RGW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| C13 | C18 | sing | 1.53Å | 1.53Å | |
| C12 | C16 | sing | 1.53Å | 1.54Å | |
| C12 | C11 | sing | 1.53Å | 1.51Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C17 | C15 | sing | 1.53Å | 1.52Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C11 | C10 | sing | 1.53Å | 1.54Å | |
| C19 | C10 | sing | 1.53Å | 1.53Å | |
| CL1 | C1 | sing | 1.74Å | 1.60Å | |
| C10 | C14 | sing | 1.53Å | 1.53Å | |
| C10 | C9 | sing | 1.53Å | 1.50Å | |
| C30 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.41Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.41Å | Aromatic |
| C9 | N2 | sing | 1.46Å | 1.45Å | |
| C29 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| N2 | C8 | sing | 1.35Å | 1.42Å | |
| C2 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.36Å | Aromatic |
| C4 | C5 | sing | 1.51Å | 1.50Å | |
| C8 | O1 | doub | 1.21Å | 1.19Å | |
| C8 | C7 | sing | 1.51Å | 1.49Å | |
| N1 | C5 | sing | 1.48Å | 1.32Å | |
| N1 | C6 | sing | 1.48Å | 1.47Å | |
| C5 | C24 | sing | 1.51Å | 1.53Å | |
| C7 | C6 | sing | 1.53Å | 1.51Å | |
| C6 | C20 | sing | 1.50Å | 1.48Å | |
| C26 | C25 | sing | 1.51Å | 1.51Å | |
| C24 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C24 | C23 | doub | 1.35Å | 1.42Å | Aromatic |
| C20 | N3 | doub | 1.30Å | 1.35Å | Aromatic |
| C20 | N5 | sing | 1.36Å | 1.35Å | Aromatic |
| C25 | C27 | doub | 1.33Å | 1.38Å | Aromatic |
| N3 | N4 | sing | 1.29Å | 1.37Å | Aromatic |
| N5 | C23 | sing | 1.40Å | 1.50Å | |
| N5 | C21 | sing | 1.34Å | 1.37Å | Aromatic |
| C23 | S1 | sing | 1.75Å | 1.56Å | Aromatic |
| N4 | C21 | doub | 1.31Å | 1.32Å | Aromatic |
| C27 | C28 | sing | 1.51Å | 1.54Å | |
| C27 | S1 | sing | 1.76Å | 1.55Å | Aromatic |
| C21 | C22 | sing | 1.51Å | 1.53Å | |
| C14 | H1 | sing | 1.09Å | 1.10Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| N1 | H14 | sing | 1.01Å | 1.00Å | |
| N2 | H16 | sing | 0.97Å | 1.00Å | |
| C3 | H17 | sing | 1.08Å | 1.08Å | |
| C2 | H18 | sing | 1.08Å | 1.08Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| C26 | H31 | sing | 1.09Å | 1.10Å | |
| C26 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C28 | H34 | sing | 1.09Å | 1.10Å | |
| C28 | H35 | sing | 1.09Å | 1.10Å | |
| C29 | H36 | sing | 1.08Å | 1.08Å | |
| C30 | H37 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | C13 | C18 | 109.3° | 109.5° |
| C13 | C12 | C16 | 111.1° | 109.5° |
| C13 | C12 | C11 | 108.7° | 109.5° |
| C13 | C12 | H11 | 109.4° | 109.4° |
| C12 | C13 | H12 | 109.5° | 109.5° |
| C12 | C13 | H13 | 109.5° | 109.5° |
| C13 | C18 | C17 | 109.0° | 109.5° |
| C13 | C18 | C19 | 108.9° | 109.4° |
| C18 | C13 | H12 | 109.5° | 109.5° |
| C18 | C13 | H13 | 109.5° | 109.4° |
