ZSV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C4 | doub | 1.38Å | 1.38Å | Aromatic |
| C3 | C11 | sing | 1.40Å | 1.38Å | Aromatic |
| C4 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C8 | sing | 1.39Å | 1.38Å | Aromatic |
| C5 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| C6 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | C16 | doub | 1.39Å | 1.37Å | Aromatic |
| C9 | C18 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | C18 | sing | 1.39Å | 1.38Å | Aromatic |
| C11 | C14 | doub | 1.40Å | 1.38Å | Aromatic |
| C11 | C21 | sing | 1.48Å | 1.47Å | |
| C12 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| C12 | C17 | doub | 1.40Å | 1.39Å | Aromatic |
| C12 | C22 | sing | 1.47Å | 1.50Å | |
| C13 | C27 | sing | 1.51Å | 1.50Å | |
| C14 | C28 | sing | 1.51Å | 1.49Å | |
| C15 | C29 | sing | 1.51Å | 1.50Å | |
| C16 | C17 | sing | 1.39Å | 1.38Å | Aromatic |
| C16 | O41 | sing | 1.36Å | 1.39Å | |
| C17 | O40 | sing | 1.36Å | 1.40Å | |
| C18 | O42 | sing | 1.36Å | 1.39Å | |
| C19 | C20 | doub | 1.31Å | 1.34Å | |
| C20 | C30 | sing | 1.51Å | 1.49Å | |
| C21 | N33 | sing | 1.35Å | 1.37Å | |
| C21 | O37 | doub | 1.22Å | 1.22Å | |
| C22 | O35 | sing | 1.35Å | 1.27Å | |
| C22 | O38 | doub | 1.21Å | 1.26Å | |
| C23 | C31 | sing | 1.51Å | 1.52Å | |
| C23 | O36 | sing | 1.34Å | 1.26Å | |
| C23 | O39 | doub | 1.21Å | 1.26Å | |
| C24 | C25 | sing | 1.53Å | 1.50Å | |
| C24 | O40 | sing | 1.43Å | 1.43Å | |
| C25 | C32 | sing | 1.53Å | 1.52Å | |
| C25 | O41 | sing | 1.43Å | 1.43Å | |
| C26 | O42 | sing | 1.43Å | 1.43Å | |
| C27 | N33 | sing | 1.46Å | 1.44Å | |
| C28 | N34 | sing | 1.47Å | 1.49Å | |
| C29 | N34 | sing | 1.47Å | 1.53Å | |
| C30 | N34 | sing | 1.47Å | 1.51Å | |
| C31 | C32 | sing | 1.53Å | 1.52Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C19 | H192 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| N33 | H33 | sing | 0.97Å | 1.00Å | |
| O35 | H35 | sing | 0.97Å | 0.95Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| O36 | H36 | sing | 0.97Å | 0.95Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å | |
| N34 | H34 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C3 | 120.3° | 120.1° |
| C1 | C2 | C4 | 119.8° | 120.2° |
| C2 | C1 | H1 | 119.8° | 119.9° |
| C1 | C2 | H2 | 120.1° | 119.9° |
| C1 | C3 | C11 | 119.4° | 119.9° |
| C3 | C1 | H1 | 119.8° | 119.9° |
| C1 | C3 | H3 | 120.3° | 120.0° |
| C2 | C4 | C14 | 120.4° | 120.2° |
| C4 | C2 | H2 | 120.1° | 119.9° |
| C2 | C4 | H4 | 119.8° | 119.9° |
| C3 | C11 | C14 | 120.5° | 119.7° |
| C3 | C11 | C21 | 118.1° | 120.1° |
| C11 | C3 | H3 | 120.3° | 120.1° |
| C4 | C14 | C11 | 119.7° | 119.8° |
| C4 | C14 | C28 | 118.9° | 120.1° |
| C14 | C4 | H4 | 119.8° | 119.9° |
| C8 | C5 | C15 | 120.1° | 120.3° |
| C5 | C8 | C16 | 120.4° | 120.4° |
| C8 | C5 | H5 | 120.0° | 119.8° |
| C5 | C8 | H8 | 119.8° | 119.7° |
| C5 | C15 | C12 | 119.7° | 119.9° |
| C5 | C15 | C29 | 117.8° | 120.0° |
| C15 | C5 | H5 | 120.0° | 119.8° |
| C9 | C6 | C13 | 120.2° | 120.0° |
| C6 | C9 | C18 | 120.6° | 119.9° |
| C9 | C6 | H6 | 119.9° | 120.0° |
| C6 | C9 | H9 | 119.7° | 120.0° |
| C6 | C13 | C7 | 119.0° | 120.1° |
| C6 | C13 | C27 | 119.7° | 119.9° |
| C13 | C6 | H6 | 119.9° | 120.0° |
