JW0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C5 | sing | 1.53Å | 1.55Å | |
| C1 | C6 | sing | 1.53Å | 1.58Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| O5 | P1 | doub | 1.48Å | 1.51Å | |
| C6 | C5 | sing | 1.53Å | 1.47Å | |
| O1 | C13 | sing | 1.43Å | 1.36Å | |
| C14 | C13 | sing | 1.54Å | 1.54Å | |
| C14 | C10 | sing | 1.52Å | 1.46Å | |
| C5 | C10 | sing | 1.53Å | 1.60Å | |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.55Å | |
| C2 | O4 | sing | 1.43Å | 1.40Å | |
| C13 | C12 | sing | 1.52Å | 1.53Å | |
| C10 | C9 | sing | 1.54Å | 1.49Å | |
| P1 | O7 | sing | 1.61Å | 1.51Å | |
| P1 | O4 | sing | 1.61Å | 1.70Å | |
| P1 | O6 | sing | 1.61Å | 1.51Å | |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| C21 | C18 | sing | 1.53Å | 1.52Å | |
| C4 | C7 | sing | 1.53Å | 1.54Å | |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| C18 | C19 | sing | 1.53Å | 1.52Å | |
| C12 | C17 | sing | 1.53Å | 1.47Å | |
| C12 | C11 | sing | 1.55Å | 1.51Å | |
| C12 | C22 | sing | 1.53Å | 1.54Å | |
| C17 | C16 | sing | 1.56Å | 1.53Å | |
| C9 | C11 | sing | 1.52Å | 1.50Å | |
| C9 | C8 | sing | 1.53Å | 1.54Å | |
| C11 | C15 | sing | 1.53Å | 1.55Å | |
| C7 | C8 | sing | 1.53Å | 1.49Å | |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| C20 | C24 | sing | 1.51Å | 1.52Å | |
| O2 | C24 | doub | 1.21Å | 1.26Å | |
| C24 | O3 | sing | 1.34Å | 1.24Å | |
| C16 | C15 | sing | 1.55Å | 1.61Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| O3 | H6 | sing | 0.97Å | 0.95Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | 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 | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C23 | H32 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| C7 | H34 | sing | 1.09Å | 1.10Å | |
| C7 | H35 | sing | 1.09Å | 1.10Å | |
| C8 | H36 | sing | 1.09Å | 1.10Å | |
| C8 | H37 | sing | 1.09Å | 1.10Å | |
| C9 | H38 | sing | 1.09Å | 1.10Å | |
| O1 | H39 | sing | 0.97Å | 0.95Å | |
| O6 | H40 | sing | 0.97Å | 0.95Å | |
| O7 | H41 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C5 | C6 | 109.0° | 109.7° |
| C23 | C5 | C10 | 107.5° | 109.5° |
| C23 | C5 | C4 | 109.3° | 109.5° |
| C5 | C23 | H31 | 109.5° | 109.4° |
| C5 | C23 | H32 | 109.5° | 109.5° |
| C5 | C23 | H33 | 109.5° | 109.5° |
| C6 | C1 | C2 | 107.6° | 109.4° |
| C1 | C6 | C5 | 112.6° | 109.4° |
| C6 | C1 | H1 | 110.0° | 109.5° |
| C6 | C1 | H2 | 110.0° | 109.5° |
| C1 | C6 | H8 | 108.7° | 109.5° |
| C1 | C6 | H9 | 108.7° | 109.5° |
| C1 | C2 | C3 | 108.6° | 109.5° |
| C1 | C2 | O4 | 108.7° | 109.5° |
| C2 | C1 | H1 | 109.9° | 109.4° |
| C2 | C1 | H2 | 109.9° | 109.5° |
| C1 | C2 | H3 | 109.9° | 109.4° |
| O5 | P1 | O7 | 109.0° | 109.5° |
| O5 | P1 | O4 | 111.7° | 109.5° |
| O5 | P1 | O6 | 108.2° | 109.5° |
| C6 | C5 | C10 | 108.2° | 109.4° |
