° | 153.2° |
| N5 | C24 | H17 | H18 | 117.6° | 120.0° |
| C24 | N5 | C26 | H19 | 108.5° | 76.3° |
| C24 | N5 | C26 | H20 | 10.1° | 43.7° |
| N5 | C24 | C25 | H28 | 180.0° | 60.0° |
| N5 | C24 | C25 | H29 | 60.0° | 60.0° |
| N5 | C24 | C25 | H30 | 60.0° | 180.0° |
| N5 | C26 | C27 | H19 | 120.7° | 120.0° |
| N5 | C26 | C27 | H20 | 120.7° | 120.0° |
| C26 | N5 | C23 | N4 | 82.0° | 149.3° |
| C26 | N5 | C23 | H15 | 157.6° | 90.7° |
| C26 | N5 | C23 | H16 | 38.5° | 29.3° |
| C26 | N5 | C24 | H17 | 1.4° | 173.9° |
| C26 | N5 | C24 | H18 | 119.8° | 54.0° |
| N5 | C26 | H19 | H20 | 117.9° | 119.9° |
| N5 | C26 | C27 | H21 | 180.0° | 175.6° |
| N5 | C26 | C27 | H22 | 60.0° | 55.6° |
| N5 | C26 | C27 | H23 | 60.0° | 64.5° |
| C23 | N5 | C26 | C27 | 97.6° | 72.4° |
| N5 | C23 | N4 | H15 | 120.5° | 120.0° |
| N5 | C23 | N4 | H16 | 120.5° | 120.1° |
| N5 | C23 | N4 | C22 | 172.8° | 74.1° |
| N5 | C23 | H15 | H16 | 118.5° | 120.0° |
| C23 | N5 | C24 | H17 | 132.4° | 50.0° |
| C23 | N5 | C24 | H18 | 109.1° | 69.9° |
| C23 | N5 | C26 | H19 | 23.1° | 47.7° |
| C23 | N5 | C26 | H20 | 141.7° | 167.6° |
| N5 | C23 | N4 | H25 | 66.6° | 161.9° |
| C27 | C26 | H19 | H20 | 117.9° | 120.1° |
| C26 | C27 | H21 | H22 | 120.1° | 120.0° |
| C26 | C27 | H21 | H23 | 120.0° | 120.0° |
| C26 | C27 | H22 | H23 | 120.0° | 120.0° |
| C23 | N4 | C22 | H25 | 120.6° | 124.0° |
| C23 | N4 | C22 | C21 | 100.2° | 174.7° |
| C23 | N4 | C22 | H13 | 20.1° | 65.3° |
| C23 | N4 | C22 | H14 | 139.5° | 54.7° |
| N4 | C23 | H15 | H16 | 118.5° | 120.0° |
| O2 | C21 | C22 | N4 | 8.3° | 0.0° |
| O2 | C21 | C22 | C20 | 179.6° | 180.0° |
| O2 | C21 | C20 | C19 | 46.5° | 5.2° |
| O2 | C21 | C20 | C28 | 133.5° | 174.9° |
| O2 | C21 | C22 | H13 | 112.0° | 120.0° |
| O2 | C21 | C22 | H14 | 128.5° | 120.1° |
| N4 | C22 | C21 | H13 | 120.3° | 120.0° |
| N4 | C22 | C21 | H14 | 120.3° | 120.1° |
| N4 | C22 | C21 | C20 | 171.3° | 180.0° |
| N4 | C22 | H13 | H14 | 119.2° | 120.0° |
| C22 | N4 | C23 | H15 | 52.3° | 165.9° |
| C22 | N4 | C23 | H16 | 66.7° | 46.0° |
| C18 | C17 | C16 | H11 | 180.0° | 179.4° |
| C17 | C18 | C19 | H12 | 180.0° | 180.0° |
| C18 | C17 | C16 | C15 | 0.0° | 0.5° |
| C17 | C18 | C19 | C20 | 179.2° | 180.0° |
| C17 | C18 | C19 | C14 | 0.1° | 0.3° |
| C18 | C17 | C16 | H10 | 180.0° | 179.8° |
| C16 | C17 | C18 | C19 | 0.2° | 0.5° |
| C17 | C16 | C15 | H10 | 180.0° | 179.7° |
| C17 | C16 | C15 | C14 | 0.2° | 0.3° |
| C16 | C17 | C18 | H12 | 179.8° | 179.4° |
| C17 | C16 | C15 | H31 | 179.8° | 180.0° |
