6TL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C31 | C32 | sing | 1.55Å | 1.33Å | |
| C31 | C30 | sing | 1.55Å | 1.50Å | |
| C32 | C33 | sing | 1.54Å | 1.49Å | |
| C30 | N6 | sing | 1.49Å | 1.46Å | |
| N6 | C33 | sing | 1.48Å | 1.46Å | |
| N6 | C29 | sing | 1.47Å | 1.46Å | |
| C29 | C28 | sing | 1.53Å | 1.52Å | |
| C28 | C27 | sing | 1.53Å | 1.50Å | |
| C27 | N5 | sing | 1.46Å | 1.45Å | |
| N1 | C8 | sing | 1.37Å | 1.37Å | Aromatic |
| N1 | C4 | sing | 1.38Å | 1.37Å | Aromatic |
| C8 | C7 | doub | 1.34Å | 1.36Å | Aromatic |
| N5 | C26 | sing | 1.35Å | 1.34Å | |
| O | C26 | doub | 1.22Å | 1.24Å | |
| C26 | C23 | sing | 1.48Å | 1.50Å | |
| C4 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.41Å | 1.41Å | Aromatic |
| C7 | C9 | sing | 1.51Å | 1.51Å | |
| C7 | C5 | sing | 1.46Å | 1.44Å | Aromatic |
| C9 | C10 | sing | 1.53Å | 1.52Å | |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| C12 | N3 | sing | 1.47Å | 1.47Å | |
| C3 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | doub | 1.40Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.40Å | 1.40Å | Aromatic |
| C23 | C24 | sing | 1.40Å | 1.39Å | Aromatic |
| C11 | N2 | sing | 1.47Å | 1.48Å | |
| C5 | C6 | doub | 1.40Å | 1.40Å | Aromatic |
| N2 | C10 | sing | 1.47Å | 1.48Å | |
| N2 | C14 | sing | 1.47Å | 1.46Å | |
| C21 | C20 | sing | 1.48Å | 1.49Å | |
| C21 | C25 | doub | 1.40Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | N4 | doub | 1.32Å | 1.34Å | Aromatic |
| C20 | C15 | sing | 1.40Å | 1.42Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| N3 | C15 | sing | 1.39Å | 1.48Å | |
| N3 | C13 | sing | 1.47Å | 1.47Å | |
| C15 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C2 | C1 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C1 | sing | 1.37Å | 1.39Å | Aromatic |
| C25 | N4 | sing | 1.32Å | 1.34Å | Aromatic |
| C13 | C14 | sing | 1.53Å | 1.50Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C22 | H20 | sing | 1.08Å | 1.08Å | |
| C24 | H21 | sing | 1.08Å | 1.08Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| C31 | H26 | sing | 1.09Å | 1.10Å | |
| C31 | H27 | sing | 1.09Å | 1.10Å | |
| C32 | H28 | sing | 1.09Å | 1.10Å | |
| C32 | H29 | sing | 1.09Å | 1.10Å | |
| C33 | H30 | sing | 1.09Å | 1.10Å | |
| C33 | H31 | sing | 1.09Å | 1.10Å | |
| N5 | H32 | sing | 0.97Å | 1.00Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C28 | H34 | sing | 1.09Å | 1.10Å | |
| C29 | H35 | sing | 1.09Å | 1.10Å | |
| C29 | H36 | sing | 1.09Å | 1.10Å | |
| C25 | H37 | sing | 1.08Å | 1.08Å | |
| C18 | H38 | sing | 1.08Å | 1.08Å | |
| C17 | H39 | sing | 1.08Å | 1.08Å | |
| C6 | H41 | sing | 1.08Å | 1.08Å | |