| C6 | C5 | C4 | 109.2° | 109.3° |
| C5 | C6 | H8 | 108.7° | 109.4° |
| C5 | C6 | H9 | 108.7° | 109.5° |
| O1 | C13 | C14 | 108.3° | 109.9° |
| O1 | C13 | C12 | 105.4° | 109.9° |
| O1 | C13 | H12 | 113.4° | 109.9° |
| C13 | O1 | H39 | 109.5° | 114.0° |
| C13 | C14 | C10 | 113.2° | 111.3° |
| C14 | C13 | C12 | 108.4° | 107.3° |
| C14 | C13 | H12 | 110.5° | 109.8° |
| C13 | C14 | H13 | 108.5° | 109.1° |
| C13 | C14 | H14 | 108.5° | 109.1° |
| C14 | C10 | C5 | 110.2° | 110.0° |
| C14 | C10 | C9 | 107.5° | 111.6° |
| C14 | C10 | H10 | 109.7° | 108.2° |
| C10 | C14 | H13 | 108.5° | 109.1° |
| C10 | C14 | H14 | 108.5° | 109.1° |
| C10 | C5 | C4 | 113.5° | 109.3° |
| C5 | C10 | C9 | 112.4° | 109.3° |
| C5 | C10 | H10 | 107.8° | 108.8° |
| C5 | C4 | C3 | 111.9° | 109.3° |
| C5 | C4 | C7 | 112.5° | 109.4° |
| C5 | C4 | H7 | 107.3° | 109.7° |
| C3 | C2 | O4 | 108.0° | 109.5° |
| C2 | C3 | C4 | 115.1° | 109.5° |
| C3 | C2 | H3 | 109.7° | 109.5° |
| C2 | C3 | H4 | 108.0° | 109.5° |
| C2 | C3 | H5 | 108.0° | 109.5° |
| C2 | O4 | P1 | 124.2° | 123.0° |
| O4 | C2 | H3 | 111.9° | 109.4° |
| C13 | C12 | C17 | 113.7° | 116.5° |
| C13 | C12 | C11 | 111.2° | 107.5° |
| C13 | C12 | C22 | 113.5° | 109.7° |
| C12 | C13 | H12 | 110.7° | 109.9° |
| C10 | C9 | C11 | 102.0° | 107.2° |
| C10 | C9 | C8 | 107.5° | 109.2° |
| C9 | C10 | H10 | 109.2° | 108.8° |
| C10 | C9 | H38 | 112.7° | 109.7° |
| O7 | P1 | O4 | 110.4° | 109.5° |
| O7 | P1 | O6 | 109.1° | 109.4° |
| P1 | O7 | H41 | 109.5° | 114.0° |
| O4 | P1 | O6 | 108.4° | 109.5° |
| P1 | O6 | H40 | 109.5° | 114.0° |
| C3 | C4 | C7 | 110.6° | 109.4° |
| C4 | C3 | H4 | 108.0° | 109.5° |
| C4 | C3 | H5 | 108.0° | 109.5° |
| C3 | C4 | H7 | 107.0° | 109.5° |
| C21 | C18 | C17 | 108.2° | 109.5° |
| C21 | C18 | C19 | 109.4° | 109.5° |
| C21 | C18 | H20 | 109.6° | 109.5° |
| C18 | C21 | H25 | 109.5° | 109.5° |
| C18 | C21 | H26 | 109.5° | 109.4° |
| C18 | C21 | H27 | 109.5° | 109.5° |
| C4 | C7 | C8 | 114.6° | 109.5° |
| C7 | C4 | H7 | 107.1° | 109.6° |
| C4 | C7 | H34 | 108.2° | 109.5° |
| C4 | C7 | H35 | 108.2° | 109.5° |
| C17 | C18 | C19 | 110.7° | 109.5° |
| C18 | C17 | C12 | 110.3° | 110.3° |
| C18 | C17 | C16 | 112.7° | 110.8° |
| C18 | C17 | H19 | 110.7° | 110.3° |
| C17 | C18 | H20 | 109.3° | 109.5° |
| C18 | C19 | C20 | 110.8° | 109.5° |
| C19 | C18 | H20 | 109.6° | 109.5° |
| C18 | C19 | H21 | 109.1° | 109.4° |
| C18 | C19 | H22 | 109.2° | 109.5° |
| C17 | C12 | C11 | 101.0° | 103.3° |
| C17 | C12 | C22 | 110.7° | 109.7° |
| C12 | C17 | C16 | 100.2° | 105.4° |
| C12 | C17 | H19 | 111.7° | 110.3° |
| C11 | C12 | C22 | 105.8° | 109.7° |
| C12 | C11 | C9 | 108.8° | 107.0° |
| C12 | C11 | C15 | 100.2° | 101.7° |
| C12 | C11 | H11 | 110.8° | 111.2° |
| C12 | C22 | H28 | 109.5° | 109.5° |
| C12 | C22 | H29 | 109.5° | 109.5° |