| C18 | C19 | C20 | C21 | 1.1° | 0.1° |
| C18 | C19 | C20 | C14 | 179.3° | 179.7° |
| C18 | C19 | C20 | C28 | 179.0° | 180.0° |
| C18 | C19 | C14 | C15 | 0.1° | 0.1° |
| C18 | C19 | C14 | N3 | 179.2° | 180.0° |
| C19 | C18 | C17 | H11 | 179.9° | 180.0° |
| C22 | C21 | C20 | C19 | 133.9° | 174.8° |
| C22 | C21 | C20 | C28 | 46.0° | 5.1° |
| C21 | C22 | H13 | H14 | 119.2° | 120.0° |
| C21 | C22 | N4 | H25 | 139.2° | 61.2° |
| C21 | C20 | C19 | C28 | 180.0° | 179.9° |
| C21 | C20 | C19 | C14 | 179.7° | 179.7° |
| C21 | C20 | C28 | C13 | 180.0° | 180.0° |
| C20 | C21 | C22 | H13 | 68.4° | 60.0° |
| C20 | C21 | C22 | H14 | 51.0° | 60.0° |
| C21 | C20 | C28 | H24 | 0.0° | 0.0° |
| C16 | C15 | C14 | C19 | 0.2° | 0.1° |
| C16 | C15 | C14 | H31 | 180.0° | 179.7° |
| C16 | C15 | C14 | N3 | 179.1° | 180.0° |
| C15 | C16 | C17 | H11 | 180.0° | 180.0° |
| C20 | C19 | C14 | C15 | 179.4° | 179.8° |
| C20 | C19 | C14 | N3 | 0.1° | 0.3° |
| C19 | C20 | C28 | C13 | 0.0° | 0.0° |
| C20 | C19 | C18 | H12 | 0.9° | 0.0° |
| C19 | C20 | C28 | H24 | 180.0° | 180.0° |
| C14 | C19 | C20 | C28 | 0.3° | 0.3° |
| C19 | C14 | C15 | N3 | 179.3° | 179.9° |
| C19 | C14 | N3 | C13 | 0.4° | 0.0° |
| C14 | C19 | C18 | H12 | 179.9° | 179.7° |
| C19 | C14 | C15 | H31 | 179.7° | 179.8° |
| C20 | C28 | C13 | H24 | 180.0° | 180.0° |
| C20 | C28 | C13 | N3 | 0.6° | 0.3° |
| C20 | C28 | C13 | N2 | 177.8° | 180.0° |
| C15 | C14 | N3 | C13 | 178.9° | 180.0° |
| C14 | C15 | C16 | H10 | 179.8° | 180.0° |
| C14 | N3 | C13 | C28 | 0.8° | 0.3° |
| C14 | N3 | C13 | N2 | 177.7° | 180.0° |
| N3 | C14 | C15 | H31 | 0.9° | 0.3° |
| C28 | C13 | N3 | N2 | 178.5° | 179.7° |
| C28 | C13 | N2 | C12 | 3.0° | 180.0° |
| C28 | C13 | N2 | C11 | 136.2° | 80.6° |
| N3 | C13 | N2 | C12 | 178.5° | 0.3° |
| N3 | C13 | N2 | C11 | 42.3° | 99.1° |
| N3 | C13 | C28 | H24 | 179.4° | 179.7° |
| C13 | N2 | C12 | C11 | 148.7° | 112.9° |
| C13 | N2 | C12 | C10 | 144.7° | 137.6° |
| C13 | N2 | C11 | C10 | 145.3° | 137.6° |
| C13 | N2 | C11 | H6 | 29.1° | 23.2° |
| C13 | N2 | C11 | H7 | 98.4° | 108.1° |
| C13 | N2 | C12 | H8 | 99.1° | 108.1° |
| C13 | N2 | C12 | H9 | 28.6° | 23.3° |
| N2 | C13 | C28 | H24 | 2.2° | 0.0° |
| N2 | C12 | C10 | H8 | 116.2° | 114.3° |
| N2 | C12 | C10 | H9 | 116.2° | 114.4° |
| C12 | N2 | C11 | C10 | 3.9° | 24.7° |
| N2 | C12 | C10 | C4 | 123.7° | 90.7° |
| C12 | N2 | C11 | H6 | 120.1° | 89.7° |
| C12 | N2 | C11 | H7 | 112.3° | 139.0° |
| N2 | C12 | H8 | H9 | 130.1° | 131.8° |