| N1 | H42 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C32 | C31 | C30 | 109.2° | 102.9° |
| C31 | C32 | C33 | 109.0° | 105.1° |
| C32 | C31 | H26 | 109.5° | 110.7° |
| C32 | C31 | H27 | 109.5° | 110.8° |
| C31 | C32 | H28 | 109.6° | 110.3° |
| C31 | C32 | H29 | 109.6° | 110.3° |
| C31 | C30 | N6 | 103.3° | 103.2° |
| C31 | C30 | H24 | 111.0° | 110.7° |
| C31 | C30 | H25 | 111.0° | 110.7° |
| C30 | C31 | H26 | 109.6° | 110.7° |
| C30 | C31 | H27 | 109.5° | 110.8° |
| C32 | C33 | N6 | 103.1° | 107.1° |
| C33 | C32 | H28 | 109.6° | 110.3° |
| C33 | C32 | H29 | 109.6° | 110.3° |
| C32 | C33 | H30 | 111.0° | 109.9° |
| C32 | C33 | H31 | 111.0° | 109.9° |
| C30 | N6 | C33 | 104.1° | 105.8° |
| C30 | N6 | C29 | 113.4° | 111.0° |
| N6 | C30 | H24 | 111.0° | 110.7° |
| N6 | C30 | H25 | 111.0° | 110.7° |
| C33 | N6 | C29 | 113.7° | 111.0° |
| N6 | C33 | H30 | 111.1° | 109.9° |
| N6 | C33 | H31 | 111.0° | 109.9° |
| N6 | C29 | C28 | 112.2° | 109.5° |
| N6 | C29 | H35 | 108.8° | 109.4° |
| N6 | C29 | H36 | 108.8° | 109.5° |
| C29 | C28 | C27 | 115.1° | 109.5° |
| C29 | C28 | H33 | 108.0° | 109.4° |
| C29 | C28 | H34 | 108.0° | 109.4° |
| C28 | C29 | H35 | 108.8° | 109.5° |
| C28 | C29 | H36 | 108.8° | 109.4° |
| C28 | C27 | N5 | 111.8° | 109.5° |
| C28 | C27 | H22 | 108.9° | 109.5° |
| C28 | C27 | H23 | 108.9° | 109.5° |
| C27 | C28 | H33 | 108.0° | 109.5° |
| C27 | C28 | H34 | 108.0° | 109.5° |
| C27 | N5 | C26 | 123.5° | 120.0° |
| N5 | C27 | H22 | 108.9° | 109.5° |
| N5 | C27 | H23 | 108.9° | 109.5° |
| C27 | N5 | H32 | 118.3° | 120.0° |
| C8 | N1 | C4 | 109.0° | 109.9° |
| N1 | C8 | C7 | 110.3° | 109.9° |
| N1 | C8 | H5 | 124.9° | 125.0° |
| C8 | N1 | H42 | 125.5° | 125.0° |
| N1 | C4 | C3 | 130.6° | 133.5° |
| N1 | C4 | C5 | 107.4° | 107.1° |
| C4 | N1 | H42 | 125.5° | 125.1° |
| C8 | C7 | C9 | 126.3° | 126.5° |
| C8 | C7 | C5 | 106.3° | 107.0° |
| C7 | C8 | H5 | 124.8° | 125.0° |
| N5 | C26 | O | 122.3° | 120.0° |
| N5 | C26 | C23 | 116.1° | 120.0° |
| C26 | N5 | H32 | 118.2° | 120.0° |
| O | C26 | C23 | 121.6° | 120.0° |
| C26 | C23 | C22 | 121.8° | 120.5° |
| C26 | C23 | C24 | 120.8° | 120.5° |
| C3 | C4 | C5 | 122.0° | 119.3° |
| C4 | C3 | C2 | 118.1° | 119.8° |
| C4 | C3 | H3 | 120.9° | 120.2° |
| C4 | C5 | C7 | 107.0° | 106.1° |
| C4 | C5 | C6 | 118.6° | 119.9° |
| C9 | C7 | C5 | 127.1° | 126.5° |
| C7 | C9 | C10 | 118.6° | 109.5° |
| C7 | C9 | H6 | 107.1° | 109.5° |
| C7 | C9 | H7 | 107.1° | 109.4° |
| C7 | C5 | C6 | 134.4° | 134.0° |
| C9 | C10 | N2 | 114.5° | 109.5° |
| C10 | C9 | H6 | 107.1° | 109.5° |
| C10 | C9 | H7 | 107.2° | 109.5° |
| C9 | C10 | H8 | 108.2° | 109.5° |
| C9 | C10 | H9 | 108.2° | 109.5° |