| C12 | C22 | H30 | 109.5° | 109.5° |
| C17 | C16 | C15 | 105.5° | 106.0° |
| C17 | C16 | H17 | 110.4° | 109.3° |
| C17 | C16 | H18 | 110.4° | 111.3° |
| C16 | C17 | H19 | 110.9° | 109.6° |
| C11 | C9 | C8 | 109.7° | 110.4° |
| C9 | C11 | C15 | 115.3° | 115.9° |
| C9 | C11 | H11 | 110.9° | 110.3° |
| C11 | C9 | H38 | 112.5° | 109.7° |
| C9 | C8 | C7 | 113.1° | 109.5° |
| C9 | C8 | H36 | 108.5° | 109.5° |
| C9 | C8 | H37 | 108.5° | 109.5° |
| C8 | C9 | H38 | 111.8° | 110.5° |
| C11 | C15 | C16 | 100.2° | 102.9° |
| C15 | C11 | H11 | 110.3° | 110.4° |
| C11 | C15 | H15 | 111.7° | 110.7° |
| C11 | C15 | H16 | 111.7° | 110.7° |
| C8 | C7 | H34 | 108.2° | 109.4° |
| C8 | C7 | H35 | 108.2° | 109.5° |
| C7 | C8 | H36 | 108.6° | 109.5° |
| C7 | C8 | H37 | 108.6° | 109.4° |
| C19 | C20 | C24 | 109.4° | 109.5° |
| C20 | C19 | H21 | 109.1° | 109.5° |
| C20 | C19 | H22 | 109.1° | 109.5° |
| C19 | C20 | H23 | 109.5° | 109.5° |
| C19 | C20 | H24 | 109.5° | 109.4° |
| C20 | C24 | O2 | 119.6° | 120.0° |
| C20 | C24 | O3 | 120.3° | 120.0° |
| C24 | C20 | H23 | 109.5° | 109.5° |
| C24 | C20 | H24 | 109.5° | 109.5° |
| O2 | C24 | O3 | 120.2° | 120.0° |
| C24 | O3 | H6 | 109.5° | 117.0° |
| C16 | C15 | H15 | 111.7° | 110.7° |
| C16 | C15 | H16 | 111.7° | 110.9° |
| C15 | C16 | H17 | 110.5° | 110.1° |
| C15 | C16 | H18 | 110.5° | 110.1° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H4 | C3 | H5 | 109.5° | 109.4° |
| H8 | C6 | H9 | 109.5° | 109.5° |
| H13 | C14 | H14 | 109.4° | 109.1° |
| H15 | C15 | H16 | 109.5° | 110.6° |
| H17 | C16 | H18 | 109.5° | 110.0° |
| H21 | C19 | H22 | 109.5° | 109.5° |
| H23 | C20 | H24 | 109.5° | 109.5° |
| H25 | C21 | H26 | 109.4° | 109.5° |
| H25 | C21 | H27 | 109.5° | 109.5° |
| H26 | C21 | H27 | 109.5° | 109.5° |
| H28 | C22 | H29 | 109.5° | 109.4° |
| H28 | C22 | H30 | 109.5° | 109.5° |
| H29 | C22 | H30 | 109.4° | 109.5° |
| H31 | C23 | H32 | 109.5° | 109.5° |
| H31 | C23 | H33 | 109.5° | 109.5° |
| H32 | C23 | H33 | 109.4° | 109.5° |
| H34 | C7 | H35 | 109.5° | 109.4° |
| H36 | C8 | H37 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C5 | C6 | C1 | 58.3° | 179.5° |
| C23 | C5 | C6 | C10 | 116.6° | 120.2° |
| C23 | C5 | C6 | C4 | 119.4° | 120.1° |
| C23 | C5 | C10 | C14 | 4.1° | 63.3° |
| C23 | C5 | C10 | C4 | 121.0° | 120.0° |
| C23 | C5 | C10 | C9 | 124.0° | 59.5° |
| C23 | C5 | C4 | C3 | 67.2° | 179.4° |
| C23 | C5 | C4 | C7 | 167.5° | 59.7° |
| C23 | C5 | C4 | H7 | 49.9° | 60.5° |
| C23 | C5 | C6 | H8 | 178.8° | 59.5° |
| C23 | C5 | C6 | H9 | 62.2° | 60.5° |
| C23 | C5 | C10 | H10 | 115.6° | 178.2° |
| C5 | C23 | H31 | H32 | 120.0° | 120.0° |
| C5 | C23 | H31 | H33 | 120.0° | 120.0° |
| C5 | C23 | H32 | H33 | 120.0° | 120.0° |
| C6 | C1 | C2 | H1 | 119.7° | 120.0° |
| C6 | C1 | C2 | H2 | 119.7° | 120.0° |