| C13 | C18 | H24 | 109.7° | 109.5° |
| C16 | C12 | C11 | 108.9° | 109.5° |
| C12 | C16 | C15 | 109.8° | 109.5° |
| C16 | C12 | H11 | 109.2° | 109.5° |
| C12 | C16 | H20 | 109.4° | 109.5° |
| C12 | C16 | H21 | 109.4° | 109.4° |
| C12 | C11 | C10 | 109.9° | 109.5° |
| C12 | C11 | H5 | 109.4° | 109.5° |
| C12 | C11 | H6 | 109.4° | 109.5° |
| C11 | C12 | H11 | 109.5° | 109.5° |
| C16 | C15 | C17 | 109.1° | 109.5° |
| C16 | C15 | C14 | 108.4° | 109.5° |
| C16 | C15 | H19 | 109.9° | 109.5° |
| C15 | C16 | H20 | 109.4° | 109.5° |
| C15 | C16 | H21 | 109.4° | 109.5° |
| C17 | C18 | C19 | 109.8° | 109.5° |
| C18 | C17 | C15 | 110.7° | 109.4° |
| C18 | C17 | H22 | 109.2° | 109.4° |
| C18 | C17 | H23 | 109.2° | 109.4° |
| C17 | C18 | H24 | 109.7° | 109.5° |
| C18 | C19 | C10 | 109.5° | 109.4° |
| C19 | C18 | H24 | 109.7° | 109.5° |
| C18 | C19 | H25 | 109.4° | 109.4° |
| C18 | C19 | H26 | 109.5° | 109.5° |
| C17 | C15 | C14 | 109.6° | 109.5° |
| C17 | C15 | H19 | 109.9° | 109.4° |
| C15 | C17 | H22 | 109.2° | 109.5° |
| C15 | C17 | H23 | 109.2° | 109.5° |
| C15 | C14 | C10 | 109.9° | 109.5° |
| C15 | C14 | H1 | 109.4° | 109.4° |
| C15 | C14 | H2 | 109.3° | 109.5° |
| C14 | C15 | H19 | 109.8° | 109.5° |
| C11 | C10 | C19 | 108.6° | 109.5° |
| C11 | C10 | C14 | 109.6° | 109.4° |
| C11 | C10 | C9 | 108.4° | 109.5° |
| C10 | C11 | H5 | 109.4° | 109.4° |
| C10 | C11 | H6 | 109.3° | 109.5° |
| C19 | C10 | C14 | 109.4° | 109.5° |
| C19 | C10 | C9 | 111.6° | 109.5° |
| C10 | C19 | H25 | 109.4° | 109.5° |
| C10 | C19 | H26 | 109.5° | 109.5° |
| CL1 | C1 | C30 | 122.2° | 120.0° |
| CL1 | C1 | C2 | 120.8° | 120.0° |
| C14 | C10 | C9 | 109.3° | 109.5° |
| C10 | C14 | H1 | 109.4° | 109.5° |
| C10 | C14 | H2 | 109.4° | 109.5° |
| C10 | C9 | N2 | 111.2° | 109.5° |
| C10 | C9 | H9 | 109.0° | 109.5° |
| C10 | C9 | H10 | 109.0° | 109.5° |
| C1 | C30 | C29 | 121.7° | 120.0° |
| C30 | C1 | C2 | 117.0° | 120.0° |
| C1 | C30 | H37 | 119.2° | 120.0° |
| C30 | C29 | C4 | 120.0° | 120.0° |
| C30 | C29 | H36 | 120.0° | 120.0° |
| C29 | C30 | H37 | 119.2° | 120.0° |
| C1 | C2 | C3 | 121.3° | 120.0° |
| C1 | C2 | H18 | 119.4° | 120.0° |
| C9 | N2 | C8 | 120.3° | 120.0° |
| N2 | C9 | H9 | 109.0° | 109.5° |
| N2 | C9 | H10 | 109.0° | 109.5° |
| C9 | N2 | H16 | 119.8° | 120.0° |
| C29 | C4 | C3 | 119.1° | 120.0° |
| C29 | C4 | C5 | 119.9° | 120.0° |
| C4 | C29 | H36 | 120.0° | 120.0° |
| N2 | C8 | O1 | 123.1° | 120.0° |
| N2 | C8 | C7 | 116.1° | 120.0° |
| C8 | N2 | H16 | 119.8° | 120.0° |
| C2 | C3 | C4 | 121.0° | 120.0° |
| C2 | C3 | H17 | 119.5° | 120.0° |
| C3 | C2 | H18 | 119.3° | 120.0° |
| C3 | C4 | C5 | 121.0° | 119.9° |
| C4 | C3 | H17 | 119.5° | 120.0° |
| C4 | C5 | N1 | 119.2° | 108.5° |
| C4 | C5 | C24 | 117.3° | 108.5° |