| C11 | C12 | N3 | 112.4° | 109.4° |
| C12 | C11 | N2 | 111.0° | 109.4° |
| C12 | C11 | H10 | 109.1° | 109.5° |
| C12 | C11 | H11 | 109.1° | 109.5° |
| C11 | C12 | H12 | 108.7° | 109.5° |
| C11 | C12 | H13 | 108.7° | 109.5° |
| C12 | N3 | C15 | 118.7° | 111.0° |
| C12 | N3 | C13 | 113.3° | 110.9° |
| N3 | C12 | H12 | 108.7° | 109.5° |
| N3 | C12 | H13 | 108.7° | 109.5° |
| C3 | C2 | C1 | 120.9° | 120.7° |
| C3 | C2 | H2 | 119.6° | 119.6° |
| C2 | C3 | H3 | 121.0° | 120.1° |
| C23 | C22 | C21 | 121.2° | 118.2° |
| C22 | C23 | C24 | 117.2° | 119.0° |
| C23 | C22 | H20 | 119.4° | 120.9° |
| C22 | C21 | C20 | 120.9° | 120.5° |
| C22 | C21 | C25 | 115.9° | 119.1° |
| C21 | C22 | H20 | 119.4° | 120.9° |
| C23 | C24 | N4 | 123.6° | 120.8° |
| C23 | C24 | H21 | 118.2° | 119.6° |
| C11 | N2 | C10 | 112.5° | 111.0° |
| C11 | N2 | C14 | 108.4° | 110.9° |
| N2 | C11 | H10 | 109.1° | 109.5° |
| N2 | C11 | H11 | 109.1° | 109.4° |
| C5 | C6 | C1 | 119.6° | 119.8° |
| C5 | C6 | H41 | 120.2° | 120.1° |
| C10 | N2 | C14 | 108.1° | 111.0° |
| N2 | C10 | H8 | 108.2° | 109.4° |
| N2 | C10 | H9 | 108.2° | 109.4° |
| N2 | C14 | C13 | 110.7° | 109.4° |
| N2 | C14 | H16 | 109.1° | 109.4° |
| N2 | C14 | H17 | 109.2° | 109.5° |
| C20 | C21 | C25 | 123.1° | 120.5° |
| C21 | C20 | C19 | 117.3° | 120.2° |
| C21 | C20 | C15 | 124.5° | 120.1° |
| C21 | C25 | N4 | 124.4° | 120.9° |
| C21 | C25 | H37 | 117.8° | 119.6° |
| C20 | C19 | C18 | 121.4° | 119.9° |
| C19 | C20 | C15 | 118.1° | 119.7° |
| C20 | C19 | H19 | 119.3° | 120.0° |
| C19 | C18 | C17 | 120.1° | 120.3° |
| C18 | C19 | H19 | 119.3° | 120.1° |
| C19 | C18 | H38 | 119.9° | 119.8° |
| C24 | N4 | C25 | 117.7° | 122.0° |
| N4 | C24 | H21 | 118.2° | 119.6° |
| C20 | C15 | N3 | 120.3° | 120.2° |
| C20 | C15 | C16 | 119.6° | 119.7° |
| C18 | C17 | C16 | 120.1° | 120.4° |
| C17 | C18 | H38 | 120.0° | 119.9° |
| C18 | C17 | H39 | 120.0° | 119.8° |
| C15 | N3 | C13 | 111.4° | 111.1° |
| N3 | C15 | C16 | 120.1° | 120.1° |
| N3 | C13 | C14 | 111.7° | 109.4° |
| N3 | C13 | H14 | 108.9° | 109.5° |
| N3 | C13 | H15 | 108.9° | 109.5° |
| C15 | C16 | C17 | 120.8° | 120.0° |
| C15 | C16 | H18 | 119.6° | 119.9° |
| C2 | C1 | C6 | 120.8° | 120.5° |
| C2 | C1 | H1 | 119.6° | 119.7° |
| C1 | C2 | H2 | 119.5° | 119.7° |
| C17 | C16 | H18 | 119.6° | 120.0° |
| C16 | C17 | H39 | 120.0° | 119.8° |
| C6 | C1 | H1 | 119.6° | 119.8° |
| C1 | C6 | H41 | 120.2° | 120.1° |
| N4 | C25 | H37 | 117.8° | 119.6° |
| C14 | C13 | H14 | 108.9° | 109.5° |
| C14 | C13 | H15 | 108.9° | 109.5° |
| C13 | C14 | H16 | 109.2° | 109.5° |
| C13 | C14 | H17 | 109.2° | 109.6° |
| H6 | C9 | H7 | 109.4° | 109.5° |
| H8 | C10 | H9 | 109.5° | 109.5° |
