CKN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C16 | sing | 1.51Å | 1.50Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | N5 | sing | 1.47Å | 1.47Å | |
| C15 | N4 | sing | 1.47Å | 1.47Å | |
| C16 | N5 | sing | 1.35Å | 1.37Å | |
| C16 | O | doub | 1.21Å | 1.22Å | |
| N6 | C21 | sing | 1.35Å | 1.32Å | |
| N5 | C13 | sing | 1.47Å | 1.47Å | |
| C21 | O1 | doub | 1.21Å | 1.24Å | |
| C21 | C20 | sing | 1.51Å | 1.51Å | |
| N4 | C9 | sing | 1.47Å | 1.48Å | |
| N4 | C12 | sing | 1.47Å | 1.47Å | |
| C9 | C8 | sing | 1.53Å | 1.54Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C20 | C1 | sing | 1.53Å | 1.53Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| C7 | C6 | sing | 1.53Å | 1.52Å | |
| C | C1 | sing | 1.53Å | 1.53Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C11 | C6 | sing | 1.53Å | 1.53Å | |
| C6 | N3 | sing | 1.47Å | 1.46Å | |
| N3 | C5 | sing | 1.38Å | 1.35Å | |
| C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C19 | sing | 1.40Å | 1.44Å | Aromatic |
| C5 | C3 | sing | 1.41Å | 1.43Å | Aromatic |
| C5 | N2 | doub | 1.32Å | 1.35Å | Aromatic |
| C3 | N | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | C18 | doub | 1.36Å | 1.35Å | Aromatic |
| N2 | C4 | sing | 1.33Å | 1.34Å | Aromatic |
| N | C18 | sing | 1.35Å | 1.40Å | Aromatic |
| N | N1 | sing | 1.40Å | 1.39Å | Aromatic |
| C4 | N1 | doub | 1.30Å | 1.36Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| N6 | H2 | sing | 0.97Å | 1.00Å | |
| N6 | H3 | sing | 0.97Å | 1.00Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.08Å | 1.08Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C | H24 | sing | 1.09Å | 1.10Å | |
| C | H25 | sing | 1.09Å | 1.10Å | |
| C | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.08Å | 1.08Å | |
| C4 | H28 | sing | 1.08Å | 1.08Å | |
| N3 | H29 | sing | 0.97Å | 1.00Å | |
| C6 | H30 | sing | 1.09Å | 1.10Å | |
| C17 | H32 | sing | 1.09Å | 1.10Å | |
| C17 | H33 | sing | 1.09Å | 1.10Å | |
| C17 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | N5 | 118.3° | 120.0° |
| C17 | C16 | O | 120.9° | 120.0° |
| C16 | C17 | H32 | 109.5° | 109.5° |
| C16 | C17 | H33 | 109.5° | 109.5° |
| C16 | C17 | H34 | 109.5° | 109.5° |
| C15 | C14 | N5 | 110.4° | 108.5° |
| C14 | C15 | N4 | 110.2° | 109.3° |
| C15 | C14 | H17 | 109.3° | 109.6° |
| C15 | C14 | H18 | 109.3° | 109.7° |
| C14 | C15 | H19 | 109.3° | 109.5° |
| C14 | C15 | H20 | 109.3° | 109.5° |
| C14 | N5 | C16 | 124.2° | 120.9° |