| C4 | C5 | H3 | 96.5° | 108.5° |
| O1 | C8 | C7 | 120.8° | 120.0° |
| C8 | C7 | C6 | 111.3° | 109.5° |
| C8 | C7 | H7 | 109.0° | 109.5° |
| C8 | C7 | H8 | 109.0° | 109.4° |
| C5 | N1 | C6 | 119.8° | 109.5° |
| N1 | C5 | C24 | 119.4° | 114.3° |
| N1 | C5 | H3 | 97.4° | 108.4° |
| C5 | N1 | H14 | 106.8° | 110.9° |
| N1 | C6 | C7 | 107.0° | 108.8° |
| N1 | C6 | C20 | 104.6° | 112.9° |
| N1 | C6 | H4 | 110.5° | 108.8° |
| C6 | N1 | H14 | 106.8° | 111.0° |
| C5 | C24 | C25 | 124.9° | 125.7° |
| C5 | C24 | C23 | 130.0° | 121.4° |
| C24 | C5 | H3 | 96.4° | 108.5° |
| C7 | C6 | C20 | 114.5° | 108.8° |
| C7 | C6 | H4 | 109.9° | 108.7° |
| C6 | C7 | H7 | 109.0° | 109.5° |
| C6 | C7 | H8 | 109.0° | 109.4° |
| C6 | C20 | N3 | 127.9° | 130.5° |
| C6 | C20 | N5 | 124.6° | 122.9° |
| C20 | C6 | H4 | 110.3° | 108.8° |
| C26 | C25 | C24 | 125.7° | 122.1° |
| C26 | C25 | C27 | 126.4° | 122.1° |
| C25 | C26 | H30 | 109.5° | 109.5° |
| C25 | C26 | H31 | 109.5° | 109.5° |
| C25 | C26 | H32 | 109.5° | 109.5° |
| C25 | C24 | C23 | 105.1° | 112.8° |
| C24 | C25 | C27 | 107.8° | 115.8° |
| C24 | C23 | N5 | 117.6° | 119.9° |
| C24 | C23 | S1 | 118.3° | 110.8° |
| N3 | C20 | N5 | 107.4° | 106.6° |
| C20 | N3 | N4 | 107.0° | 109.7° |
| C20 | N5 | C23 | 123.2° | 119.1° |
| C20 | N5 | C21 | 108.9° | 107.2° |
| C25 | C27 | C28 | 121.6° | 125.2° |
| C25 | C27 | S1 | 119.2° | 109.6° |
| N3 | N4 | C21 | 109.6° | 109.9° |
| C23 | N5 | C21 | 127.7° | 133.7° |
| N5 | C23 | S1 | 123.8° | 129.3° |
| N5 | C21 | N4 | 107.0° | 106.5° |
| N5 | C21 | C22 | 126.4° | 126.8° |
| C23 | S1 | C27 | 89.5° | 90.8° |
| N4 | C21 | C22 | 126.6° | 126.7° |
| C28 | C27 | S1 | 119.1° | 125.2° |
| C27 | C28 | H33 | 109.5° | 109.5° |
| C27 | C28 | H34 | 109.5° | 109.5° |
| C27 | C28 | H35 | 109.5° | 109.5° |
| C21 | C22 | H27 | 109.5° | 109.5° |
| C21 | C22 | H28 | 109.4° | 109.5° |
| C21 | C22 | H29 | 109.5° | 109.5° |
| H1 | C14 | H2 | 109.5° | 109.5° |
| H5 | C11 | H6 | 109.5° | 109.5° |
| H7 | C7 | H8 | 109.5° | 109.5° |
| H9 | C9 | H10 | 109.5° | 109.4° |
| H12 | C13 | H13 | 109.5° | 109.5° |
| H20 | C16 | H21 | 109.5° | 109.4° |
| H22 | C17 | H23 | 109.5° | 109.5° |
| H25 | C19 | H26 | 109.5° | 109.5° |
| H27 | C22 | H28 | 109.5° | 109.4° |
| H27 | C22 | H29 | 109.5° | 109.5° |
| H28 | C22 | H29 | 109.5° | 109.5° |
| H30 | C26 | H31 | 109.5° | 109.4° |
| H30 | C26 | H32 | 109.4° | 109.5° |
| H31 | C26 | H32 | 109.5° | 109.5° |
| H33 | C28 | H34 | 109.5° | 109.4° |
| H33 | C28 | H35 | 109.5° | 109.4° |
| H34 | C28 | H35 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | C13 | C18 | H12 | 120.0° | 120.1° |
| C12 | C13 | C18 | H13 | 120.0° | 120.0° |
| C13 | C12 | C16 | C11 | 119.7° | 120.0° |
| C13 | C12 | C16 | H11 | 120.7° | 120.0° |