| H10 | C11 | H11 | 109.5° | 109.5° |
| H12 | C12 | H13 | 109.5° | 109.5° |
| H14 | C13 | H15 | 109.5° | 109.4° |
| H16 | C14 | H17 | 109.5° | 109.5° |
| H22 | C27 | H23 | 109.5° | 109.5° |
| H24 | C30 | H25 | 109.5° | 110.6° |
| H26 | C31 | H27 | 109.5° | 110.8° |
| H28 | C32 | H29 | 109.5° | 110.4° |
| H30 | C33 | H31 | 109.5° | 110.1° |
| H33 | C28 | H34 | 109.5° | 109.5° |
| H35 | C29 | H36 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C32 | C31 | C30 | H26 | 119.9° | 118.3° |
| C32 | C31 | C30 | H27 | 119.9° | 118.4° |
| C31 | C32 | C33 | H28 | 119.9° | 118.9° |
| C31 | C32 | C33 | H29 | 119.9° | 118.9° |
| C32 | C31 | C30 | N6 | 17.8° | 37.4° |
| C31 | C32 | C33 | N6 | 22.4° | 1.2° |
| C32 | C31 | C30 | H24 | 101.2° | 155.9° |
| C32 | C31 | C30 | H25 | 136.8° | 81.1° |
| C32 | C31 | H26 | H27 | 120.1° | 123.3° |
| C31 | C32 | H28 | H29 | 120.2° | 122.1° |
| C31 | C32 | C33 | H30 | 141.4° | 118.1° |
| C31 | C32 | C33 | H31 | 96.6° | 120.6° |
| C30 | C31 | C32 | C33 | 2.8° | 21.9° |
| C31 | C30 | N6 | H24 | 119.0° | 118.5° |
| C31 | C30 | N6 | H25 | 119.0° | 118.5° |
| C31 | C30 | N6 | C33 | 31.1° | 39.1° |
| C31 | C30 | N6 | C29 | 155.1° | 159.7° |
| C31 | C30 | H24 | H25 | 122.9° | 123.1° |
| C30 | C31 | H26 | H27 | 120.1° | 123.2° |
| C30 | C31 | C32 | H28 | 117.1° | 140.8° |
| C30 | C31 | C32 | H29 | 122.7° | 97.0° |
| C32 | C33 | N6 | C30 | 32.7° | 25.3° |
| C32 | C33 | N6 | H30 | 119.0° | 119.3° |
| C32 | C33 | N6 | H31 | 119.0° | 119.4° |
| C32 | C33 | N6 | C29 | 156.6° | 145.8° |
| C33 | C32 | C31 | H26 | 117.2° | 96.4° |
| C33 | C32 | C31 | H27 | 122.8° | 140.4° |
| C33 | C32 | H28 | H29 | 120.2° | 122.1° |
| C32 | C33 | H30 | H31 | 122.9° | 121.2° |
| C30 | N6 | C33 | C29 | 123.9° | 120.5° |
| C30 | N6 | C29 | C28 | 141.7° | 72.6° |
| N6 | C30 | H24 | H25 | 122.9° | 123.1° |
| N6 | C30 | C31 | H26 | 137.8° | 81.0° |
| N6 | C30 | C31 | H27 | 102.1° | 155.8° |
| C30 | N6 | C33 | H30 | 151.7° | 94.0° |
| C30 | N6 | C33 | H31 | 86.3° | 144.7° |
| C30 | N6 | C29 | H35 | 97.9° | 167.4° |
| C30 | N6 | C29 | H36 | 21.3° | 47.4° |
| C33 | N6 | C29 | C28 | 99.6° | 170.0° |
| C33 | N6 | C30 | H24 | 87.9° | 157.6° |
| C33 | N6 | C30 | H25 | 150.1° | 79.4° |
| N6 | C33 | C32 | H28 | 97.5° | 117.7° |
| N6 | C33 | C32 | H29 | 142.3° | 120.1° |
| N6 | C33 | H30 | H31 | 122.9° | 121.2° |
| C33 | N6 | C29 | H35 | 20.8° | 50.0° |
| C33 | N6 | C29 | H36 | 140.0° | 70.0° |
| N6 | C29 | C28 | H35 | 120.4° | 120.0° |
| N6 | C29 | C28 | H36 | 120.4° | 120.0° |
| N6 | C29 | C28 | C27 | 169.6° | 180.0° |
| C29 | N6 | C30 | H24 | 36.1° | 81.8° |
| C29 | N6 | C30 | H25 | 85.9° | 41.2° |