| C14 | N5 | C13 | 113.4° | 118.2° |
| N5 | C14 | H17 | 109.2° | 109.7° |
| N5 | C14 | H18 | 109.2° | 109.6° |
| C15 | N4 | C9 | 113.8° | 111.0° |
| C15 | N4 | C12 | 110.1° | 111.2° |
| N4 | C15 | H19 | 109.3° | 109.5° |
| N4 | C15 | H20 | 109.3° | 109.5° |
| N5 | C16 | O | 120.8° | 120.0° |
| C16 | N5 | C13 | 122.2° | 120.9° |
| N6 | C21 | O1 | 122.8° | 120.0° |
| N6 | C21 | C20 | 116.2° | 120.0° |
| C21 | N6 | H2 | 120.0° | 120.1° |
| C21 | N6 | H3 | 120.0° | 120.0° |
| N5 | C13 | C12 | 110.5° | 108.5° |
| N5 | C13 | H15 | 109.2° | 109.6° |
| N5 | C13 | H16 | 109.2° | 109.8° |
| O1 | C21 | C20 | 121.0° | 120.0° |
| C21 | C20 | C1 | 115.2° | 109.5° |
| C21 | C20 | H22 | 108.0° | 109.5° |
| C21 | C20 | H23 | 108.0° | 109.5° |
| C9 | N4 | C12 | 114.8° | 111.0° |
| N4 | C9 | C8 | 115.7° | 109.5° |
| N4 | C9 | C10 | 110.8° | 109.4° |
| N4 | C9 | H8 | 105.9° | 109.5° |
| N4 | C12 | C13 | 111.0° | 109.4° |
| N4 | C12 | H13 | 109.1° | 109.5° |
| N4 | C12 | H14 | 109.1° | 109.5° |
| C8 | C9 | C10 | 112.9° | 109.4° |
| C9 | C8 | C7 | 112.2° | 109.5° |
| C9 | C8 | H6 | 108.8° | 109.4° |
| C9 | C8 | H7 | 108.8° | 109.5° |
| C8 | C9 | H8 | 105.3° | 109.5° |
| C9 | C10 | C11 | 111.6° | 109.5° |
| C10 | C9 | H8 | 105.3° | 109.5° |
| C9 | C10 | H9 | 108.9° | 109.5° |
| C9 | C10 | H10 | 108.9° | 109.5° |
| C20 | C1 | C | 111.2° | 109.5° |
| C20 | C1 | C2 | 112.9° | 109.5° |
| C20 | C1 | H1 | 106.6° | 109.4° |
| C1 | C20 | H22 | 108.0° | 109.5° |
| C1 | C20 | H23 | 108.0° | 109.4° |
| C8 | C7 | C6 | 111.3° | 109.4° |
| C8 | C7 | H4 | 109.0° | 109.4° |
| C8 | C7 | H5 | 109.0° | 109.5° |
| C7 | C8 | H6 | 108.8° | 109.5° |
| C7 | C8 | H7 | 108.8° | 109.5° |
| C13 | C12 | H13 | 109.1° | 109.5° |
| C13 | C12 | H14 | 109.1° | 109.5° |
| C12 | C13 | H15 | 109.2° | 109.7° |
| C12 | C13 | H16 | 109.2° | 109.7° |
| C7 | C6 | C11 | 110.4° | 109.5° |
| C7 | C6 | N3 | 111.3° | 109.5° |
| C6 | C7 | H4 | 109.0° | 109.5° |
| C6 | C7 | H5 | 109.0° | 109.5° |
| C7 | C6 | H30 | 108.0° | 109.5° |
| C | C1 | C2 | 112.3° | 109.5° |
| C | C1 | H1 | 106.6° | 109.5° |
| C1 | C | H24 | 109.5° | 109.5° |
| C1 | C | H25 | 109.4° | 109.5° |
| C1 | C | H26 | 109.4° | 109.4° |
| C10 | C11 | C6 | 111.5° | 109.4° |
| C11 | C10 | H9 | 108.9° | 109.5° |
| C11 | C10 | H10 | 108.9° | 109.4° |
| C10 | C11 | H11 | 108.9° | 109.4° |
| C10 | C11 | H12 | 109.0° | 109.5° |
| C1 | C2 | C3 | 125.4° | 126.6° |
| C1 | C2 | C19 | 127.9° | 126.6° |