| C13 | C12 | C11 | H11 | 119.5° | 120.0° |
| C13 | C12 | C16 | C15 | 58.2° | 60.0° |
| C12 | C13 | C18 | C17 | 58.7° | 60.0° |
| C12 | C13 | C18 | C19 | 61.1° | 60.0° |
| C13 | C12 | C11 | C10 | 61.5° | 60.0° |
| C13 | C12 | C11 | H5 | 178.4° | 59.9° |
| C13 | C12 | C11 | H6 | 58.5° | 180.0° |
| C12 | C13 | H12 | H13 | 120.1° | 120.1° |
| C13 | C12 | C16 | H20 | 61.9° | 60.0° |
| C13 | C12 | C16 | H21 | 178.2° | 179.9° |
| C12 | C13 | C18 | H24 | 178.8° | 180.0° |
| C18 | C13 | C12 | C16 | 58.2° | 60.0° |
| C18 | C13 | C12 | C11 | 61.6° | 60.1° |
| C13 | C18 | C17 | C19 | 119.3° | 120.0° |
| C13 | C18 | C17 | H24 | 120.1° | 120.0° |
| C13 | C18 | C19 | H24 | 120.1° | 120.0° |
| C13 | C18 | C17 | C15 | 60.7° | 59.9° |
| C13 | C18 | C19 | C10 | 60.2° | 60.0° |
| C18 | C13 | C12 | H11 | 178.8° | 180.0° |
| C18 | C13 | H12 | H13 | 120.1° | 119.9° |
| C13 | C18 | C17 | H22 | 179.2° | 60.0° |
| C13 | C18 | C17 | H23 | 59.5° | 179.9° |
| C13 | C18 | C19 | H25 | 59.7° | 180.0° |
| C13 | C18 | C19 | H26 | 179.7° | 60.0° |
| C16 | C12 | C11 | H11 | 119.3° | 120.0° |
| C12 | C16 | C15 | H20 | 120.1° | 120.0° |
| C12 | C16 | C15 | H21 | 120.0° | 120.0° |
| C12 | C16 | C15 | C17 | 58.1° | 60.0° |
| C12 | C16 | C15 | C14 | 61.3° | 60.0° |
| C16 | C12 | C11 | C10 | 59.7° | 60.0° |
| C16 | C12 | C11 | H5 | 60.4° | 180.0° |
| C16 | C12 | C11 | H6 | 179.8° | 60.0° |
| C16 | C12 | C13 | H12 | 178.2° | 180.0° |
| C16 | C12 | C13 | H13 | 61.8° | 60.0° |
| C12 | C16 | C15 | H19 | 178.7° | 180.0° |
| C12 | C16 | H20 | H21 | 119.8° | 120.0° |
| C11 | C12 | C16 | C15 | 61.6° | 60.0° |
| C12 | C11 | C10 | H5 | 120.1° | 120.0° |
| C12 | C11 | C10 | H6 | 120.1° | 120.1° |
| C12 | C11 | C10 | C19 | 60.5° | 60.0° |
| C12 | C11 | C10 | C14 | 59.0° | 60.0° |
| C12 | C11 | C10 | C9 | 178.2° | 180.0° |
| C12 | C11 | H5 | H6 | 119.8° | 120.1° |
| C11 | C12 | C13 | H12 | 58.3° | 60.0° |
| C11 | C12 | C13 | H13 | 178.4° | 180.0° |
| C11 | C12 | C16 | H20 | 178.4° | 180.0° |
| C11 | C12 | C16 | H21 | 58.5° | 60.0° |
| C16 | C15 | C17 | C18 | 60.4° | 60.0° |
| C16 | C15 | C17 | C14 | 118.6° | 120.0° |
| C16 | C15 | C17 | H19 | 120.6° | 120.0° |
| C16 | C15 | C14 | H19 | 120.1° | 120.0° |
| C16 | C15 | C14 | C10 | 60.1° | 60.0° |
| C16 | C15 | C14 | H1 | 179.8° | 60.0° |
| C16 | C15 | C14 | H2 | 59.9° | 180.0° |
| C15 | C16 | C12 | H11 | 178.9° | 180.0° |
| C15 | C16 | H20 | H21 | 119.8° | 120.0° |
| C16 | C15 | C17 | H22 | 179.5° | 60.0° |
| C16 | C15 | C17 | H23 | 59.8° | 180.0° |
| C17 | C18 | C19 | H24 | 120.6° | 120.0° |
| C18 | C17 | C15 | H22 | 120.2° | 120.0° |
| C18 | C17 | C15 | H23 | 120.2° | 120.0° |
| C18 | C17 | C15 | C14 | 58.2° | 60.0° |
| C17 | C18 | C19 | C10 | 59.1° | 60.0° |