| C29 | N6 | C33 | H30 | 84.4° | 26.5° |
| C29 | N6 | C33 | H31 | 37.6° | 94.8° |
| N6 | C29 | C28 | H33 | 48.8° | 60.0° |
| N6 | C29 | C28 | H34 | 69.6° | 59.9° |
| N6 | C29 | H35 | H36 | 118.8° | 120.0° |
| C29 | C28 | C27 | H33 | 120.8° | 120.0° |
| C29 | C28 | C27 | H34 | 120.8° | 120.0° |
| C29 | C28 | C27 | N5 | 46.5° | 180.0° |
| C29 | C28 | C27 | H22 | 73.9° | 60.0° |
| C29 | C28 | C27 | H23 | 166.9° | 60.0° |
| C29 | C28 | H33 | H34 | 117.4° | 120.0° |
| C28 | C29 | H35 | H36 | 118.8° | 120.0° |
| C28 | C27 | N5 | H22 | 120.3° | 120.0° |
| C28 | C27 | N5 | H23 | 120.4° | 120.0° |
| C28 | C27 | N5 | C26 | 64.8° | 180.0° |
| C28 | C27 | H22 | H23 | 118.9° | 120.0° |
| C28 | C27 | N5 | H32 | 115.2° | 0.0° |
| C27 | C28 | H33 | H34 | 117.4° | 120.1° |
| C27 | C28 | C29 | H35 | 70.0° | 60.0° |
| C27 | C28 | C29 | H36 | 49.2° | 60.0° |
| C27 | N5 | C26 | H32 | 180.0° | 179.9° |
| C27 | N5 | C26 | O | 3.1° | 0.1° |
| C27 | N5 | C26 | C23 | 176.1° | 180.0° |
| N5 | C27 | H22 | H23 | 118.9° | 120.0° |
| N5 | C27 | C28 | H33 | 167.3° | 60.0° |
| N5 | C27 | C28 | H34 | 74.3° | 60.0° |
| C8 | N1 | C4 | H42 | 180.0° | 179.6° |
| N1 | C8 | C7 | H5 | 180.0° | 179.9° |
| C8 | N1 | C4 | C3 | 178.2° | 180.0° |
| C8 | N1 | C4 | C5 | 0.5° | 0.2° |
| N1 | C8 | C7 | C9 | 174.8° | 179.9° |
| N1 | C8 | C7 | C5 | 0.1° | 0.4° |
| C4 | N1 | C8 | C7 | 0.4° | 0.4° |
| N1 | C4 | C3 | C5 | 178.5° | 179.8° |
| N1 | C4 | C5 | C7 | 0.4° | 0.1° |
| N1 | C4 | C3 | C2 | 178.9° | 180.0° |
| N1 | C4 | C5 | C6 | 179.5° | 180.0° |
| N1 | C4 | C3 | H3 | 1.1° | 0.0° |
| C4 | N1 | C8 | H5 | 179.6° | 179.7° |
| C8 | C7 | C5 | C4 | 0.2° | 0.3° |
| C8 | C7 | C9 | C5 | 173.9° | 179.6° |
| C8 | C7 | C9 | C10 | 129.1° | 94.7° |
| C8 | C7 | C5 | C6 | 179.1° | 179.7° |
| C8 | C7 | C9 | H6 | 109.6° | 25.4° |
| C8 | C7 | C9 | H7 | 7.8° | 145.3° |
| C7 | C8 | N1 | H42 | 179.6° | 180.0° |
| N5 | C26 | O | C23 | 179.2° | 179.9° |
| N5 | C26 | C23 | C22 | 123.5° | 180.0° |
| N5 | C26 | C23 | C24 | 51.7° | 0.1° |
| C26 | N5 | C27 | H22 | 174.9° | 60.0° |
| C26 | N5 | C27 | H23 | 55.6° | 60.0° |
| O | C26 | C23 | C22 | 55.8° | 0.0° |
| O | C26 | C23 | C24 | 129.1° | 180.0° |
| O | C26 | N5 | H32 | 176.9° | 180.0° |
| C26 | C23 | C22 | C24 | 175.3° | 179.9° |
| C26 | C23 | C22 | C21 | 175.4° | 180.0° |
| C26 | C23 | C24 | N4 | 173.5° | 179.7° |
| C26 | C23 | C22 | H20 | 4.6° | 0.0° |
| C26 | C23 | C24 | H21 | 6.5° | 0.1° |
| C23 | C26 | N5 | H32 | 3.9° | 0.1° |
| C3 | C4 | C5 | C7 | 178.4° | 179.8° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.7° | 0.2° |
| C4 | C3 | C2 | C1 | 0.1° | 0.0° |
| C4 | C3 | C2 | H2 | 179.9° | 180.0° |
| C3 | C4 | N1 | H42 | 1.8° | 0.4° |
