A1IIM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C18 | N8 | sing | 1.47Å | 1.46Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C3 | C2 | sing | 1.55Å | 1.50Å | |
| C3 | C4 | sing | 1.55Å | 1.50Å | |
| C2 | C1 | sing | 1.54Å | 1.51Å | |
| N8 | C22 | sing | 1.47Å | 1.46Å | |
| N8 | C15 | sing | 1.38Å | 1.36Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| N9 | C21 | sing | 1.47Å | 1.48Å | |
| N9 | C23 | sing | 1.47Å | 1.47Å | |
| C23 | C24 | sing | 1.53Å | 1.49Å | |
| C4 | N1 | sing | 1.48Å | 1.46Å | |
| C24 | C26 | sing | 1.53Å | 1.48Å | |
| C24 | C25 | sing | 1.53Å | 1.49Å | |
| C1 | N1 | sing | 1.47Å | 1.46Å | |
| C16 | C15 | doub | 1.39Å | 1.40Å | |
| C16 | C17 | sing | 1.40Å | 1.40Å | |
| C15 | C14 | sing | 1.41Å | 1.40Å | |
| C26 | C25 | sing | 1.53Å | 1.50Å | |
| N1 | C5 | sing | 1.39Å | 1.35Å | |
| O1 | C17 | doub | 1.22Å | 1.24Å | |
| C17 | N7 | sing | 1.35Å | 1.40Å | |
| C14 | C13 | doub | 1.35Å | 1.35Å | |
| C5 | N3 | doub | 1.33Å | 1.34Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.41Å | Aromatic |
| N3 | C8 | sing | 1.33Å | 1.34Å | Aromatic |
| N7 | C13 | sing | 1.36Å | 1.37Å | |
| N7 | C11 | sing | 1.46Å | 1.47Å | |
| C6 | N2 | doub | 1.32Å | 1.33Å | Aromatic |
| C10 | C9 | doub | 1.37Å | 1.37Å | Aromatic |
| C10 | N4 | sing | 1.35Å | 1.34Å | Aromatic |
| C8 | C9 | sing | 1.48Å | 1.46Å | |
| C8 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | N4 | sing | 1.46Å | 1.45Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C9 | N6 | sing | 1.35Å | 1.36Å | Aromatic |
| N4 | N5 | sing | 1.29Å | 1.37Å | Aromatic |
| N2 | C7 | sing | 1.32Å | 1.33Å | Aromatic |
| N6 | N5 | doub | 1.29Å | 1.32Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.08Å | 1.08Å | |
| C7 | H10 | sing | 1.08Å | 1.08Å | |
| C10 | H11 | sing | 1.08Å | 1.08Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.08Å | 1.08Å | |
| C14 | H17 | sing | 1.08Å | 1.08Å | |
| C16 | H18 | sing | 1.08Å | 1.08Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| N9 | H28 | sing | 1.01Å | 1.00Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C24 | H32 | sing | 1.09Å | 1.10Å | |
| C25 | H33 | sing | 1.09Å | 1.10Å | |
| C25 | H34 | sing | 1.09Å | 1.10Å | |
| C26 | H35 | sing | 1.09Å | 1.10Å | |
| C26 | H36 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C18 | N8 | 107.8° | 108.8° |
| C18 | C19 | C20 | 111.1° | 109.3° |
| C19 | C18 | H19 | 109.9° | 109.6° |