| C17 | C18 | C13 | H12 | 178.7° | 180.0° |
| C17 | C18 | C13 | H13 | 61.3° | 60.1° |
| C18 | C17 | C15 | H19 | 179.0° | 180.0° |
| C18 | C17 | H22 | H23 | 119.5° | 120.0° |
| C17 | C18 | C19 | H25 | 179.1° | 60.0° |
| C17 | C18 | C19 | H26 | 60.9° | 180.0° |
| C19 | C18 | C17 | C15 | 58.6° | 60.0° |
| C18 | C19 | C10 | C11 | 59.5° | 60.0° |
| C18 | C19 | C10 | H25 | 120.0° | 120.0° |
| C18 | C19 | C10 | H26 | 120.0° | 120.0° |
| C18 | C19 | C10 | C14 | 60.0° | 60.0° |
| C18 | C19 | C10 | C9 | 178.9° | 180.0° |
| C19 | C18 | C13 | H12 | 58.9° | 60.0° |
| C19 | C18 | C13 | H13 | 178.9° | 179.9° |
| C19 | C18 | C17 | H22 | 61.6° | 180.0° |
| C19 | C18 | C17 | H23 | 178.8° | 60.0° |
| C18 | C19 | H25 | H26 | 120.0° | 120.0° |
| C17 | C15 | C14 | H19 | 120.8° | 119.9° |
| C17 | C15 | C14 | C10 | 58.9° | 60.0° |
| C17 | C15 | C14 | H1 | 61.2° | 179.9° |
| C17 | C15 | C14 | H2 | 178.9° | 60.0° |
| C17 | C15 | C16 | H20 | 62.0° | 60.0° |
| C17 | C15 | C16 | H21 | 178.1° | 180.0° |
| C15 | C17 | H22 | H23 | 119.4° | 120.1° |
| C15 | C17 | C18 | H24 | 179.2° | 180.0° |
| C15 | C14 | C10 | C11 | 58.9° | 60.0° |
| C15 | C14 | C10 | C19 | 60.0° | 60.0° |
| C15 | C14 | C10 | H1 | 120.1° | 120.0° |
| C15 | C14 | C10 | H2 | 120.0° | 120.0° |
| C15 | C14 | C10 | C9 | 177.6° | 180.0° |
| C15 | C14 | H1 | H2 | 119.8° | 120.0° |
| C14 | C15 | C16 | H20 | 178.7° | 180.0° |
| C14 | C15 | C16 | H21 | 58.8° | 60.0° |
| C14 | C15 | C17 | H22 | 61.9° | 180.0° |
| C14 | C15 | C17 | H23 | 178.4° | 59.9° |
| C11 | C10 | C19 | C14 | 119.5° | 120.0° |
| C11 | C10 | C19 | C9 | 119.4° | 120.0° |
| C11 | C10 | C14 | C9 | 118.6° | 120.0° |
| C11 | C10 | C9 | N2 | 176.6° | 180.0° |
| C11 | C10 | C14 | H1 | 179.0° | 60.0° |
| C11 | C10 | C14 | H2 | 61.1° | 180.0° |
| C10 | C11 | H5 | H6 | 119.8° | 120.0° |
| C11 | C10 | C9 | H9 | 63.2° | 60.0° |
| C11 | C10 | C9 | H10 | 56.3° | 60.0° |
| C10 | C11 | C12 | H11 | 179.0° | 179.9° |
| C11 | C10 | C19 | H25 | 60.4° | 180.0° |
| C11 | C10 | C19 | H26 | 179.5° | 60.0° |
| C19 | C10 | C14 | C9 | 122.5° | 120.0° |
| C19 | C10 | C9 | N2 | 57.1° | 60.0° |
| C19 | C10 | C14 | H1 | 60.1° | 180.0° |
| C19 | C10 | C14 | H2 | 180.0° | 60.0° |
| C19 | C10 | C11 | H5 | 179.5° | 60.0° |
| C19 | C10 | C11 | H6 | 59.6° | 180.0° |
| C19 | C10 | C9 | H9 | 177.4° | 180.0° |
| C19 | C10 | C9 | H10 | 63.1° | 60.0° |
| C10 | C19 | C18 | H24 | 179.7° | 180.0° |
| C10 | C19 | H25 | H26 | 120.0° | 120.0° |
| CL1 | C1 | C30 | C2 | 177.6° | 179.5° |
| CL1 | C1 | C30 | C29 | 179.5° | 179.6° |
| CL1 | C1 | C2 | C3 | 179.4° | 180.0° |
| CL1 | C1 | C2 | H18 | 0.7° | 0.1° |
| CL1 | C1 | C30 | H37 | 0.5° | 0.5° |
| C14 | C10 | C9 | N2 | 64.1° | 60.0° |
| C10 | C14 | H1 | H2 | 119.8° | 120.0° |