| C2 | C1 | H1 | 106.8° | 109.5° |
| C11 | C6 | N3 | 110.3° | 109.5° |
| C6 | C11 | H11 | 109.0° | 109.5° |
| C6 | C11 | H12 | 109.0° | 109.5° |
| C11 | C6 | H30 | 108.0° | 109.5° |
| C6 | N3 | C5 | 126.7° | 120.0° |
| C6 | N3 | H29 | 105.0° | 120.0° |
| N3 | C6 | H30 | 108.8° | 109.5° |
| N3 | C5 | C3 | 120.8° | 120.4° |
| N3 | C5 | N2 | 117.9° | 120.4° |
| C5 | N3 | H29 | 105.0° | 120.0° |
| C3 | C2 | C19 | 106.6° | 106.8° |
| C2 | C3 | C5 | 136.7° | 133.8° |
| C2 | C3 | N | 107.6° | 107.6° |
| C2 | C19 | C18 | 109.0° | 108.0° |
| C2 | C19 | H21 | 125.5° | 126.0° |
| C3 | C5 | N2 | 121.3° | 119.2° |
| C5 | C3 | N | 115.4° | 118.6° |
| C5 | N2 | C4 | 117.7° | 121.6° |
| C3 | N | C18 | 109.6° | 108.5° |
| C3 | N | N1 | 125.0° | 118.3° |
| C19 | C18 | N | 107.2° | 109.1° |
| C18 | C19 | H21 | 125.5° | 126.0° |
| C19 | C18 | H27 | 126.4° | 125.5° |
| N2 | C4 | N1 | 127.7° | 122.3° |
| N2 | C4 | H28 | 116.2° | 118.8° |
| C18 | N | N1 | 125.4° | 133.2° |
| N | C18 | H27 | 126.4° | 125.4° |
| N | N1 | C4 | 112.8° | 120.1° |
| N1 | C4 | H28 | 116.2° | 118.9° |
| H2 | N6 | H3 | 120.0° | 120.0° |
| H4 | C7 | H5 | 109.5° | 109.5° |
| H6 | C8 | H7 | 109.5° | 109.5° |
| H9 | C10 | H10 | 109.5° | 109.5° |
| H11 | C11 | H12 | 109.4° | 109.5° |
| H13 | C12 | H14 | 109.5° | 109.5° |
| H15 | C13 | H16 | 109.5° | 109.6° |
| H17 | C14 | H18 | 109.5° | 109.7° |
| H19 | C15 | H20 | 109.5° | 109.5° |
| H22 | C20 | H23 | 109.5° | 109.5° |
| H24 | C | H25 | 109.5° | 109.5° |
| H24 | C | H26 | 109.5° | 109.4° |
| H25 | C | H26 | 109.5° | 109.5° |
| H32 | C17 | H33 | 109.5° | 109.4° |
| H32 | C17 | H34 | 109.4° | 109.4° |
| H33 | C17 | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | N5 | C14 | 3.6° | 180.0° |
| C17 | C16 | N5 | O | 178.9° | 180.0° |
| C17 | C16 | N5 | C13 | 177.4° | 0.1° |
| C16 | C17 | H32 | H33 | 120.0° | 120.0° |
| C16 | C17 | H32 | H34 | 120.0° | 120.0° |
| C16 | C17 | H33 | H34 | 120.0° | 120.0° |
| C15 | C14 | N5 | H17 | 120.1° | 119.7° |
| C15 | C14 | N5 | H18 | 120.1° | 119.7° |
| C14 | C15 | N4 | H19 | 120.1° | 120.0° |
| C14 | C15 | N4 | H20 | 120.1° | 119.9° |
| C15 | C14 | N5 | C16 | 131.9° | 128.8° |
| C15 | C14 | N5 | C13 | 53.9° | 51.2° |
| C14 | C15 | N4 | C9 | 169.8° | 172.8° |
| C14 | C15 | N4 | C12 | 59.8° | 63.1° |
| C15 | C14 | H17 | H18 | 119.6° | 120.5° |
| C14 | C15 | H19 | H20 | 119.7° | 120.0° |
| N5 | C14 | C15 | N4 | 56.7° | 53.9° |