| C19 | C18 | H20 | 109.9° | 109.6° |
| C18 | C19 | H21 | 109.1° | 109.5° |
| C18 | C19 | H22 | 109.1° | 109.5° |
| C18 | N8 | C22 | 111.0° | 118.8° |
| C18 | N8 | C15 | 123.7° | 120.6° |
| N8 | C18 | H19 | 109.9° | 109.6° |
| N8 | C18 | H20 | 109.9° | 109.6° |
| C19 | C20 | C21 | 111.4° | 109.6° |
| C20 | C19 | H21 | 109.0° | 109.5° |
| C20 | C19 | H22 | 109.1° | 109.5° |
| C19 | C20 | H23 | 109.0° | 109.4° |
| C19 | C20 | H24 | 109.0° | 109.5° |
| C20 | C21 | C22 | 111.9° | 109.3° |
| C20 | C21 | N9 | 112.4° | 109.5° |
| C21 | C20 | H23 | 109.0° | 109.4° |
| C21 | C20 | H24 | 109.0° | 109.5° |
| C20 | C21 | H25 | 107.9° | 109.5° |
| C2 | C3 | C4 | 105.0° | 101.7° |
| C3 | C2 | C1 | 105.1° | 103.0° |
| C3 | C2 | H3 | 110.5° | 110.7° |
| C3 | C2 | H4 | 110.5° | 110.9° |
| C2 | C3 | H5 | 110.6° | 111.0° |
| C2 | C3 | H6 | 110.6° | 111.0° |
| C3 | C4 | N1 | 103.5° | 104.8° |
| C4 | C3 | H5 | 110.6° | 111.0° |
| C4 | C3 | H6 | 110.6° | 111.0° |
| C3 | C4 | H7 | 110.9° | 110.4° |
| C3 | C4 | H8 | 111.0° | 110.4° |
| C2 | C1 | N1 | 103.2° | 107.2° |
| C2 | C1 | H1 | 111.0° | 109.9° |
| C2 | C1 | H2 | 111.0° | 110.0° |
| C1 | C2 | H3 | 110.5° | 110.7° |
| C1 | C2 | H4 | 110.6° | 110.7° |
| C22 | N8 | C15 | 124.3° | 120.6° |
| N8 | C22 | C21 | 110.2° | 108.8° |
| N8 | C22 | H26 | 109.3° | 109.6° |
| N8 | C22 | H27 | 109.3° | 109.6° |
| N8 | C15 | C16 | 117.9° | 120.5° |
| N8 | C15 | C14 | 122.5° | 120.5° |
| C22 | C21 | N9 | 108.2° | 109.5° |
| C22 | C21 | H25 | 107.7° | 109.5° |
| C21 | C22 | H26 | 109.3° | 109.4° |
| C21 | C22 | H27 | 109.3° | 109.8° |
| C21 | N9 | C23 | 113.3° | 111.0° |
| N9 | C21 | H25 | 108.5° | 109.5° |
| C21 | N9 | H28 | 108.5° | 111.0° |
| N9 | C23 | C24 | 108.9° | 109.5° |
| C23 | N9 | H28 | 108.5° | 111.0° |
| N9 | C23 | H30 | 109.6° | 109.5° |
| N9 | C23 | H31 | 109.6° | 109.5° |
| C23 | C24 | C26 | 120.2° | 117.5° |
| C23 | C24 | C25 | 118.0° | 117.5° |
| C24 | C23 | H30 | 109.6° | 109.4° |
| C24 | C23 | H31 | 109.6° | 109.5° |
| C23 | C24 | H32 | 115.5° | 115.5° |
| C4 | N1 | C1 | 112.8° | 108.5° |
| C4 | N1 | C5 | 124.3° | 111.0° |
| N1 | C4 | H7 | 110.9° | 110.4° |
| N1 | C4 | H8 | 110.9° | 110.3° |
| C26 | C24 | C25 | 60.6° | 60.0° |
| C24 | C26 | C25 | 59.8° | 60.0° |
| C26 | C24 | H32 | 115.7° | 117.5° |
| C24 | C26 | H35 | 120.0° | 117.5° |
| C24 | C26 | H36 | 120.0° | 117.4° |
| C24 | C25 | C26 | 59.6° | 60.0° |