| C14 | C10 | C11 | H5 | 61.1° | 180.0° |
| C14 | C10 | C11 | H6 | 179.1° | 60.0° |
| C14 | C10 | C9 | H9 | 56.2° | 60.0° |
| C14 | C10 | C9 | H10 | 175.7° | 180.0° |
| C10 | C14 | C15 | H19 | 179.7° | 180.0° |
| C14 | C10 | C19 | H25 | 180.0° | 60.0° |
| C14 | C10 | C19 | H26 | 60.0° | 180.0° |
| C10 | C9 | N2 | H9 | 120.3° | 120.0° |
| C10 | C9 | N2 | H10 | 120.2° | 120.0° |
| C10 | C9 | N2 | C8 | 109.5° | 180.0° |
| C9 | C10 | C14 | H1 | 62.4° | 60.0° |
| C9 | C10 | C14 | H2 | 57.5° | 60.0° |
| C9 | C10 | C11 | H5 | 58.1° | 60.0° |
| C9 | C10 | C11 | H6 | 61.7° | 60.0° |
| C10 | C9 | H9 | H10 | 119.2° | 120.0° |
| C10 | C9 | N2 | H16 | 70.5° | 0.0° |
| C9 | C10 | C19 | H25 | 58.9° | 60.0° |
| C9 | C10 | C19 | H26 | 61.1° | 60.0° |
| C1 | C30 | C29 | H37 | 180.0° | 179.1° |
| C1 | C30 | C29 | C4 | 1.9° | 0.6° |
| C30 | C1 | C2 | C3 | 1.8° | 0.5° |
| C30 | C1 | C2 | H18 | 178.3° | 179.5° |
| C1 | C30 | C29 | H36 | 178.1° | 179.5° |
| C29 | C30 | C1 | C2 | 1.9° | 0.8° |
| C30 | C29 | C4 | H36 | 180.0° | 179.9° |
| C30 | C29 | C4 | C3 | 1.7° | 0.1° |
| C30 | C29 | C4 | C5 | 178.4° | 179.7° |
| C1 | C2 | C3 | H18 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 1.6° | 0.0° |
| C1 | C2 | C3 | H17 | 178.4° | 180.0° |
| C2 | C1 | C30 | H37 | 178.1° | 180.0° |
| C9 | N2 | C8 | H16 | 180.0° | 180.0° |
| C9 | N2 | C8 | O1 | 1.6° | 0.1° |
| C9 | N2 | C8 | C7 | 176.6° | 180.0° |
| N2 | C9 | H9 | H10 | 119.2° | 120.0° |
| C29 | C4 | C3 | C2 | 1.5° | 0.2° |
| C29 | C4 | C3 | C5 | 176.7° | 179.8° |
| C29 | C4 | C5 | N1 | 42.5° | 165.1° |
| C29 | C4 | C5 | C24 | 160.5° | 70.2° |
| C29 | C4 | C5 | H3 | 59.8° | 47.5° |
| C29 | C4 | C3 | H17 | 178.4° | 179.8° |
| C4 | C29 | C30 | H37 | 178.1° | 179.8° |
| N2 | C8 | O1 | C7 | 178.1° | 180.0° |
| N2 | C8 | C7 | C6 | 160.0° | 179.9° |
| N2 | C8 | C7 | H7 | 79.7° | 60.0° |
| N2 | C8 | C7 | H8 | 39.7° | 60.0° |
| C8 | N2 | C9 | H9 | 10.8° | 59.9° |
| C8 | N2 | C9 | H10 | 130.3° | 60.0° |
| C2 | C3 | C4 | H17 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 178.2° | 180.0° |
| C3 | C4 | C5 | N1 | 134.2° | 14.7° |
| C3 | C4 | C5 | C24 | 22.8° | 110.1° |
| C3 | C4 | C5 | H3 | 123.5° | 132.3° |
| C4 | C3 | C2 | H18 | 178.4° | 180.0° |
| C3 | C4 | C29 | H36 | 178.4° | 180.0° |
| C4 | C5 | N1 | C24 | 156.5° | 121.2° |
| C4 | C5 | N1 | H3 | 101.8° | 117.6° |
| C4 | C5 | N1 | C6 | 179.8° | 163.0° |
| C4 | C5 | C24 | H3 | 100.8° | 117.7° |
| C4 | C5 | C24 | C25 | 52.2° | 17.2° |
| C4 | C5 | C24 | C23 | 125.8° | 161.9° |
| C4 | C5 | N1 | H14 | 58.7° | 74.1° |
| C5 | C4 | C3 | H17 | 1.8° | 0.1° |
| C5 | C4 | C29 | H36 | 1.6° | 0.2° |
| O1 | C8 | C7 | C6 | 21.8° | 0.0° |
| O1 | C8 | C7 | H7 | 98.5° | 120.0° |
| O1 | C8 | C7 | H8 | 142.1° | 120.0° |