| C14 | N5 | C16 | C13 | 173.8° | 179.9° |
| C14 | N5 | C16 | O | 177.5° | 0.0° |
| C14 | N5 | C13 | C12 | 52.7° | 51.2° |
| C14 | N5 | C13 | H15 | 67.5° | 170.9° |
| C14 | N5 | C13 | H16 | 172.9° | 68.6° |
| N5 | C14 | H17 | H18 | 119.6° | 120.5° |
| N5 | C14 | C15 | H19 | 63.4° | 66.1° |
| N5 | C14 | C15 | H20 | 176.8° | 173.8° |
| C15 | N4 | C9 | C12 | 128.1° | 124.2° |
| C15 | N4 | C9 | C8 | 80.9° | 180.0° |
| C15 | N4 | C9 | C10 | 149.0° | 60.1° |
| C15 | N4 | C12 | C13 | 58.9° | 63.1° |
| C15 | N4 | C9 | H8 | 35.2° | 59.9° |
| C15 | N4 | C12 | H13 | 61.3° | 176.9° |
| C15 | N4 | C12 | H14 | 179.1° | 56.9° |
| N4 | C15 | C14 | H17 | 63.4° | 65.9° |
| N4 | C15 | C14 | H18 | 176.9° | 173.6° |
| N4 | C15 | H19 | H20 | 119.6° | 120.0° |
| C16 | N5 | C13 | C12 | 132.9° | 128.9° |
| C16 | N5 | C13 | H15 | 106.9° | 9.1° |
| C16 | N5 | C13 | H16 | 12.7° | 111.3° |
| C16 | N5 | C14 | H17 | 108.0° | 111.4° |
| C16 | N5 | C14 | H18 | 11.7° | 9.1° |
| N5 | C16 | C17 | H32 | 178.9° | 60.0° |
| N5 | C16 | C17 | H33 | 61.1° | 180.0° |
| N5 | C16 | C17 | H34 | 58.9° | 60.0° |
| O | C16 | N5 | C13 | 3.7° | 179.9° |
| O | C16 | C17 | H32 | 0.0° | 120.0° |
| O | C16 | C17 | H33 | 120.0° | 0.0° |
| O | C16 | C17 | H34 | 120.0° | 120.1° |
| N6 | C21 | O1 | C20 | 179.1° | 180.0° |
| N6 | C21 | C20 | C1 | 167.2° | 180.0° |
| C21 | N6 | H2 | H3 | 180.0° | 180.0° |
| N6 | C21 | C20 | H22 | 71.9° | 60.0° |
| N6 | C21 | C20 | H23 | 46.4° | 60.0° |
| N5 | C13 | C12 | N4 | 54.6° | 53.8° |
| N5 | C13 | C12 | H15 | 120.2° | 119.7° |
| N5 | C13 | C12 | H16 | 120.2° | 119.9° |
| N5 | C13 | C12 | H13 | 65.7° | 173.8° |
| N5 | C13 | C12 | H14 | 174.8° | 66.2° |
| N5 | C13 | H15 | H16 | 119.5° | 120.6° |
| C13 | N5 | C14 | H17 | 66.3° | 68.5° |
| C13 | N5 | C14 | H18 | 174.0° | 171.0° |
| O1 | C21 | C20 | C1 | 13.6° | 0.0° |
| O1 | C21 | N6 | H2 | 0.0° | 0.0° |
| O1 | C21 | N6 | H3 | 180.0° | 180.0° |
| O1 | C21 | C20 | H22 | 107.2° | 120.0° |
| O1 | C21 | C20 | H23 | 134.4° | 120.0° |
| C21 | C20 | C1 | H22 | 120.8° | 120.0° |
| C21 | C20 | C1 | H23 | 120.8° | 120.0° |
| C21 | C20 | C1 | C | 131.6° | 65.0° |
| C21 | C20 | C1 | C2 | 101.1° | 175.0° |
| C21 | C20 | C1 | H1 | 15.9° | 55.0° |
| C20 | C21 | N6 | H2 | 179.1° | 180.0° |
| C20 | C21 | N6 | H3 | 0.8° | 0.0° |
| C21 | C20 | H22 | H23 | 117.4° | 120.1° |
| N4 | C9 | C8 | C10 | 129.1° | 119.9° |
| N4 | C9 | C8 | H8 | 116.5° | 120.1° |
| N4 | C9 | C10 | H8 | 114.1° | 120.0° |