| C25 | C24 | H32 | 115.7° | 117.5° |
| C24 | C25 | H33 | 120.1° | 117.5° |
| C24 | C25 | H34 | 120.1° | 117.5° |
| C1 | N1 | C5 | 122.9° | 111.0° |
| N1 | C1 | H1 | 111.0° | 109.9° |
| N1 | C1 | H2 | 111.0° | 109.9° |
| C15 | C16 | C17 | 120.8° | 119.1° |
| C16 | C15 | C14 | 119.2° | 118.9° |
| C15 | C16 | H18 | 119.6° | 120.4° |
| C16 | C17 | O1 | 122.9° | 119.9° |
| C16 | C17 | N7 | 117.3° | 120.2° |
| C17 | C16 | H18 | 119.6° | 120.5° |
| C15 | C14 | C13 | 120.0° | 119.8° |
| C15 | C14 | H17 | 120.0° | 120.1° |
| C26 | C25 | H33 | 120.1° | 117.5° |
| C26 | C25 | H34 | 120.1° | 117.5° |
| C25 | C26 | H35 | 120.1° | 117.5° |
| C25 | C26 | H36 | 120.0° | 117.5° |
| N1 | C5 | N3 | 118.5° | 120.0° |
| N1 | C5 | C6 | 121.1° | 120.0° |
| O1 | C17 | N7 | 119.7° | 119.9° |
| C17 | N7 | C13 | 121.6° | 121.1° |
| C17 | N7 | C11 | 118.4° | 119.4° |
| C14 | C13 | N7 | 121.0° | 120.9° |
| C14 | C13 | H16 | 119.5° | 119.6° |
| C13 | C14 | H17 | 120.0° | 120.1° |
| N3 | C5 | C6 | 120.3° | 120.0° |
| C5 | N3 | C8 | 117.1° | 119.8° |
| C5 | C6 | N2 | 122.2° | 120.1° |
| C5 | C6 | H9 | 118.9° | 120.0° |
| N3 | C8 | C9 | 117.0° | 120.0° |
| N3 | C8 | C7 | 121.8° | 119.9° |
| C13 | N7 | C11 | 119.7° | 119.4° |
| N7 | C13 | H16 | 119.5° | 119.6° |
| N7 | C11 | N4 | 113.4° | 109.5° |
| N7 | C11 | C12 | 110.2° | 109.5° |
| N7 | C11 | H12 | 107.3° | 109.5° |
| C6 | N2 | C7 | 117.1° | 120.2° |
| N2 | C6 | H9 | 118.9° | 119.9° |
| C9 | C10 | N4 | 104.6° | 106.0° |
| C10 | C9 | C8 | 128.7° | 126.9° |
| C10 | C9 | N6 | 109.0° | 106.2° |
| C9 | C10 | H11 | 127.7° | 127.0° |
| C10 | N4 | C11 | 127.4° | 125.7° |
| C10 | N4 | N5 | 111.2° | 108.6° |
| N4 | C10 | H11 | 127.7° | 127.0° |
| C9 | C8 | C7 | 121.2° | 120.1° |
| C8 | C9 | N6 | 122.3° | 126.9° |
| C8 | C7 | N2 | 121.4° | 120.1° |
| C8 | C7 | H10 | 119.3° | 120.0° |
| N4 | C11 | C12 | 111.5° | 109.5° |
| C11 | N4 | N5 | 121.2° | 125.7° |
| N4 | C11 | H12 | 107.5° | 109.5° |
| C12 | C11 | H12 | 106.6° | 109.4° |
| C11 | C12 | H13 | 109.5° | 109.5° |
| C11 | C12 | H14 | 109.5° | 109.5° |
| C11 | C12 | H15 | 109.5° | 109.5° |
| C9 | N6 | N5 | 108.9° | 108.7° |
| N4 | N5 | N6 | 106.1° | 110.5° |
| N2 | C7 | H10 | 119.3° | 120.0° |
| H1 | C1 | H2 | 109.5° | 109.9° |
| H3 | C2 | H4 | 109.5° | 110.6° |
| H5 | C3 | H6 | 109.5° | 110.9° |
| H7 | C4 | H8 | 109.5° | 110.4° |
| H13 | C12 | H14 | 109.5° | 109.5° |