| O1 | C8 | N2 | H16 | 178.5° | 180.0° |
| C8 | C7 | C6 | N1 | 70.9° | 64.4° |
| C8 | C7 | C6 | H7 | 120.3° | 120.0° |
| C8 | C7 | C6 | H8 | 120.3° | 119.9° |
| C8 | C7 | C6 | C20 | 173.7° | 172.3° |
| C8 | C7 | C6 | H4 | 49.0° | 54.0° |
| C8 | C7 | H7 | H8 | 119.2° | 120.0° |
| C7 | C8 | N2 | H16 | 3.3° | 0.0° |
| C5 | N1 | C6 | H14 | 121.5° | 122.8° |
| N1 | C5 | C24 | H3 | 102.3° | 121.1° |
| C5 | N1 | C6 | C7 | 155.6° | 79.4° |
| C5 | N1 | C6 | C20 | 82.6° | 41.4° |
| N1 | C5 | C24 | C25 | 150.8° | 104.1° |
| N1 | C5 | C24 | C23 | 31.2° | 76.8° |
| C5 | N1 | C6 | H4 | 36.1° | 162.3° |
| C6 | N1 | C5 | C24 | 23.3° | 41.8° |
| N1 | C6 | C7 | C20 | 115.3° | 123.3° |
| N1 | C6 | C7 | H4 | 119.9° | 118.3° |
| N1 | C6 | C20 | H4 | 118.7° | 120.9° |
| N1 | C6 | C20 | N3 | 109.6° | 103.8° |
| N1 | C6 | C20 | N5 | 65.5° | 76.9° |
| C6 | N1 | C5 | H3 | 78.4° | 79.3° |
| N1 | C6 | C7 | H7 | 168.8° | 55.7° |
| N1 | C6 | C7 | H8 | 49.3° | 175.7° |
| C5 | C24 | C25 | C26 | 3.0° | 4.2° |
| C5 | C24 | C25 | C23 | 178.4° | 179.2° |
| C5 | C24 | C25 | C27 | 178.2° | 175.8° |
| C5 | C24 | C23 | N5 | 6.0° | 5.1° |
| C5 | C24 | C23 | S1 | 179.3° | 175.1° |
| C24 | C5 | N1 | H14 | 144.7° | 164.7° |
| C7 | C6 | C20 | H4 | 124.5° | 118.3° |
| C7 | C6 | C20 | N3 | 7.1° | 135.4° |
| C7 | C6 | C20 | N5 | 177.8° | 44.0° |
| C6 | C7 | H7 | H8 | 119.1° | 120.0° |
| C7 | C6 | N1 | H14 | 34.2° | 157.8° |
| C6 | C20 | N3 | N5 | 175.8° | 179.4° |
| C6 | C20 | N3 | N4 | 178.2° | 176.7° |
| C6 | C20 | N5 | C23 | 6.4° | 6.0° |
| C6 | C20 | N5 | C21 | 178.3° | 176.1° |
| C20 | C6 | C7 | H7 | 53.4° | 67.7° |
| C20 | C6 | C7 | H8 | 66.0° | 52.4° |
| C20 | C6 | N1 | H14 | 156.0° | 81.4° |
| C26 | C25 | C24 | C27 | 178.7° | 180.0° |
| C26 | C25 | C24 | C23 | 178.5° | 176.6° |
| C26 | C25 | C27 | C28 | 2.6° | 0.9° |
| C26 | C25 | C27 | S1 | 177.4° | 179.1° |
| C25 | C26 | H30 | H31 | 120.0° | 120.0° |
| C25 | C26 | H30 | H32 | 120.0° | 120.0° |
| C25 | C26 | H31 | H32 | 120.0° | 120.0° |
| C25 | C24 | C23 | N5 | 175.7° | 175.7° |
| C25 | C24 | C23 | S1 | 0.9° | 4.2° |
| C24 | C25 | C27 | C28 | 178.6° | 179.1° |
| C24 | C25 | C27 | S1 | 1.3° | 0.9° |
| C25 | C24 | C5 | H3 | 48.6° | 134.9° |
| C24 | C25 | C26 | H30 | 89.2° | 82.2° |
| C24 | C25 | C26 | H31 | 150.7° | 157.8° |
| C24 | C25 | C26 | H32 | 30.7° | 37.8° |
| C24 | C23 | N5 | C20 | 37.5° | 41.9° |
| C23 | C24 | C25 | C27 | 0.2° | 3.4° |
| C24 | C23 | N5 | S1 | 174.5° | 179.8° |
| C24 | C23 | N5 | C21 | 148.1° | 135.3° |
| C24 | C23 | S1 | C27 | 1.4° | 3.1° |
| C23 | C24 | C5 | H3 | 133.4° | 44.3° |
| N3 | C20 | N5 | C23 | 177.7° | 174.5° |
| N3 | C20 | N5 | C21 | 2.4° | 3.4° |
| C20 | N3 | N4 | C21 | 1.5° | 1.1° |
| N3 | C20 | C6 | H4 | 131.6° | 17.1° |
| N5 | C20 | N3 | N4 | 2.4° | 2.8° |