| N2 | C12 | C10 | H32 | 108.0° | 138.1° |
| N2 | C11 | C10 | H6 | 116.2° | 114.3° |
| N2 | C11 | C10 | H7 | 116.2° | 114.4° |
| N2 | C11 | C10 | C4 | 121.6° | 90.7° |
| N2 | C11 | H6 | H7 | 130.1° | 131.7° |
| C11 | N2 | C12 | H8 | 112.3° | 139.0° |
| C11 | N2 | C12 | H9 | 120.1° | 89.6° |
| N2 | C11 | C10 | H32 | 108.0° | 138.0° |
| C2 | C1 | O1 | H35 | 119.8° | 120.0° |
| C2 | C1 | O1 | H36 | 119.8° | 120.0° |
| C2 | C1 | O1 | C | 176.9° | 180.0° |
| C1 | C2 | H1 | H2 | 120.0° | 120.0° |
| C1 | C2 | H1 | H3 | 120.0° | 120.0° |
| C1 | C2 | H2 | H3 | 120.0° | 120.0° |
| C2 | C1 | H35 | H36 | 120.5° | 120.1° |
| C12 | C10 | C11 | C4 | 117.9° | 114.4° |
| C12 | C10 | C11 | H32 | 111.7° | 114.3° |
| C12 | C10 | C4 | H32 | 127.8° | 131.6° |
| C12 | C10 | C4 | N | 67.2° | 36.7° |
| C12 | C10 | C4 | C3 | 116.2° | 143.6° |
| C12 | C10 | C11 | H6 | 119.9° | 90.6° |
| C12 | C10 | C11 | H7 | 112.5° | 138.1° |
| C10 | C12 | H8 | H9 | 130.1° | 131.6° |
| C11 | C10 | C4 | H32 | 129.9° | 131.7° |
| C11 | C10 | C4 | N | 35.1° | 60.0° |
| C11 | C10 | C4 | C3 | 141.5° | 119.7° |
| C10 | C11 | H6 | H7 | 130.1° | 131.7° |
| C11 | C10 | C12 | H8 | 112.5° | 138.1° |
| C11 | C10 | C12 | H9 | 119.9° | 90.7° |
| C10 | C4 | N | C3 | 177.3° | 179.7° |
| C10 | C4 | C3 | C | 2.9° | 0.2° |
| C10 | C4 | N | C5 | 176.6° | 180.0° |
| C10 | C4 | C3 | N1 | 176.3° | 179.7° |
| C4 | C10 | C11 | H6 | 122.2° | 155.0° |
| C4 | C10 | C11 | H7 | 5.4° | 23.8° |
| C4 | C10 | C12 | H8 | 7.5° | 23.7° |
| C4 | C10 | C12 | H9 | 120.1° | 154.9° |
| C1 | O1 | C | C3 | 174.4° | 180.0° |
| C1 | O1 | C | O | 4.6° | 0.0° |
| O1 | C1 | C2 | H1 | 180.0° | 60.0° |
| O1 | C1 | C2 | H2 | 60.0° | 60.0° |
| O1 | C1 | C2 | H3 | 60.0° | 180.0° |
| O1 | C1 | H35 | H36 | 120.5° | 120.0° |
| O1 | C | C3 | C4 | 23.7° | 180.0° |
| O1 | C | C3 | O | 179.1° | 180.0° |
| O1 | C | C3 | N1 | 157.2° | 0.0° |
| C | O1 | C1 | H35 | 57.1° | 60.0° |
| C | O1 | C1 | H36 | 63.2° | 60.0° |
| N | C4 | C3 | C | 179.7° | 180.0° |
| N | C4 | C3 | N1 | 0.5° | 0.0° |
| C4 | N | C5 | N1 | 0.5° | 0.5° |
| C4 | N | C5 | C9 | 178.1° | 179.8° |
| N | C4 | C10 | H32 | 165.1° | 168.3° |
| C4 | C3 | C | N1 | 179.1° | 179.9° |
| C4 | C3 | C | O | 155.4° | 0.0° |
| C3 | C4 | N | C5 | 0.7° | 0.3° |
| C4 | C3 | N1 | C5 | 0.2° | 0.3° |
| C4 | C3 | N1 | C6 | 178.5° | 180.0° |
| C3 | C4 | C10 | H32 | 11.6° | 12.0° |
| C | C3 | N1 | C5 | 179.5° | 179.8° |
| C | C3 | N1 | C6 | 0.8° | 0.1° |
| O | C | C3 | N1 | 23.7° | 179.9° |