| H13 | C12 | H15 | 109.4° | 109.5° |
| H14 | C12 | H15 | 109.5° | 109.4° |
| H19 | C18 | H20 | 109.5° | 109.7° |
| H21 | C19 | H22 | 109.5° | 109.6° |
| H23 | C20 | H24 | 109.4° | 109.5° |
| H26 | C22 | H27 | 109.5° | 109.8° |
| H30 | C23 | H31 | 109.5° | 109.5° |
| H33 | C25 | H34 | 109.5° | 115.6° |
| H35 | C26 | H36 | 109.4° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C18 | N8 | H19 | 119.7° | 119.8° |
| C19 | C18 | N8 | H20 | 119.7° | 119.8° |
| C18 | C19 | C20 | H21 | 120.2° | 119.9° |
| C18 | C19 | C20 | H22 | 120.2° | 119.9° |
| C18 | C19 | C20 | C21 | 51.7° | 61.4° |
| C19 | C18 | N8 | C22 | 66.4° | 53.6° |
| C19 | C18 | N8 | C15 | 102.9° | 126.6° |
| C19 | C18 | H19 | H20 | 120.7° | 120.4° |
| C18 | C19 | H21 | H22 | 119.3° | 120.1° |
| C18 | C19 | C20 | H23 | 172.0° | 178.6° |
| C18 | C19 | C20 | H24 | 68.7° | 58.7° |
| N8 | C18 | C19 | C20 | 60.4° | 54.6° |
| C18 | N8 | C22 | C15 | 169.2° | 179.7° |
| C18 | N8 | C22 | C21 | 62.2° | 53.6° |
| C18 | N8 | C15 | C16 | 6.6° | 172.8° |
| C18 | N8 | C15 | C14 | 167.1° | 7.1° |
| N8 | C18 | H19 | H20 | 120.8° | 120.3° |
| N8 | C18 | C19 | H21 | 59.8° | 65.3° |
| N8 | C18 | C19 | H22 | 179.4° | 174.6° |
| C18 | N8 | C22 | H26 | 57.9° | 65.9° |
| C18 | N8 | C22 | H27 | 177.7° | 173.6° |
| C19 | C20 | C21 | H23 | 120.3° | 120.0° |
| C19 | C20 | C21 | H24 | 120.3° | 120.1° |
| C19 | C20 | C21 | C22 | 46.8° | 61.4° |
| C19 | C20 | C21 | N9 | 168.8° | 178.6° |
| C20 | C19 | C18 | H19 | 59.4° | 174.4° |
| C20 | C19 | C18 | H20 | 179.8° | 65.2° |
| C20 | C19 | H21 | H22 | 119.3° | 120.1° |
| C19 | C20 | H23 | H24 | 119.1° | 120.0° |
| C19 | C20 | C21 | H25 | 71.6° | 58.5° |
| C20 | C21 | C22 | N8 | 51.5° | 54.6° |
| C20 | C21 | C22 | N9 | 124.4° | 120.0° |
| C20 | C21 | C22 | H25 | 118.5° | 119.9° |
| C20 | C21 | N9 | H25 | 119.2° | 120.1° |
| C20 | C21 | N9 | C23 | 60.6° | 85.0° |
| C21 | C20 | C19 | H21 | 68.6° | 58.5° |
| C21 | C20 | C19 | H22 | 171.9° | 178.7° |
| C21 | C20 | H23 | H24 | 119.1° | 120.0° |
| C20 | C21 | C22 | H26 | 68.6° | 65.0° |
| C20 | C21 | C22 | H27 | 171.7° | 174.5° |
| C20 | C21 | N9 | H28 | 59.9° | 38.9° |
| C2 | C3 | C4 | H5 | 119.3° | 118.1° |
| C2 | C3 | C4 | H6 | 119.3° | 118.1° |
| C3 | C2 | C1 | H3 | 119.3° | 118.4° |
| C3 | C2 | C1 | H4 | 119.3° | 118.6° |
| C2 | C3 | C4 | N1 | 26.4° | 37.1° |
| C3 | C2 | C1 | N1 | 26.0° | 22.3° |
| C3 | C2 | C1 | H1 | 145.0° | 97.1° |