| C4 | C5 | C7 | C9 | 175.1° | 180.0° |
| C4 | C5 | C7 | C6 | 178.9° | 179.9° |
| C5 | C4 | C3 | C2 | 0.4° | 0.2° |
| C4 | C5 | C6 | C1 | 0.5° | 0.1° |
| C5 | C4 | C3 | H3 | 179.6° | 179.8° |
| C4 | C5 | C6 | H41 | 179.5° | 180.0° |
| C5 | C4 | N1 | H42 | 179.5° | 179.8° |
| C7 | C9 | C10 | H6 | 121.3° | 120.0° |
| C7 | C9 | C10 | H7 | 121.3° | 120.0° |
| C9 | C7 | C5 | C6 | 6.0° | 0.0° |
| C7 | C9 | C10 | N2 | 54.9° | 180.0° |
| C9 | C7 | C8 | H5 | 5.2° | 0.1° |
| C7 | C9 | H6 | H7 | 115.8° | 120.0° |
| C7 | C9 | C10 | H8 | 65.9° | 60.0° |
| C7 | C9 | C10 | H9 | 175.6° | 60.0° |
| C5 | C7 | C9 | C10 | 57.0° | 85.0° |
| C7 | C5 | C6 | C1 | 178.3° | 180.0° |
| C5 | C7 | C8 | H5 | 179.9° | 179.6° |
| C5 | C7 | C9 | H6 | 64.3° | 155.0° |
| C5 | C7 | C9 | H7 | 178.3° | 35.0° |
| C7 | C5 | C6 | H41 | 1.7° | 0.1° |
| C9 | C10 | N2 | C11 | 88.1° | 170.0° |
| C9 | C10 | N2 | H8 | 120.8° | 120.1° |
| C9 | C10 | N2 | H9 | 120.7° | 120.0° |
| C9 | C10 | N2 | C14 | 152.2° | 66.2° |
| C10 | C9 | H6 | H7 | 115.9° | 120.0° |
| C9 | C10 | H8 | H9 | 117.7° | 120.1° |
| C11 | C12 | N3 | H12 | 120.4° | 120.0° |
| C11 | C12 | N3 | H13 | 120.5° | 120.0° |
| C12 | C11 | N2 | H10 | 120.2° | 120.0° |
| C12 | C11 | N2 | H11 | 120.2° | 120.0° |
| C12 | C11 | N2 | C10 | 178.7° | 176.8° |
| C12 | C11 | N2 | C14 | 59.1° | 59.3° |
| C11 | C12 | N3 | C15 | 179.4° | 176.8° |
| C11 | C12 | N3 | C13 | 47.0° | 59.3° |
| C12 | C11 | H10 | H11 | 119.3° | 120.1° |
| C11 | C12 | H12 | H13 | 118.6° | 120.1° |
| N3 | C12 | C11 | N2 | 51.8° | 58.4° |
| C12 | N3 | C15 | C20 | 74.7° | 120.3° |
| C12 | N3 | C15 | C13 | 134.4° | 123.8° |
| C12 | N3 | C15 | C16 | 105.1° | 60.0° |
| C12 | N3 | C13 | C14 | 50.1° | 59.3° |
| N3 | C12 | C11 | H10 | 172.1° | 178.3° |
| N3 | C12 | C11 | H11 | 68.4° | 61.6° |
| N3 | C12 | H12 | H13 | 118.6° | 120.0° |
| C12 | N3 | C13 | H14 | 170.4° | 60.7° |
| C12 | N3 | C13 | H15 | 70.3° | 179.3° |
| C3 | C2 | C1 | H2 | 180.0° | 180.0° |
| C3 | C2 | C1 | C6 | 0.3° | 0.3° |
| C3 | C2 | C1 | H1 | 179.7° | 180.0° |
| C23 | C22 | C21 | H20 | 180.0° | 179.9° |
| C23 | C22 | C21 | C20 | 175.8° | 180.0° |
| C23 | C22 | C21 | C25 | 1.5° | 0.2° |
| C22 | C23 | C24 | N4 | 1.9° | 0.3° |
| C22 | C23 | C24 | H21 | 178.1° | 179.9° |
| C21 | C22 | C23 | C24 | 0.1° | 0.0° |
| C22 | C21 | C20 | C25 | 177.1° | 179.8° |
| C22 | C21 | C20 | C19 | 50.1° | 49.8° |
| C22 | C21 | C20 | C15 | 132.9° | 130.3° |
| C22 | C21 | C25 | N4 | 1.2° | 0.2° |
| C22 | C21 | C25 | H37 | 178.8° | 179.7° |
| C23 | C24 | N4 | H21 | 180.0° | 179.6° |
| C23 | C24 | N4 | C25 | 2.2° | 0.4° |
| C24 | C23 | C22 | H20 | 179.9° | 179.9° |
| C11 | N2 | C10 | C14 | 119.7° | 123.8° |