| C1 | C6 | C5 | H8 | 120.5° | 119.9° |
| C1 | C6 | C5 | H9 | 120.5° | 120.0° |
| C1 | C6 | C5 | C10 | 174.9° | 59.3° |
| C1 | C6 | C5 | C4 | 61.1° | 60.4° |
| C6 | C1 | C2 | C3 | 56.5° | 59.9° |
| C6 | C1 | C2 | O4 | 60.7° | 179.9° |
| C6 | C1 | H1 | H2 | 120.9° | 120.0° |
| C6 | C1 | C2 | H3 | 176.5° | 60.1° |
| C1 | C6 | H8 | H9 | 118.6° | 120.1° |
| C2 | C1 | C6 | C5 | 64.7° | 60.2° |
| C1 | C2 | C3 | O4 | 117.7° | 120.0° |
| C1 | C2 | C3 | H3 | 120.1° | 120.0° |
| C1 | C2 | O4 | H3 | 121.6° | 119.9° |
| C1 | C2 | O4 | P1 | 43.9° | 120.0° |
| C1 | C2 | C3 | C4 | 52.5° | 59.9° |
| C2 | C1 | H1 | H2 | 120.8° | 120.0° |
| C1 | C2 | C3 | H4 | 68.3° | 179.9° |
| C1 | C2 | C3 | H5 | 173.3° | 60.1° |
| C2 | C1 | C6 | H8 | 55.7° | 179.9° |
| C2 | C1 | C6 | H9 | 174.8° | 59.8° |
| O5 | P1 | O4 | C2 | 20.0° | 55.0° |
| O5 | P1 | O7 | O4 | 123.0° | 120.0° |
| O5 | P1 | O7 | O6 | 118.0° | 120.0° |
| O5 | P1 | O4 | O6 | 119.1° | 120.0° |
| O5 | P1 | O6 | H40 | 0.0° | 60.0° |
| O5 | P1 | O7 | H41 | 0.0° | 180.0° |
| C6 | C5 | C10 | C14 | 121.7° | 57.0° |
| C6 | C5 | C10 | C4 | 121.4° | 119.7° |
| C6 | C5 | C10 | C9 | 118.5° | 179.9° |
| C6 | C5 | C4 | C3 | 51.9° | 60.3° |
| C6 | C5 | C4 | C7 | 73.3° | 179.9° |
| C5 | C6 | C1 | H1 | 55.0° | 59.8° |
| C5 | C6 | C1 | H2 | 175.6° | 179.8° |
| C6 | C5 | C4 | H7 | 169.1° | 59.8° |
| C5 | C6 | H8 | H9 | 118.6° | 120.0° |
| C6 | C5 | C10 | H10 | 2.0° | 61.4° |
| C6 | C5 | C23 | H31 | 180.0° | 60.1° |
| C6 | C5 | C23 | H32 | 60.0° | 59.8° |
| C6 | C5 | C23 | H33 | 60.0° | 179.8° |
| O1 | C13 | C14 | C12 | 113.8° | 119.5° |
| O1 | C13 | C14 | H12 | 124.8° | 121.1° |
| O1 | C13 | C14 | C10 | 64.1° | 62.1° |
| O1 | C13 | C12 | H12 | 123.0° | 121.1° |
| O1 | C13 | C12 | C17 | 44.3° | 60.0° |
| O1 | C13 | C12 | C11 | 68.8° | 55.2° |
| O1 | C13 | C12 | C22 | 172.1° | 174.5° |
| O1 | C13 | C14 | H13 | 175.3° | 58.4° |
| O1 | C13 | C14 | H14 | 56.4° | 177.5° |
| C13 | C14 | C10 | H13 | 120.6° | 120.5° |
| C13 | C14 | C10 | H14 | 120.6° | 120.4° |
| C13 | C14 | C10 | C5 | 172.9° | 176.4° |
| C14 | C13 | C12 | H12 | 121.3° | 119.4° |
| C13 | C14 | C10 | C9 | 64.3° | 55.0° |
| C14 | C13 | C12 | C17 | 160.0° | 179.5° |
| C14 | C13 | C12 | C11 | 46.9° | 64.3° |
| C14 | C13 | C12 | C22 | 72.2° | 55.0° |
| C13 | C14 | C10 | H10 | 54.4° | 64.8° |
| C13 | C14 | H13 | H14 | 118.3° | 119.1° |
| C14 | C13 | O1 | H39 | 180.0° | 62.1° |
| C14 | C10 | C5 | C9 | 119.9° | 122.8° |
| C14 | C10 | C5 | H10 | 119.7° | 118.4° |
| C14 | C10 | C5 | C4 | 116.9° | 176.7° |
| C10 | C14 | C13 | C12 | 49.7° | 57.4° |
| C14 | C10 | C9 | H10 | 118.9° | 119.4° |
| C14 | C10 | C9 | C11 | 72.1° | 58.1° |
| C14 | C10 | C9 | C8 | 172.5° | 177.7° |
| C10 | C14 | C13 | H12 | 171.1° | 176.8° |
| C10 | C14 | H13 | H14 | 118.3° | 119.1° |
| C14 | C10 | C9 | H38 | 48.8° | 61.0° |