| C3 | C2 | C1 | H2 | 92.9° | 141.8° |
| C3 | C2 | H3 | H4 | 122.0° | 123.3° |
| C2 | C3 | H5 | H6 | 122.1° | 123.9° |
| C2 | C3 | C4 | H7 | 145.5° | 81.8° |
| C2 | C3 | C4 | H8 | 92.6° | 155.9° |
| C4 | C3 | C2 | C1 | 33.2° | 35.7° |
| C3 | C4 | N1 | H7 | 119.1° | 118.9° |
| C3 | C4 | N1 | H8 | 119.1° | 118.9° |
| C3 | C4 | N1 | C1 | 10.4° | 24.1° |
| C3 | C4 | N1 | C5 | 170.1° | 146.4° |
| C4 | C3 | C2 | H3 | 86.1° | 82.7° |
| C4 | C3 | C2 | H4 | 152.5° | 154.1° |
| C4 | C3 | H5 | H6 | 122.1° | 123.9° |
| C3 | C4 | H7 | H8 | 122.8° | 122.4° |
| C2 | C1 | N1 | C4 | 9.8° | 1.0° |
| C2 | C1 | N1 | H1 | 119.0° | 119.4° |
| C2 | C1 | N1 | H2 | 119.0° | 119.6° |
| C2 | C1 | N1 | C5 | 169.7° | 123.2° |
| C2 | C1 | H1 | H2 | 122.9° | 121.2° |
| C1 | C2 | H3 | H4 | 122.0° | 123.1° |
| C1 | C2 | C3 | H5 | 86.1° | 153.8° |
| C1 | C2 | C3 | H6 | 152.5° | 82.4° |
| N8 | C22 | C21 | H26 | 120.1° | 119.6° |
| N8 | C22 | C21 | H27 | 120.1° | 119.9° |
| N8 | C22 | C21 | N9 | 175.9° | 174.6° |
| C22 | N8 | C15 | C16 | 174.5° | 6.9° |
| C22 | N8 | C15 | C14 | 0.8° | 173.1° |
| C22 | N8 | C18 | H19 | 53.3° | 173.4° |
| C22 | N8 | C18 | H20 | 173.8° | 66.2° |
| N8 | C22 | C21 | H25 | 66.9° | 65.3° |
| N8 | C22 | H26 | H27 | 119.7° | 120.3° |
| C15 | N8 | C22 | C21 | 107.0° | 126.6° |
| N8 | C15 | C16 | C14 | 173.9° | 179.9° |
| N8 | C15 | C16 | C17 | 175.7° | 179.8° |
| N8 | C15 | C14 | C13 | 175.4° | 180.0° |
| N8 | C15 | C14 | H17 | 4.6° | 0.0° |
| N8 | C15 | C16 | H18 | 4.3° | 0.1° |
| C15 | N8 | C18 | H19 | 137.4° | 6.8° |
| C15 | N8 | C18 | H20 | 16.9° | 113.6° |
| C15 | N8 | C22 | H26 | 132.8° | 113.8° |
| C15 | N8 | C22 | H27 | 13.1° | 6.6° |
| C22 | C21 | N9 | H25 | 116.6° | 120.1° |
| C22 | C21 | N9 | C23 | 175.2° | 155.2° |
| C22 | C21 | C20 | H23 | 167.1° | 178.6° |
| C22 | C21 | C20 | H24 | 73.5° | 58.7° |
| C21 | C22 | H26 | H27 | 119.6° | 120.5° |
| C22 | C21 | N9 | H28 | 64.2° | 80.9° |
| C21 | N9 | C23 | H28 | 120.5° | 123.9° |
| C21 | N9 | C23 | C24 | 167.9° | 180.0° |
| N9 | C21 | C20 | H23 | 70.8° | 58.6° |
| N9 | C21 | C20 | H24 | 48.6° | 61.3° |
| N9 | C21 | C22 | H26 | 55.8° | 55.0° |
| N9 | C21 | C22 | H27 | 63.9° | 65.5° |
| C21 | N9 | C23 | H30 | 48.0° | 60.0° |
| C21 | N9 | C23 | H31 | 72.1° | 60.0° |
| N9 | C23 | C24 | H30 | 119.9° | 120.0° |
| N9 | C23 | C24 | H31 | 119.9° | 120.0° |
| N9 | C23 | C24 | C26 | 156.1° | 175.0° |
| N9 | C23 | C24 | C25 | 85.6° | 116.3° |