| C11 | N2 | C14 | C13 | 62.6° | 59.2° |
| C11 | N2 | C10 | H8 | 151.1° | 70.0° |
| C11 | N2 | C10 | H9 | 32.6° | 50.0° |
| N2 | C11 | H10 | H11 | 119.3° | 120.0° |
| N2 | C11 | C12 | H12 | 172.3° | 178.4° |
| N2 | C11 | C12 | H13 | 68.6° | 61.6° |
| C11 | N2 | C14 | H16 | 177.2° | 60.6° |
| C11 | N2 | C14 | H17 | 57.6° | 179.3° |
| C5 | C6 | C1 | C2 | 0.0° | 0.3° |
| C5 | C6 | C1 | H41 | 180.0° | 179.9° |
| C5 | C6 | C1 | H1 | 180.0° | 180.0° |
| C10 | N2 | C14 | C13 | 175.2° | 176.9° |
| N2 | C10 | C9 | H6 | 176.2° | 60.0° |
| N2 | C10 | C9 | H7 | 66.5° | 60.0° |
| N2 | C10 | H8 | H9 | 117.7° | 119.9° |
| C10 | N2 | C11 | H10 | 61.1° | 56.8° |
| C10 | N2 | C11 | H11 | 58.4° | 63.2° |
| C10 | N2 | C14 | H16 | 55.0° | 63.3° |
| C10 | N2 | C14 | H17 | 64.7° | 56.8° |
| N2 | C14 | C13 | N3 | 58.3° | 58.4° |
| N2 | C14 | C13 | H16 | 120.2° | 119.9° |
| N2 | C14 | C13 | H17 | 120.2° | 120.0° |
| C14 | N2 | C10 | H8 | 31.4° | 53.9° |
| C14 | N2 | C10 | H9 | 87.1° | 173.8° |
| C14 | N2 | C11 | H10 | 179.3° | 179.3° |
| C14 | N2 | C11 | H11 | 61.1° | 60.7° |
| N2 | C14 | C13 | H14 | 178.6° | 61.7° |
| N2 | C14 | C13 | H15 | 62.1° | 178.4° |
| N2 | C14 | H16 | H17 | 119.5° | 120.0° |
| C21 | C20 | C19 | C15 | 177.2° | 179.9° |
| C21 | C20 | C19 | C18 | 176.6° | 180.0° |
| C21 | C20 | C15 | N3 | 5.3° | 0.3° |
| C21 | C20 | C15 | C16 | 175.0° | 180.0° |
| C20 | C21 | C25 | N4 | 176.1° | 180.0° |
| C21 | C20 | C19 | H19 | 3.4° | 0.1° |
| C20 | C21 | C22 | H20 | 4.2° | 0.1° |
| C20 | C21 | C25 | H37 | 3.9° | 0.0° |
| C25 | C21 | C20 | C19 | 127.0° | 130.0° |
| C21 | C25 | N4 | C24 | 0.6° | 0.1° |
| C25 | C21 | C20 | C15 | 50.0° | 50.0° |
| C21 | C25 | N4 | H37 | 180.0° | 179.9° |
| C25 | C21 | C22 | H20 | 178.5° | 179.8° |
| C20 | C19 | C18 | H19 | 180.0° | 179.9° |
| C20 | C19 | C18 | C17 | 0.8° | 0.1° |
| C19 | C20 | C15 | N3 | 177.7° | 179.7° |
| C19 | C20 | C15 | C16 | 2.0° | 0.0° |
| C20 | C19 | C18 | H38 | 179.2° | 179.9° |
| C18 | C19 | C20 | C15 | 0.6° | 0.1° |
| C19 | C18 | C17 | H38 | 180.0° | 179.9° |
| C19 | C18 | C17 | C16 | 0.7° | 0.1° |
| C19 | C18 | C17 | H39 | 179.3° | 180.0° |
| C24 | N4 | C25 | H37 | 179.4° | 180.0° |
| C20 | C15 | N3 | C16 | 179.7° | 179.7° |
| C20 | C15 | N3 | C13 | 151.0° | 115.9° |
| C20 | C15 | C16 | C17 | 2.1° | 0.0° |
| C20 | C15 | C16 | H18 | 177.9° | 180.0° |
| C15 | C20 | C19 | H19 | 179.4° | 180.0° |
| C18 | C17 | C16 | C15 | 0.7° | 0.0° |
| C18 | C17 | C16 | H39 | 180.0° | 179.9° |
| C18 | C17 | C16 | H18 | 179.3° | 180.0° |
| C17 | C18 | C19 | H19 | 179.3° | 180.0° |
| N3 | C15 | C16 | C17 | 177.6° | 179.7° |
| C15 | N3 | C13 | C14 | 173.0° | 176.8° |