| C20 | N5 | C23 | C21 | 174.4° | 177.2° |
| C20 | N5 | C23 | S1 | 137.0° | 137.9° |
| C20 | N5 | C21 | N4 | 1.4° | 2.8° |
| C20 | N5 | C21 | C22 | 178.6° | 177.1° |
| N5 | C20 | C6 | H4 | 53.3° | 162.2° |
| C25 | C27 | S1 | C23 | 1.6° | 1.3° |
| C25 | C27 | C28 | S1 | 179.9° | 180.0° |
| C27 | C25 | C26 | H30 | 89.3° | 97.8° |
| C27 | C25 | C26 | H31 | 30.8° | 22.2° |
| C27 | C25 | C26 | H32 | 150.8° | 142.2° |
| C25 | C27 | C28 | H33 | 179.9° | 90.0° |
| C25 | C27 | C28 | H34 | 59.9° | 150.0° |
| C25 | C27 | C28 | H35 | 60.1° | 30.0° |
| N3 | N4 | C21 | N5 | 0.1° | 1.1° |
| N3 | N4 | C21 | C22 | 179.9° | 178.7° |
| C23 | N5 | C21 | N4 | 176.4° | 174.7° |
| N5 | C23 | S1 | C27 | 175.9° | 176.7° |
| C23 | N5 | C21 | C22 | 3.5° | 5.5° |
| C21 | N5 | C23 | S1 | 37.4° | 44.9° |
| N5 | C21 | N4 | C22 | 180.0° | 179.9° |
| N5 | C21 | C22 | H27 | 180.0° | 89.8° |
| N5 | C21 | C22 | H28 | 60.0° | 30.1° |
| N5 | C21 | C22 | H29 | 60.0° | 150.1° |
| C23 | S1 | C27 | C28 | 178.4° | 178.7° |
| N4 | C21 | C22 | H27 | 0.0° | 90.0° |
| N4 | C21 | C22 | H28 | 120.0° | 150.1° |
| N4 | C21 | C22 | H29 | 120.0° | 30.1° |
| C27 | C28 | H33 | H34 | 120.0° | 120.0° |
| C27 | C28 | H33 | H35 | 120.0° | 120.1° |
| C27 | C28 | H34 | H35 | 120.0° | 120.1° |
| S1 | C27 | C28 | H33 | 0.0° | 90.0° |
| S1 | C27 | C28 | H34 | 120.0° | 30.0° |
| S1 | C27 | C28 | H35 | 120.0° | 150.0° |
| C21 | C22 | H27 | H28 | 120.0° | 120.0° |
| C21 | C22 | H27 | H29 | 120.0° | 120.1° |
| C21 | C22 | H28 | H29 | 120.0° | 120.0° |
| H1 | C14 | C15 | H19 | 59.7° | 60.0° |
| H2 | C14 | C15 | H19 | 60.2° | 60.0° |
| H3 | C5 | N1 | H14 | 43.0° | 43.5° |
| H4 | C6 | C7 | H7 | 71.3° | 174.0° |
| H4 | C6 | C7 | H8 | 169.3° | 65.9° |
| H4 | C6 | N1 | H14 | 85.4° | 39.5° |
| H5 | C11 | C12 | H11 | 58.9° | 60.0° |
| H6 | C11 | C12 | H11 | 60.9° | 60.0° |
| H9 | C9 | N2 | H16 | 169.2° | 120.0° |
| H10 | C9 | N2 | H16 | 49.7° | 120.0° |
| H11 | C12 | C13 | H12 | 61.3° | 60.0° |
| H11 | C12 | C13 | H13 | 58.8° | 60.0° |
| H11 | C12 | C16 | H20 | 58.8° | 60.0° |
| H11 | C12 | C16 | H21 | 61.0° | 60.0° |
| H12 | C13 | C18 | H24 | 61.2° | 59.9° |
| H13 | C13 | C18 | H24 | 58.9° | 60.0° |
| H17 | C3 | C2 | H18 | 1.6° | 0.0° |
| H19 | C15 | C16 | H20 | 58.7° | 60.0° |
| H19 | C15 | C16 | H21 | 61.2° | 60.0° |
| H19 | C15 | C17 | H22 | 58.8° | 60.0° |
| H19 | C15 | C17 | H23 | 60.8° | 60.0° |
| H22 | C17 | C18 | H24 | 59.1° | 60.0° |
| H23 | C17 | C18 | H24 | 60.6° | 60.0° |
| H24 | C18 | C19 | H25 | 60.3° | 60.1° |
| H24 | C18 | C19 | H26 | 59.7° | 60.0° |
| H27 | C22 | H28 | H29 | 120.0° | 120.0° |
| H30 | C26 | H31 | H32 | 120.0° | 120.0° |
| H33 | C28 | H34 | H35 | 120.0° | 119.9° |
| H36 | C29 | C30 | H37 | 1.9° | 0.3° |