| C23 | N9 | C21 | H25 | 58.6° | 35.1° |
| N9 | C23 | H30 | H31 | 120.3° | 120.0° |
| N9 | C23 | C24 | H32 | 57.3° | 29.3° |
| C23 | C24 | C26 | C25 | 107.2° | 107.5° |
| C23 | C24 | C26 | H32 | 146.5° | 145.0° |
| C23 | C24 | C25 | H32 | 142.9° | 145.0° |
| C24 | C23 | N9 | H28 | 71.5° | 56.0° |
| C24 | C23 | H30 | H31 | 120.2° | 120.0° |
| C23 | C24 | C25 | H33 | 139.9° | 145.0° |
| C23 | C24 | C25 | H34 | 1.4° | 0.0° |
| C23 | C24 | C26 | H35 | 2.2° | 0.0° |
| C23 | C24 | C26 | H36 | 143.4° | 145.1° |
| C4 | N1 | C1 | C5 | 179.5° | 122.2° |
| C4 | N1 | C5 | N3 | 0.6° | 83.9° |
| C4 | N1 | C5 | C6 | 178.4° | 96.3° |
| C4 | N1 | C1 | H1 | 128.8° | 120.4° |
| C4 | N1 | C1 | H2 | 109.2° | 118.6° |
| N1 | C4 | C3 | H5 | 92.8° | 155.2° |
| N1 | C4 | C3 | H6 | 145.7° | 81.0° |
| N1 | C4 | H7 | H8 | 122.7° | 122.2° |
| C26 | C24 | C25 | H32 | 106.4° | 107.5° |
| C24 | C26 | C25 | H35 | 109.4° | 107.5° |
| C24 | C26 | C25 | H36 | 109.4° | 107.5° |
| C26 | C24 | C23 | H30 | 36.2° | 65.0° |
| C26 | C24 | C23 | H31 | 83.9° | 55.0° |
| C26 | C24 | C25 | H33 | 109.4° | 107.5° |
| C26 | C24 | C25 | H34 | 109.4° | 107.5° |
| C24 | C26 | H35 | H36 | 144.8° | 145.7° |
| C25 | C24 | C23 | H30 | 34.3° | 3.6° |
| C25 | C24 | C23 | H31 | 154.4° | 123.6° |
| C24 | C25 | H33 | H34 | 144.9° | 145.7° |
| C1 | N1 | C5 | N3 | 180.0° | 36.9° |
| C1 | N1 | C5 | C6 | 1.0° | 142.9° |
| N1 | C1 | H1 | H2 | 122.9° | 121.0° |
| N1 | C1 | C2 | H3 | 93.3° | 96.1° |
| N1 | C1 | C2 | H4 | 145.3° | 140.8° |
| C1 | N1 | C4 | H7 | 129.5° | 94.8° |
| C1 | N1 | C4 | H8 | 108.6° | 143.0° |
| C15 | C16 | C17 | H18 | 180.0° | 179.9° |
| C15 | C16 | C17 | O1 | 176.3° | 180.0° |
| C15 | C16 | C17 | N7 | 0.4° | 0.4° |
| C16 | C15 | C14 | C13 | 1.8° | 0.1° |
| C16 | C15 | C14 | H17 | 178.2° | 180.0° |
| C17 | C16 | C15 | C14 | 1.8° | 0.1° |
| C16 | C17 | O1 | N7 | 175.7° | 179.6° |
| C16 | C17 | N7 | C13 | 2.7° | 0.5° |
| C16 | C17 | N7 | C11 | 176.2° | 179.8° |
| C15 | C14 | C13 | H17 | 180.0° | 180.0° |
| C15 | C14 | C13 | N7 | 0.4° | 0.0° |
| C15 | C14 | C13 | H16 | 179.6° | 180.0° |
| C14 | C15 | C16 | H18 | 178.2° | 180.0° |
| C26 | C25 | H33 | H34 | 144.9° | 145.7° |
| C25 | C26 | H35 | H36 | 144.8° | 145.7° |
| N1 | C5 | N3 | C6 | 179.0° | 179.7° |
| N1 | C5 | N3 | C8 | 178.7° | 179.8° |
| N1 | C5 | C6 | N2 | 177.8° | 180.0° |
| C5 | N1 | C1 | H1 | 50.7° | 117.3° |