| C5 | C10 | C9 | H10 | 119.6° | 118.7° |
| C10 | C5 | C4 | C3 | 172.8° | 59.4° |
| C10 | C5 | C4 | C7 | 47.5° | 60.3° |
| C5 | C10 | C9 | C11 | 166.5° | 180.0° |
| C5 | C10 | C9 | C8 | 51.1° | 60.4° |
| C10 | C5 | C4 | H7 | 70.1° | 179.5° |
| C10 | C5 | C6 | H8 | 64.6° | 60.7° |
| C10 | C5 | C6 | H9 | 54.4° | 179.3° |
| C5 | C10 | C14 | H13 | 66.5° | 63.1° |
| C5 | C10 | C14 | H14 | 52.3° | 56.0° |
| C10 | C5 | C23 | H31 | 62.9° | 60.0° |
| C10 | C5 | C23 | H32 | 57.1° | 180.0° |
| C10 | C5 | C23 | H33 | 177.0° | 60.0° |
| C5 | C10 | C9 | H38 | 72.6° | 60.9° |
| C5 | C4 | C3 | C2 | 49.7° | 60.1° |
| C4 | C5 | C10 | C9 | 3.0° | 60.5° |
| C5 | C4 | C3 | C7 | 126.3° | 119.7° |
| C5 | C4 | C3 | H7 | 117.3° | 120.2° |
| C5 | C4 | C7 | H7 | 117.7° | 120.2° |
| C5 | C4 | C7 | C8 | 35.2° | 60.0° |
| C5 | C4 | C3 | H4 | 71.2° | 179.9° |
| C5 | C4 | C3 | H5 | 170.5° | 59.9° |
| C4 | C5 | C6 | H8 | 59.4° | 179.6° |
| C4 | C5 | C6 | H9 | 178.5° | 59.6° |
| C4 | C5 | C10 | H10 | 123.4° | 58.3° |
| C4 | C5 | C23 | H31 | 60.7° | 179.9° |
| C4 | C5 | C23 | H32 | 179.3° | 60.1° |
| C4 | C5 | C23 | H33 | 59.4° | 59.9° |
| C5 | C4 | C7 | H34 | 155.9° | 60.0° |
| C5 | C4 | C7 | H35 | 85.6° | 179.9° |
| C3 | C2 | O4 | H3 | 120.8° | 120.0° |
| C3 | C2 | O4 | P1 | 161.5° | 119.9° |
| C2 | C3 | C4 | H4 | 120.8° | 120.0° |
| C2 | C3 | C4 | H5 | 120.8° | 120.0° |
| C2 | C3 | C4 | C7 | 76.7° | 179.9° |
| C3 | C2 | C1 | H1 | 63.2° | 60.1° |
| C3 | C2 | C1 | H2 | 176.2° | 179.9° |
| C2 | C3 | H4 | H5 | 117.4° | 120.0° |
| C2 | C3 | C4 | H7 | 167.0° | 60.0° |
| C2 | O4 | P1 | O7 | 101.4° | 65.1° |
| C2 | O4 | P1 | O6 | 139.1° | 175.0° |
| O4 | C2 | C3 | C4 | 65.2° | 179.9° |
| O4 | C2 | C1 | H1 | 179.6° | 59.9° |
| O4 | C2 | C1 | H2 | 59.0° | 60.1° |
| O4 | C2 | C3 | H4 | 174.0° | 60.1° |
| O4 | C2 | C3 | H5 | 55.6° | 59.9° |
| C13 | C12 | C17 | C18 | 69.1° | 94.3° |
| C13 | C12 | C17 | C11 | 119.1° | 117.6° |
| C13 | C12 | C17 | C22 | 129.2° | 125.5° |
| C13 | C12 | C11 | C22 | 123.7° | 119.3° |
| C13 | C12 | C17 | C16 | 171.9° | 146.0° |
| C13 | C12 | C11 | C9 | 61.0° | 69.9° |
| C13 | C12 | C11 | C15 | 177.6° | 168.1° |
| C13 | C12 | C11 | H11 | 61.2° | 50.6° |
| C12 | C13 | C14 | H13 | 70.9° | 177.9° |
| C12 | C13 | C14 | H14 | 170.2° | 63.1° |
| C13 | C12 | C17 | H19 | 54.5° | 27.8° |
| C13 | C12 | C22 | H28 | 180.0° | 64.0° |
| C13 | C12 | C22 | H29 | 60.0° | 55.9° |
| C13 | C12 | C22 | H30 | 60.0° | 176.0° |
| C12 | C13 | O1 | H39 | 64.2° | 180.0° |
| C10 | C9 | C11 | C12 | 71.1° | 64.6° |
| C10 | C9 | C11 | C8 | 113.8° | 118.8° |
| C10 | C9 | C11 | H38 | 121.0° | 119.1° |
| C10 | C9 | C8 | H38 | 124.2° | 120.8° |
| C10 | C9 | C11 | C15 | 177.3° | 177.2° |
| C10 | C9 | C8 | C7 | 65.7° | 60.2° |
| C10 | C9 | C11 | H11 | 51.0° | 56.5° |
| C9 | C10 | C14 | H13 | 56.3° | 175.4° |