| N4 | C9 | C8 | C7 | 178.9° | 180.0° |
| C9 | N4 | C12 | C13 | 171.2° | 172.8° |
| N4 | C9 | C10 | C11 | 178.4° | 180.0° |
| N4 | C9 | C8 | H6 | 58.5° | 60.1° |
| N4 | C9 | C8 | H7 | 60.7° | 59.9° |
| N4 | C9 | C10 | H9 | 58.1° | 60.0° |
| N4 | C9 | C10 | H10 | 61.3° | 60.0° |
| C9 | N4 | C12 | H13 | 68.6° | 52.8° |
| C9 | N4 | C12 | H14 | 51.0° | 67.2° |
| C9 | N4 | C15 | H19 | 70.1° | 67.2° |
| C9 | N4 | C15 | H20 | 49.7° | 52.9° |
| C12 | N4 | C9 | C8 | 47.1° | 55.8° |
| C12 | N4 | C9 | C10 | 83.0° | 175.7° |
| N4 | C12 | C13 | H13 | 120.2° | 120.0° |
| N4 | C12 | C13 | H14 | 120.2° | 120.0° |
| C12 | N4 | C9 | H8 | 163.3° | 64.3° |
| N4 | C12 | H13 | H14 | 119.3° | 120.1° |
| N4 | C12 | C13 | H15 | 65.6° | 173.5° |
| N4 | C12 | C13 | H16 | 174.7° | 66.1° |
| C12 | N4 | C15 | H19 | 60.3° | 56.9° |
| C12 | N4 | C15 | H20 | 179.9° | 177.0° |
| C8 | C9 | C10 | H8 | 114.3° | 120.0° |
| C9 | C8 | C7 | H6 | 120.4° | 119.9° |
| C9 | C8 | C7 | H7 | 120.4° | 120.0° |
| C9 | C8 | C7 | C6 | 53.6° | 60.1° |
| C8 | C9 | C10 | C11 | 50.0° | 60.0° |
| C9 | C8 | C7 | H4 | 173.8° | 179.9° |
| C9 | C8 | C7 | H5 | 66.7° | 60.0° |
| C9 | C8 | H6 | H7 | 118.8° | 120.0° |
| C8 | C9 | C10 | H9 | 170.4° | 180.0° |
| C8 | C9 | C10 | H10 | 70.3° | 60.0° |
| C10 | C9 | C8 | C7 | 49.8° | 60.1° |
| C9 | C10 | C11 | H9 | 120.3° | 120.0° |
| C9 | C10 | C11 | H10 | 120.3° | 120.0° |
| C9 | C10 | C11 | C6 | 54.5° | 60.0° |
| C10 | C9 | C8 | H6 | 70.6° | 180.0° |
| C10 | C9 | C8 | H7 | 170.2° | 60.0° |
| C9 | C10 | H9 | H10 | 119.0° | 120.0° |
| C9 | C10 | C11 | H11 | 65.8° | 60.0° |
| C9 | C10 | C11 | H12 | 174.8° | 180.0° |
| C20 | C1 | C | C2 | 127.6° | 120.0° |
| C20 | C1 | C | H1 | 115.7° | 120.0° |
| C20 | C1 | C2 | H1 | 116.8° | 120.0° |
| C20 | C1 | C2 | C3 | 111.5° | 114.5° |
| C20 | C1 | C2 | C19 | 73.3° | 65.8° |
| C1 | C20 | H22 | H23 | 117.4° | 119.9° |
| C20 | C1 | C | H24 | 180.0° | 60.0° |
| C20 | C1 | C | H25 | 60.0° | 180.0° |
| C20 | C1 | C | H26 | 60.0° | 60.0° |
| C8 | C7 | C6 | H4 | 120.3° | 120.0° |
| C8 | C7 | C6 | H5 | 120.3° | 120.0° |
| C8 | C7 | C6 | C11 | 57.8° | 60.1° |
| C8 | C7 | C6 | N3 | 179.4° | 180.0° |
| C8 | C7 | H4 | H5 | 119.1° | 120.0° |
| C7 | C8 | H6 | H7 | 118.7° | 120.1° |
| C7 | C8 | C9 | H8 | 64.6° | 60.0° |
| C8 | C7 | C6 | H30 | 60.0° | 60.0° |
| C13 | C12 | H13 | H14 | 119.3° | 120.1° |
| C12 | C13 | H15 | H16 | 119.5° | 120.4° |
| C7 | C6 | C11 | C10 | 58.5° | 60.0° |