| C5 | N1 | C1 | H2 | 71.3° | 3.6° |
| C5 | N1 | C4 | H7 | 51.1° | 27.5° |
| C5 | N1 | C4 | H8 | 70.8° | 94.8° |
| N1 | C5 | C6 | H9 | 2.2° | 0.0° |
| O1 | C17 | N7 | C13 | 178.7° | 180.0° |
| O1 | C17 | N7 | C11 | 7.9° | 0.2° |
| O1 | C17 | C16 | H18 | 3.7° | 0.1° |
| C17 | N7 | C13 | C14 | 2.8° | 0.3° |
| C17 | N7 | C13 | C11 | 173.4° | 179.7° |
| C17 | N7 | C11 | N4 | 110.8° | 59.7° |
| C17 | N7 | C11 | C12 | 123.4° | 60.3° |
| C17 | N7 | C11 | H12 | 7.8° | 179.8° |
| C17 | N7 | C13 | H16 | 177.2° | 179.8° |
| N7 | C17 | C16 | H18 | 179.6° | 179.7° |
| C14 | C13 | N7 | H16 | 180.0° | 180.0° |
| C14 | C13 | N7 | C11 | 176.2° | 180.0° |
| N3 | C5 | C6 | N2 | 3.2° | 0.3° |
| C5 | N3 | C8 | C9 | 177.8° | 179.7° |
| C5 | N3 | C8 | C7 | 1.1° | 0.5° |
| N3 | C5 | C6 | H9 | 176.8° | 179.7° |
| C6 | C5 | N3 | C8 | 2.3° | 0.5° |
| C5 | C6 | N2 | H9 | 180.0° | 180.0° |
| C5 | C6 | N2 | C7 | 2.6° | 0.0° |
| N3 | C8 | C9 | C10 | 2.2° | 0.4° |
| N3 | C8 | C9 | C7 | 179.0° | 179.8° |
| N3 | C8 | C9 | N6 | 176.7° | 179.8° |
| N3 | C8 | C7 | N2 | 0.6° | 0.2° |
| N3 | C8 | C7 | H10 | 179.4° | 179.9° |
| C13 | N7 | C11 | N4 | 75.6° | 120.0° |
| C13 | N7 | C11 | C12 | 50.1° | 120.0° |
| C13 | N7 | C11 | H12 | 165.8° | 0.0° |
| N7 | C13 | C14 | H17 | 179.5° | 180.0° |
| N7 | C11 | N4 | C10 | 61.6° | 155.0° |
| N7 | C11 | N4 | C12 | 125.1° | 120.0° |
| N7 | C11 | N4 | H12 | 118.4° | 120.0° |
| N7 | C11 | C12 | H12 | 116.1° | 120.0° |
| N7 | C11 | N4 | N5 | 123.7° | 25.0° |
| N7 | C11 | C12 | H13 | 180.0° | 180.0° |
| N7 | C11 | C12 | H14 | 60.0° | 60.0° |
| N7 | C11 | C12 | H15 | 60.0° | 60.0° |
| C11 | N7 | C13 | H16 | 3.9° | 0.0° |
| C6 | N2 | C7 | C8 | 1.4° | 0.0° |
| C6 | N2 | C7 | H10 | 178.7° | 179.9° |
| C9 | C10 | N4 | H11 | 180.0° | 180.0° |
| C10 | C9 | C8 | N6 | 178.9° | 179.8° |
| C10 | C9 | C8 | C7 | 178.8° | 179.7° |
| C9 | C10 | N4 | C11 | 178.2° | 180.0° |
| C9 | C10 | N4 | N5 | 3.0° | 0.0° |
| C10 | C9 | N6 | N5 | 0.4° | 0.4° |
| N4 | C10 | C9 | C8 | 179.4° | 180.0° |
| C10 | N4 | C11 | N5 | 174.7° | 180.0° |
| C10 | N4 | C11 | C12 | 173.4° | 85.0° |
| N4 | C10 | C9 | N6 | 1.6° | 0.2° |
| C10 | N4 | N5 | N6 | 3.3° | 0.3° |
| C10 | N4 | C11 | H12 | 56.9° | 35.0° |
| C9 | C8 | C7 | N2 | 178.3° | 179.9° |
| C8 | C9 | N6 | N5 | 178.7° | 179.8° |
| C9 | C8 | C7 | H10 | 1.7° | 0.0° |
| C8 | C9 | C10 | H11 | 0.6° | 0.0° |
| C7 | C8 | C9 | N6 | 2.3° | 0.0° |