| C9 | C10 | C14 | H14 | 175.1° | 65.5° |
| C10 | C9 | C8 | H36 | 54.8° | 179.8° |
| C10 | C9 | C8 | H37 | 173.7° | 59.8° |
| O7 | P1 | O4 | O6 | 119.4° | 119.9° |
| O7 | P1 | O6 | H40 | 118.4° | 60.0° |
| P1 | O4 | C2 | H3 | 77.7° | 0.1° |
| O4 | P1 | O6 | H40 | 121.3° | 180.0° |
| O4 | P1 | O7 | H41 | 123.1° | 60.0° |
| O6 | P1 | O7 | H41 | 117.9° | 60.0° |
| C3 | C4 | C7 | H7 | 116.3° | 120.1° |
| C3 | C4 | C7 | C8 | 161.2° | 59.6° |
| C4 | C3 | C2 | H3 | 172.6° | 60.1° |
| C4 | C3 | H4 | H5 | 117.4° | 120.0° |
| C3 | C4 | C7 | H34 | 78.1° | 179.6° |
| C3 | C4 | C7 | H35 | 40.4° | 60.4° |
| C21 | C18 | C17 | C19 | 119.9° | 120.0° |
| C21 | C18 | C17 | H20 | 119.3° | 120.0° |
| C21 | C18 | C19 | H20 | 120.1° | 120.0° |
| C21 | C18 | C17 | C12 | 130.5° | 66.2° |
| C21 | C18 | C17 | C16 | 118.4° | 177.4° |
| C21 | C18 | C19 | C20 | 37.8° | 65.0° |
| C21 | C18 | C17 | H19 | 6.3° | 55.9° |
| C21 | C18 | C19 | H21 | 158.0° | 175.0° |
| C21 | C18 | C19 | H22 | 82.4° | 55.1° |
| C18 | C21 | H25 | H26 | 120.0° | 119.9° |
| C18 | C21 | H25 | H27 | 120.0° | 120.0° |
| C18 | C21 | H26 | H27 | 120.0° | 120.0° |
| C4 | C7 | C8 | C9 | 20.7° | 60.1° |
| C4 | C7 | C8 | H34 | 120.8° | 120.0° |
| C4 | C7 | C8 | H35 | 120.8° | 120.1° |
| C7 | C4 | C3 | H4 | 162.5° | 60.1° |
| C7 | C4 | C3 | H5 | 44.2° | 59.8° |
| C4 | C7 | H34 | H35 | 117.6° | 120.0° |
| C4 | C7 | C8 | H36 | 99.8° | 179.8° |
| C4 | C7 | C8 | H37 | 141.2° | 59.9° |
| C17 | C18 | C19 | H20 | 120.7° | 120.0° |
| C18 | C17 | C12 | C16 | 119.0° | 119.7° |
| C18 | C17 | C12 | H19 | 123.6° | 122.1° |
| C18 | C17 | C12 | C11 | 171.8° | 148.2° |
| C18 | C17 | C12 | C22 | 60.1° | 31.2° |
| C18 | C17 | C16 | H19 | 124.6° | 122.0° |
| C17 | C18 | C19 | C20 | 157.0° | 175.0° |
| C18 | C17 | C16 | C15 | 146.2° | 121.6° |
| C18 | C17 | C16 | H17 | 94.4° | 3.0° |
| C18 | C17 | C16 | H18 | 26.9° | 118.7° |
| C17 | C18 | C19 | H21 | 82.8° | 55.0° |
| C17 | C18 | C19 | H22 | 36.8° | 64.9° |
| C17 | C18 | C21 | H25 | 180.0° | 59.8° |
| C17 | C18 | C21 | H26 | 60.0° | 179.8° |
| C17 | C18 | C21 | H27 | 60.0° | 60.2° |
| C19 | C18 | C17 | C12 | 109.6° | 173.8° |
| C19 | C18 | C17 | C16 | 1.5° | 57.4° |
| C18 | C19 | C20 | H21 | 120.2° | 120.0° |
| C18 | C19 | C20 | H22 | 120.2° | 120.0° |
| C18 | C19 | C20 | C24 | 137.9° | 180.0° |
| C19 | C18 | C17 | H19 | 126.2° | 64.2° |
| C18 | C19 | H21 | H22 | 119.4° | 120.0° |
| C18 | C19 | C20 | H23 | 102.2° | 60.0° |
| C18 | C19 | C20 | H24 | 17.9° | 60.0° |
| C19 | C18 | C21 | H25 | 59.3° | 179.9° |
| C19 | C18 | C21 | H26 | 60.7° | 60.2° |
| C19 | C18 | C21 | H27 | 179.3° | 59.8° |
| C17 | C12 | C11 | C22 | 115.4° | 117.0° |
| C12 | C17 | C16 | H19 | 118.1° | 118.7° |
| C17 | C12 | C11 | C9 | 178.1° | 166.4° |
| C17 | C12 | C11 | C15 | 56.7° | 44.4° |