| C15 | N3 | C12 | H12 | 59.0° | 56.8° |
| C15 | N3 | C12 | H13 | 60.1° | 63.2° |
| C15 | N3 | C13 | H14 | 52.7° | 63.2° |
| C15 | N3 | C13 | H15 | 66.6° | 56.8° |
| N3 | C15 | C16 | H18 | 2.4° | 0.3° |
| C13 | N3 | C15 | C16 | 29.3° | 63.8° |
| N3 | C13 | C14 | H14 | 120.4° | 120.0° |
| N3 | C13 | C14 | H15 | 120.3° | 120.0° |
| C13 | N3 | C12 | H12 | 167.5° | 179.3° |
| C13 | N3 | C12 | H13 | 73.4° | 60.7° |
| N3 | C13 | H14 | H15 | 119.0° | 120.1° |
| N3 | C13 | C14 | H16 | 178.4° | 61.5° |
| N3 | C13 | C14 | H17 | 61.9° | 178.4° |
| C15 | C16 | C17 | H18 | 180.0° | 180.0° |
| C15 | C16 | C17 | H39 | 179.3° | 180.0° |
| C2 | C1 | C6 | H1 | 180.0° | 179.7° |
| C1 | C2 | C3 | H3 | 179.9° | 180.0° |
| C2 | C1 | C6 | H41 | 180.0° | 179.7° |
| C16 | C17 | C18 | H38 | 179.3° | 180.0° |
| C6 | C1 | C2 | H2 | 179.7° | 179.7° |
| C25 | N4 | C24 | H21 | 177.8° | 180.0° |
| C14 | C13 | H14 | H15 | 119.0° | 120.0° |
| C13 | C14 | H16 | H17 | 119.4° | 120.1° |
| H1 | C1 | C2 | H2 | 0.3° | 0.1° |
| H1 | C1 | C6 | H41 | 0.0° | 0.1° |
| H2 | C2 | C3 | H3 | 0.1° | 0.0° |
| H5 | C8 | N1 | H42 | 0.4° | 0.0° |
| H6 | C9 | C10 | H8 | 55.4° | 180.0° |
| H6 | C9 | C10 | H9 | 63.1° | 60.0° |
| H7 | C9 | C10 | H8 | 172.8° | 60.0° |
| H7 | C9 | C10 | H9 | 54.3° | 180.0° |
| H10 | C11 | C12 | H12 | 67.5° | 61.7° |
| H10 | C11 | C12 | H13 | 51.6° | 58.4° |
| H11 | C11 | C12 | H12 | 52.0° | 58.4° |
| H11 | C11 | C12 | H13 | 171.2° | 178.5° |
| H14 | C13 | C14 | H16 | 61.2° | 178.5° |
| H14 | C13 | C14 | H17 | 58.4° | 58.4° |
| H15 | C13 | C14 | H16 | 58.1° | 58.5° |
| H15 | C13 | C14 | H17 | 177.7° | 61.6° |
| H18 | C16 | C17 | H39 | 0.8° | 0.1° |
| H19 | C19 | C18 | H38 | 0.8° | 0.0° |
| H22 | C27 | N5 | H32 | 5.1° | 120.0° |
| H22 | C27 | C28 | H33 | 47.0° | 180.0° |
| H22 | C27 | C28 | H34 | 165.3° | 60.0° |
| H23 | C27 | N5 | H32 | 124.4° | 120.1° |
| H23 | C27 | C28 | H33 | 72.3° | 60.0° |
| H23 | C27 | C28 | H34 | 46.0° | 180.0° |
| H24 | C30 | C31 | H26 | 18.8° | 37.5° |
| H24 | C30 | C31 | H27 | 138.9° | 85.7° |
| H25 | C30 | C31 | H26 | 103.2° | 160.5° |
| H25 | C30 | C31 | H27 | 16.9° | 37.3° |
| H26 | C31 | C32 | H28 | 122.9° | 22.5° |
| H26 | C31 | C32 | H29 | 2.8° | 144.7° |
| H27 | C31 | C32 | H28 | 2.8° | 100.7° |
| H27 | C31 | C32 | H29 | 117.3° | 21.4° |
| H28 | C32 | C33 | H30 | 21.5° | 123.0° |
| H28 | C32 | C33 | H31 | 143.5° | 1.7° |
| H29 | C32 | C33 | H30 | 98.7° | 0.8° |
| H29 | C32 | C33 | H31 | 23.3° | 120.5° |
| H33 | C28 | C29 | H35 | 169.2° | 60.0° |
| H33 | C28 | C29 | H36 | 71.6° | 180.0° |
| H34 | C28 | C29 | H35 | 50.8° | 179.9° |
| H34 | C28 | C29 | H36 | 170.0° | 60.0° |
| H38 | C18 | C17 | H39 | 0.7° | 0.0° |