| C8 | C7 | N2 | H10 | 180.0° | 179.9° |
| N4 | C11 | C12 | H12 | 117.1° | 120.0° |
| C11 | N4 | N5 | N6 | 178.8° | 179.7° |
| C11 | N4 | C10 | H11 | 1.8° | 0.0° |
| N4 | C11 | C12 | H13 | 53.2° | 60.0° |
| N4 | C11 | C12 | H14 | 173.2° | 180.0° |
| N4 | C11 | C12 | H15 | 66.8° | 60.0° |
| C12 | C11 | N4 | N5 | 1.3° | 95.0° |
| C11 | C12 | H13 | H14 | 120.0° | 120.0° |
| C11 | C12 | H13 | H15 | 120.0° | 120.0° |
| C11 | C12 | H14 | H15 | 120.0° | 120.0° |
| C9 | N6 | N5 | N4 | 2.2° | 0.4° |
| N6 | C9 | C10 | H11 | 178.4° | 179.8° |
| N5 | N4 | C10 | H11 | 177.0° | 180.0° |
| N5 | N4 | C11 | H12 | 117.8° | 145.0° |
| C7 | N2 | C6 | H9 | 177.4° | 180.0° |
| H1 | C1 | C2 | H3 | 25.7° | 144.5° |
| H1 | C1 | C2 | H4 | 95.7° | 21.4° |
| H2 | C1 | C2 | H3 | 147.8° | 23.4° |
| H2 | C1 | C2 | H4 | 26.4° | 99.7° |
| H3 | C2 | C3 | H5 | 154.6° | 35.4° |
| H3 | C2 | C3 | H6 | 33.2° | 159.2° |
| H4 | C2 | C3 | H5 | 33.2° | 87.8° |
| H4 | C2 | C3 | H6 | 88.2° | 36.0° |
| H5 | C3 | C4 | H7 | 26.2° | 36.3° |
| H5 | C3 | C4 | H8 | 148.1° | 86.0° |
| H6 | C3 | C4 | H7 | 95.2° | 160.1° |
| H6 | C3 | C4 | H8 | 26.7° | 37.8° |
| H12 | C11 | C12 | H13 | 63.9° | 60.0° |
| H12 | C11 | C12 | H14 | 56.1° | 60.0° |
| H12 | C11 | C12 | H15 | 176.1° | 180.0° |
| H13 | C12 | H14 | H15 | 120.0° | 120.0° |
| H16 | C13 | C14 | H17 | 0.4° | 0.0° |
| H19 | C18 | C19 | H21 | 179.6° | 54.5° |
| H19 | C18 | C19 | H22 | 60.9° | 65.6° |
| H20 | C18 | C19 | H21 | 59.9° | 174.9° |
| H20 | C18 | C19 | H22 | 59.6° | 54.8° |
| H21 | C19 | C20 | H23 | 51.7° | 61.5° |
| H21 | C19 | C20 | H24 | 171.1° | 178.6° |
| H22 | C19 | C20 | H23 | 67.8° | 58.7° |
| H22 | C19 | C20 | H24 | 51.6° | 61.3° |
| H23 | C20 | C21 | H25 | 48.8° | 61.5° |
| H24 | C20 | C21 | H25 | 168.2° | 178.6° |
| H25 | C21 | C22 | H26 | 173.0° | 175.1° |
| H25 | C21 | C22 | H27 | 53.2° | 54.6° |
| H25 | C21 | N9 | H28 | 179.2° | 159.0° |
| H28 | N9 | C23 | H30 | 168.6° | 176.0° |
| H28 | N9 | C23 | H31 | 48.4° | 64.0° |
| H30 | C23 | C24 | H32 | 177.3° | 149.3° |
| H31 | C23 | C24 | H32 | 62.6° | 90.7° |
| H32 | C24 | C25 | H33 | 3.0° | 0.0° |
| H32 | C24 | C25 | H34 | 144.3° | 145.0° |
| H32 | C24 | C26 | H35 | 144.3° | 145.1° |
| H32 | C24 | C26 | H36 | 3.1° | 0.0° |
| H33 | C25 | C26 | H35 | 141.2° | 145.0° |
| H33 | C25 | C26 | H36 | 0.1° | 0.0° |
| H34 | C25 | C26 | H35 | 0.0° | 0.1° |
| H34 | C25 | C26 | H36 | 141.2° | 145.1° |