| C12 | C17 | C16 | C15 | 29.0° | 2.3° |
| C17 | C12 | C11 | H11 | 59.7° | 73.1° |
| C17 | C12 | C13 | H12 | 78.6° | 61.1° |
| C12 | C17 | C16 | H17 | 148.3° | 116.3° |
| C12 | C17 | C16 | H18 | 90.4° | 122.0° |
| C12 | C17 | C18 | H20 | 11.2° | 53.8° |
| C17 | C12 | C22 | H28 | 50.8° | 65.3° |
| C17 | C12 | C22 | H29 | 69.3° | 174.8° |
| C17 | C12 | C22 | H30 | 170.8° | 54.8° |
| C11 | C12 | C17 | C16 | 52.8° | 28.5° |
| C12 | C11 | C9 | C15 | 111.6° | 112.6° |
| C12 | C11 | C9 | H11 | 122.1° | 121.1° |
| C12 | C11 | C9 | C8 | 175.1° | 176.6° |
| C12 | C11 | C15 | H11 | 116.8° | 118.1° |
| C12 | C11 | C15 | C16 | 35.3° | 42.4° |
| C11 | C12 | C13 | H12 | 168.2° | 176.3° |
| C12 | C11 | C15 | H15 | 83.2° | 75.9° |
| C12 | C11 | C15 | H16 | 153.8° | 161.0° |
| C11 | C12 | C17 | H19 | 64.7° | 89.8° |
| C11 | C12 | C22 | H28 | 57.8° | 178.1° |
| C11 | C12 | C22 | H29 | 177.8° | 62.0° |
| C11 | C12 | C22 | H30 | 62.2° | 58.1° |
| C12 | C11 | C9 | H38 | 49.9° | 54.5° |
| C22 | C12 | C17 | C16 | 58.9° | 88.5° |
| C22 | C12 | C11 | C9 | 62.6° | 49.4° |
| C22 | C12 | C11 | C15 | 58.7° | 72.6° |
| C22 | C12 | C11 | H11 | 175.2° | 169.9° |
| C22 | C12 | C13 | H12 | 49.1° | 64.4° |
| C22 | C12 | C17 | H19 | 176.3° | 153.3° |
| C12 | C22 | H28 | H29 | 120.0° | 120.0° |
| C12 | C22 | H28 | H30 | 120.0° | 120.0° |
| C12 | C22 | H29 | H30 | 120.0° | 120.0° |
| C17 | C16 | C15 | C11 | 4.5° | 25.1° |
| C17 | C16 | C15 | H17 | 119.4° | 118.1° |
| C17 | C16 | C15 | H18 | 119.4° | 120.4° |
| C17 | C16 | C15 | H15 | 114.1° | 93.2° |
| C17 | C16 | C15 | H16 | 123.0° | 143.5° |
| C17 | C16 | H17 | H18 | 121.8° | 122.5° |
| C16 | C17 | C18 | H20 | 122.3° | 62.6° |
| C11 | C9 | C8 | H38 | 125.6° | 121.6° |
| C9 | C11 | C15 | H11 | 126.6° | 126.3° |
| C11 | C9 | C8 | C7 | 176.0° | 177.7° |
| C9 | C11 | C15 | C16 | 151.9° | 158.0° |
| C11 | C9 | C10 | H10 | 46.8° | 61.3° |
| C9 | C11 | C15 | H15 | 33.4° | 39.7° |
| C9 | C11 | C15 | H16 | 89.6° | 83.4° |
| C11 | C9 | C8 | H36 | 55.4° | 62.2° |
| C11 | C9 | C8 | H37 | 63.5° | 57.8° |
| C8 | C9 | C11 | C15 | 63.5° | 64.0° |
| C9 | C8 | C7 | H36 | 120.5° | 120.1° |
| C9 | C8 | C7 | H37 | 120.5° | 120.0° |
| C8 | C9 | C10 | H10 | 68.6° | 58.3° |
| C8 | C9 | C11 | H11 | 62.8° | 62.3° |
| C9 | C8 | C7 | H34 | 100.0° | 59.9° |
| C9 | C8 | C7 | H35 | 141.5° | 179.8° |
| C9 | C8 | H36 | H37 | 118.3° | 120.0° |
| C11 | C15 | C16 | H15 | 118.5° | 118.3° |
| C11 | C15 | C16 | H16 | 118.5° | 118.4° |
| C11 | C15 | H15 | H16 | 124.3° | 123.1° |
| C11 | C15 | C16 | H17 | 114.9° | 143.2° |
| C11 | C15 | C16 | H18 | 123.8° | 95.3° |
| C15 | C11 | C9 | H38 | 61.7° | 58.1° |
| C8 | C7 | C4 | H7 | 82.5° | 179.7° |
| C8 | C7 | H34 | H35 | 117.7° | 120.0° |
| C7 | C8 | H36 | H37 | 118.4° | 119.9° |
| C7 | C8 | C9 | H38 | 58.5° | 60.7° |