| C7 | C6 | C11 | N3 | 123.4° | 120.0° |
| C7 | C6 | C11 | H30 | 117.9° | 120.0° |
| C7 | C6 | N3 | H30 | 118.9° | 120.0° |
| C7 | C6 | N3 | C5 | 153.6° | 155.0° |
| C6 | C7 | H4 | H5 | 119.2° | 120.0° |
| C6 | C7 | C8 | H6 | 66.9° | 180.0° |
| C6 | C7 | C8 | H7 | 174.0° | 60.0° |
| C7 | C6 | C11 | H11 | 61.8° | 59.9° |
| C7 | C6 | C11 | H12 | 178.8° | 180.0° |
| C7 | C6 | N3 | H29 | 31.3° | 25.0° |
| C | C1 | C2 | H1 | 116.5° | 120.0° |
| C | C1 | C2 | C3 | 121.8° | 125.5° |
| C | C1 | C2 | C19 | 53.4° | 54.2° |
| C | C1 | C20 | H22 | 10.8° | 175.0° |
| C | C1 | C20 | H23 | 107.5° | 55.0° |
| C1 | C | H24 | H25 | 120.0° | 120.0° |
| C1 | C | H24 | H26 | 120.0° | 119.9° |
| C1 | C | H25 | H26 | 120.0° | 120.0° |
| C10 | C11 | C6 | H11 | 120.3° | 119.9° |
| C10 | C11 | C6 | H12 | 120.3° | 120.0° |
| C10 | C11 | C6 | N3 | 178.1° | 180.0° |
| C11 | C10 | C9 | H8 | 64.3° | 60.0° |
| C11 | C10 | H9 | H10 | 119.0° | 120.0° |
| C10 | C11 | H11 | H12 | 119.1° | 120.1° |
| C10 | C11 | C6 | H30 | 59.4° | 60.0° |
| C1 | C2 | C3 | C19 | 176.0° | 179.8° |
| C1 | C2 | C3 | C5 | 9.4° | 0.1° |
| C1 | C2 | C3 | N | 177.0° | 180.0° |
| C1 | C2 | C19 | C18 | 176.1° | 180.0° |
| C1 | C2 | C19 | H21 | 3.9° | 0.0° |
| C2 | C1 | C20 | H22 | 138.1° | 55.0° |
| C2 | C1 | C20 | H23 | 19.8° | 65.0° |
| C2 | C1 | C | H24 | 52.3° | 60.0° |
| C2 | C1 | C | H25 | 172.4° | 60.0° |
| C2 | C1 | C | H26 | 67.6° | 180.0° |
| C11 | C6 | N3 | H30 | 118.2° | 120.0° |
| C11 | C6 | N3 | C5 | 83.6° | 85.0° |
| C11 | C6 | C7 | H4 | 178.1° | 180.0° |
| C11 | C6 | C7 | H5 | 62.4° | 60.0° |
| C6 | C11 | C10 | H9 | 174.8° | 180.0° |
| C6 | C11 | C10 | H10 | 65.8° | 60.0° |
| C6 | C11 | H11 | H12 | 119.1° | 120.0° |
| C11 | C6 | N3 | H29 | 154.1° | 95.0° |
| C6 | N3 | C5 | H29 | 122.3° | 180.0° |
| C6 | N3 | C5 | C3 | 178.8° | 174.3° |
| C6 | N3 | C5 | N2 | 3.4° | 5.7° |
| N3 | C6 | C7 | H4 | 59.1° | 60.0° |
| N3 | C6 | C7 | H5 | 60.3° | 60.0° |
| N3 | C6 | C11 | H11 | 61.6° | 60.0° |
| N3 | C6 | C11 | H12 | 57.8° | 60.0° |
| N3 | C5 | C3 | C2 | 4.4° | 0.0° |
| N3 | C5 | C3 | N2 | 177.7° | 180.0° |
| N3 | C5 | C3 | N | 177.7° | 180.0° |
| N3 | C5 | N2 | C4 | 180.0° | 180.0° |
| C5 | N3 | C6 | H30 | 34.7° | 35.0° |
| C2 | C3 | C5 | N | 173.3° | 180.0° |
| C2 | C3 | C5 | N2 | 177.9° | 180.0° |
| C3 | C2 | C19 | C18 | 0.2° | 0.2° |
| C2 | C3 | N | C18 | 1.3° | 0.2° |
| C2 | C3 | N | N1 | 179.4° | 180.0° |