| N | C5 | N1 | C3 | 0.2° | 0.5° |
| N | C5 | N1 | C9 | 178.8° | 179.8° |
| N | C5 | N1 | C6 | 179.0° | 179.8° |
| N | C5 | C9 | C8 | 178.3° | 179.7° |
| N | C5 | C9 | H5 | 1.7° | 0.2° |
| C3 | N1 | C5 | C6 | 178.8° | 179.7° |
| C3 | N1 | C5 | C9 | 178.6° | 179.8° |
| C3 | N1 | C6 | C7 | 178.1° | 179.7° |
| C3 | N1 | C6 | H34 | 1.9° | 0.0° |
| N1 | C5 | C9 | C8 | 0.2° | 0.0° |
| C5 | N1 | C6 | C7 | 0.4° | 0.1° |
| N1 | C5 | C9 | H5 | 179.8° | 179.9° |
| C5 | N1 | C6 | H34 | 179.5° | 179.7° |
| C9 | C5 | N1 | C6 | 0.2° | 0.0° |
| C5 | C9 | C8 | H5 | 180.0° | 179.9° |
| C5 | C9 | C8 | C7 | 0.5° | 0.0° |
| C5 | C9 | C8 | H33 | 179.5° | 179.9° |
| N1 | C6 | C7 | H34 | 180.0° | 179.7° |
| N1 | C6 | C7 | C8 | 0.2° | 0.0° |
| N1 | C6 | C7 | H4 | 179.8° | 180.0° |
| C9 | C8 | C7 | C6 | 0.3° | 0.0° |
| C9 | C8 | C7 | H33 | 180.0° | 179.9° |
| C9 | C8 | C7 | H4 | 179.7° | 180.0° |
| C6 | C7 | C8 | H4 | 180.0° | 180.0° |
| C6 | C7 | C8 | H33 | 179.7° | 179.9° |
| C7 | C8 | C9 | H5 | 179.5° | 179.9° |
| C8 | C7 | C6 | H34 | 179.8° | 179.7° |
| H1 | C2 | H2 | H3 | 120.0° | 120.0° |
| H1 | C2 | C1 | H35 | 60.1° | 60.0° |
| H1 | C2 | C1 | H36 | 60.2° | 179.9° |
| H2 | C2 | C1 | H35 | 59.9° | 180.0° |
| H2 | C2 | C1 | H36 | 179.8° | 59.9° |
| H3 | C2 | C1 | H35 | 179.8° | 60.1° |
| H3 | C2 | C1 | H36 | 59.9° | 60.0° |
| H4 | C7 | C8 | H33 | 0.3° | 0.0° |
| H4 | C7 | C6 | H34 | 0.2° | 0.3° |
| H5 | C9 | C8 | H33 | 0.5° | 0.1° |
| H6 | C11 | C10 | H32 | 8.2° | 23.8° |
| H7 | C11 | C10 | H32 | 135.8° | 107.5° |
| H8 | C12 | C10 | H32 | 135.7° | 107.6° |
| H9 | C12 | C10 | H32 | 8.1° | 23.6° |
| H10 | C16 | C17 | H11 | 0.0° | 0.3° |
| H10 | C16 | C15 | H31 | 0.2° | 0.3° |
| H11 | C17 | C18 | H12 | 0.2° | 0.0° |
| H13 | C22 | N4 | H25 | 100.5° | 58.7° |
| H14 | C22 | N4 | H25 | 18.9° | 178.7° |
| H15 | C23 | N4 | H25 | 172.9° | 41.9° |
| H16 | C23 | N4 | H25 | 53.9° | 78.0° |
| H17 | C24 | C25 | H28 | 59.2° | 179.9° |
| H17 | C24 | C25 | H29 | 60.8° | 60.0° |
| H17 | C24 | C25 | H30 | 179.2° | 60.0° |
| H18 | C24 | C25 | H28 | 59.2° | 60.0° |
| H18 | C24 | C25 | H29 | 179.2° | 180.0° |
| H18 | C24 | C25 | H30 | 60.8° | 60.0° |
| H19 | C26 | C27 | H21 | 59.3° | 55.6° |
| H19 | C26 | C27 | H22 | 179.4° | 64.4° |
| H19 | C26 | C27 | H23 | 60.7° | 175.5° |
| H20 | C26 | C27 | H21 | 59.4° | 64.5° |
| H20 | C26 | C27 | H22 | 60.7° | 175.5° |
| H20 | C26 | C27 | H23 | 179.3° | 55.5° |
| H21 | C27 | H22 | H23 | 119.9° | 119.9° |
| H28 | C25 | H29 | H30 | 120.0° | 120.0° |