| C19 | C20 | C24 | H23 | 120.0° | 120.0° |
| C19 | C20 | C24 | H24 | 120.0° | 119.9° |
| C19 | C20 | C24 | O2 | 58.3° | 0.1° |
| C19 | C20 | C24 | O3 | 121.5° | 180.0° |
| C20 | C19 | C18 | H20 | 82.3° | 55.0° |
| C20 | C19 | H21 | H22 | 119.4° | 120.0° |
| C19 | C20 | H23 | H24 | 120.1° | 120.0° |
| C20 | C24 | O2 | O3 | 179.8° | 179.9° |
| C20 | C24 | O3 | H6 | 179.8° | 180.0° |
| C24 | C20 | C19 | H21 | 17.7° | 60.0° |
| C24 | C20 | C19 | H22 | 101.9° | 60.0° |
| C24 | C20 | H23 | H24 | 120.0° | 120.0° |
| O2 | C24 | O3 | H6 | 0.0° | 0.1° |
| O2 | C24 | C20 | H23 | 178.3° | 119.9° |
| O2 | C24 | C20 | H24 | 61.7° | 120.0° |
| O3 | C24 | C20 | H23 | 1.6° | 60.0° |
| O3 | C24 | C20 | H24 | 118.5° | 60.1° |
| C16 | C15 | C11 | H11 | 81.5° | 75.7° |
| C16 | C15 | H15 | H16 | 124.3° | 123.4° |
| C15 | C16 | H17 | H18 | 121.8° | 121.5° |
| C15 | C16 | C17 | H19 | 89.1° | 116.4° |
| H1 | C1 | C2 | H3 | 56.8° | 179.8° |
| H1 | C1 | C6 | H8 | 175.4° | 60.1° |
| H1 | C1 | C6 | H9 | 65.5° | 179.8° |
| H2 | C1 | C2 | H3 | 63.8° | 59.8° |
| H2 | C1 | C6 | H8 | 63.9° | 59.9° |
| H2 | C1 | C6 | H9 | 55.1° | 60.2° |
| H3 | C2 | C3 | H4 | 51.8° | 59.9° |
| H3 | C2 | C3 | H5 | 66.6° | 179.9° |
| H4 | C3 | C4 | H7 | 46.1° | 60.0° |
| H5 | C3 | C4 | H7 | 72.2° | 179.9° |
| H7 | C4 | C7 | H34 | 38.2° | 60.3° |
| H7 | C4 | C7 | H35 | 156.7° | 59.6° |
| H10 | C10 | C14 | H13 | 174.9° | 55.7° |
| H10 | C10 | C14 | H14 | 66.2° | 174.8° |
| H10 | C10 | C9 | H38 | 167.7° | 179.6° |
| H11 | C11 | C15 | H15 | 160.0° | 166.0° |
| H11 | C11 | C15 | H16 | 37.0° | 42.9° |
| H11 | C11 | C9 | H38 | 172.0° | 175.6° |
| H12 | C13 | C14 | H13 | 50.5° | 62.7° |
| H12 | C13 | C14 | H14 | 68.3° | 56.4° |
| H12 | C13 | O1 | H39 | 57.0° | 58.9° |
| H15 | C15 | C16 | H17 | 126.6° | 24.9° |
| H15 | C15 | C16 | H18 | 5.3° | 146.3° |
| H16 | C15 | C16 | H17 | 3.6° | 98.4° |
| H16 | C15 | C16 | H18 | 117.7° | 23.1° |
| H17 | C16 | C17 | H19 | 30.2° | 125.0° |
| H18 | C16 | C17 | H19 | 151.5° | 3.3° |
| H19 | C17 | C18 | H20 | 112.9° | 175.8° |
| H20 | C18 | C19 | H21 | 37.9° | 65.0° |
| H20 | C18 | C19 | H22 | 157.5° | 175.1° |
| H20 | C18 | C21 | H25 | 60.9° | 60.1° |
| H20 | C18 | C21 | H26 | 179.2° | 59.8° |
| H20 | C18 | C21 | H27 | 59.1° | 179.8° |
| H21 | C19 | C20 | H23 | 137.7° | 180.0° |
| H21 | C19 | C20 | H24 | 102.3° | 60.0° |
| H22 | C19 | C20 | H23 | 18.1° | 60.0° |
| H22 | C19 | C20 | H24 | 138.1° | 180.0° |
| H25 | C21 | H26 | H27 | 120.0° | 120.0° |
| H28 | C22 | H29 | H30 | 120.0° | 120.0° |
| H31 | C23 | H32 | H33 | 120.0° | 120.1° |
| H34 | C7 | C8 | H36 | 139.4° | 60.2° |
| H34 | C7 | C8 | H37 | 20.5° | 179.9° |
| H35 | C7 | C8 | H36 | 21.0° | 59.7° |
| H35 | C7 | C8 | H37 | 98.0° | 60.2° |
| H36 | C8 | C9 | H38 | 179.0° | 59.4° |
| H37 | C8 | C9 | H38 | 62.1° | 179.4° |