| C3 | C2 | C1 | H1 | 5.3° | 5.5° |
| C3 | C2 | C19 | H21 | 179.8° | 179.8° |
| C19 | C2 | C3 | C5 | 174.6° | 179.8° |
| C19 | C2 | C3 | N | 0.9° | 0.2° |
| C2 | C19 | C18 | H21 | 180.0° | 180.0° |
| C2 | C19 | C18 | N | 0.6° | 0.1° |
| C19 | C2 | C1 | H1 | 169.9° | 174.2° |
| C2 | C19 | C18 | H27 | 179.5° | 180.0° |
| C3 | C5 | N2 | C4 | 2.3° | 0.0° |
| C5 | C3 | N | C18 | 176.5° | 179.9° |
| C5 | C3 | N | N1 | 4.3° | 0.0° |
| C3 | C5 | N3 | H29 | 58.9° | 5.7° |
| N2 | C5 | C3 | N | 4.6° | 0.0° |
| C5 | N2 | C4 | N1 | 0.8° | 0.1° |
| C5 | N2 | C4 | H28 | 179.2° | 180.0° |
| N2 | C5 | N3 | H29 | 118.9° | 174.3° |
| C3 | N | C18 | C19 | 1.2° | 0.0° |
| C3 | N | C18 | N1 | 179.3° | 179.8° |
| C3 | N | N1 | C4 | 1.5° | 0.0° |
| C3 | N | C18 | H27 | 178.9° | 179.8° |
| C19 | C18 | N | H27 | 180.0° | 179.9° |
| C19 | C18 | N | N1 | 179.6° | 179.9° |
| N2 | C4 | N1 | N | 1.3° | 0.1° |
| N2 | C4 | N1 | H28 | 180.0° | 179.9° |
| C18 | N | N1 | C4 | 179.3° | 179.8° |
| N | C18 | C19 | H21 | 179.4° | 179.9° |
| N1 | N | C18 | H27 | 0.4° | 0.0° |
| N | N1 | C4 | H28 | 178.7° | 180.0° |
| H1 | C1 | C20 | H22 | 105.0° | 65.0° |
| H1 | C1 | C20 | H23 | 136.7° | 175.0° |
| H1 | C1 | C | H24 | 64.3° | 179.9° |
| H1 | C1 | C | H25 | 55.7° | 60.0° |
| H1 | C1 | C | H26 | 175.7° | 60.0° |
| H4 | C7 | C8 | H6 | 53.4° | 60.0° |
| H4 | C7 | C8 | H7 | 65.8° | 60.0° |
| H4 | C7 | C6 | H30 | 60.3° | 60.0° |
| H5 | C7 | C8 | H6 | 172.9° | 59.9° |
| H5 | C7 | C8 | H7 | 53.7° | 180.0° |
| H5 | C7 | C6 | H30 | 179.7° | 180.0° |
| H6 | C8 | C9 | H8 | 175.0° | 60.0° |
| H7 | C8 | C9 | H8 | 55.8° | 180.0° |
| H8 | C9 | C10 | H9 | 56.0° | 60.0° |
| H8 | C9 | C10 | H10 | 175.4° | 180.0° |
| H9 | C10 | C11 | H11 | 54.5° | 60.0° |
| H9 | C10 | C11 | H12 | 64.8° | 60.0° |
| H10 | C10 | C11 | H11 | 173.9° | 180.0° |
| H10 | C10 | C11 | H12 | 54.5° | 60.0° |
| H11 | C11 | C6 | H30 | 179.7° | 180.0° |
| H12 | C11 | C6 | H30 | 61.0° | 60.0° |
| H13 | C12 | C13 | H15 | 174.2° | 66.5° |
| H13 | C12 | C13 | H16 | 54.5° | 53.9° |
| H14 | C12 | C13 | H15 | 54.6° | 53.5° |
| H14 | C12 | C13 | H16 | 65.0° | 173.9° |
| H17 | C14 | C15 | H19 | 176.5° | 174.1° |
| H17 | C14 | C15 | H20 | 56.7° | 54.1° |
| H18 | C14 | C15 | H19 | 56.8° | 53.6° |
| H18 | C14 | C15 | H20 | 63.0° | 66.5° |
| H21 | C19 | C18 | H27 | 0.5° | 0.0° |
| H24 | C | H25 | H26 | 120.0° | 120.0° |
| H29 | N3 | C6 | H30 | 87.6° | 145.0° |
| H32 | C17 | H33 | H34 | 119.9° | 120.0° |