| C10 | C7 | C13 | 121.3° | 120.1° |
| C7 | C10 | C18 | 118.9° | 120.0° |
| C10 | C7 | H7 | 119.3° | 120.0° |
| C7 | C10 | H10 | 120.6° | 120.0° |
| C7 | C13 | C27 | 121.3° | 120.0° |
| C13 | C7 | H7 | 119.4° | 119.9° |
| C8 | C16 | C17 | 119.9° | 119.9° |
| C8 | C16 | O41 | 117.3° | 119.3° |
| C16 | C8 | H8 | 119.8° | 119.9° |
| C9 | C18 | C10 | 120.1° | 119.9° |
| C9 | C18 | O42 | 116.4° | 120.0° |
| C18 | C9 | H9 | 119.7° | 120.1° |
| C10 | C18 | O42 | 123.5° | 120.1° |
| C18 | C10 | H10 | 120.5° | 120.0° |
| C14 | C11 | C21 | 121.4° | 120.1° |
| C11 | C14 | C28 | 121.4° | 120.1° |
| C11 | C21 | N33 | 114.4° | 120.0° |
| C11 | C21 | O37 | 121.3° | 120.0° |
| C15 | C12 | C17 | 119.8° | 119.7° |
| C15 | C12 | C22 | 120.6° | 120.1° |
| C12 | C15 | C29 | 122.5° | 120.1° |
| C17 | C12 | C22 | 119.5° | 120.1° |
| C12 | C17 | C16 | 120.0° | 119.7° |
| C12 | C17 | O40 | 118.5° | 119.4° |
| C12 | C22 | O35 | 113.7° | 120.0° |
| C12 | C22 | O38 | 121.5° | 120.0° |
| C13 | C27 | N33 | 111.5° | 109.5° |
| C13 | C27 | H271 | 109.0° | 109.4° |
| C13 | C27 | H272 | 109.0° | 109.5° |
| C14 | C28 | N34 | 114.7° | 109.5° |
| C14 | C28 | H281 | 108.2° | 109.4° |
| C14 | C28 | H282 | 108.1° | 109.5° |
| C15 | C29 | N34 | 106.1° | 109.4° |
| C15 | C29 | H291 | 110.3° | 109.5° |
| C15 | C29 | H292 | 110.3° | 109.5° |
| C17 | C16 | O41 | 122.7° | 120.7° |
| C16 | C17 | O40 | 121.4° | 120.9° |
| C16 | O41 | C25 | 110.6° | 116.7° |
| C17 | O40 | C24 | 113.7° | 116.7° |
| C18 | O42 | C26 | 112.8° | 117.0° |
| C19 | C20 | C30 | 123.4° | 120.0° |
| C20 | C19 | H191 | 120.0° | 120.0° |
| C20 | C19 | H192 | 120.0° | 120.0° |
| C19 | C20 | H20 | 118.3° | 120.0° |
| C20 | C30 | N34 | 114.9° | 109.5° |
| C30 | C20 | H20 | 118.3° | 120.0° |
| C20 | C30 | H301 | 108.1° | 109.5° |
| C20 | C30 | H302 | 108.1° | 109.5° |
| N33 | C21 | O37 | 124.3° | 120.0° |
| C21 | N33 | C27 | 122.1° | 120.0° |
| C21 | N33 | H33 | 119.0° | 120.0° |
| O35 | C22 | O38 | 124.5° | 120.0° |
| C22 | O35 | H35 | 109.5° | 117.0° |
| C31 | C23 | O36 | 117.6° | 120.0° |
| C31 | C23 | O39 | 114.2° | 120.0° |
| C23 | C31 | C32 | 106.4° | 109.5° |
| C23 | C31 | H311 | 110.2° | 109.5° |
| C23 | C31 | H312 | 110.2° | 109.5° |
| O36 | C23 | O39 | 128.2° | 120.0° |
| C23 | O36 | H36 | 109.5° | 117.0° |
| C25 | C24 | O40 | 110.6° | 108.2° |
| C24 | C25 | C32 | 108.3° | 109.7° |
| C24 | C25 | O41 | 109.1° | 108.3° |
| C25 | C24 | H241 | 109.2° | 109.7° |
| C25 | C24 | H242 | 109.2° | 109.7° |
| C24 | C25 | H25 | 109.4° | 109.7° |
| O40 | C24 | H241 | 109.2° | 109.7° |
| O40 | C24 | H242 | 109.2° | 109.8° |
| C32 | C25 | O41 | 110.3° | 109.7° |
| C25 | C32 | C31 | 112.9° | 109.5° |
| C32 | C25 | H25 | 109.3° | 109.7° |
| C25 | C32 | H321 | 108.6° | 109.5° |
| C25 | C32 | H322 | 108.6° | 109.5° |
| O41 | C25 | H25 | 110.4° | 109.8° |
| O42 | C26 | H261 | 109.5° | 109.5° |
| O42 | C26 | H262 | 109.5° | 109.5° |
| O42 | C26 | H263 | 109.5° | 109.4° |
| N33 | C27 | H271 | 109.0° | 109.5° |
| N33 | C27 | H272 | 109.0° | 109.5° |
| C27 | N33 | H33 | 119.0° | 120.0° |
| C28 | N34 | C29 | 117.0° | 109.4° |
| C28 | N34 | C30 | 108.2° | 109.5° |
| N34 | C28 | H281 | 108.1° | 109.5° |
| N34 | C28 | H282 | 108.1° | 109.5° |
| C28 | N34 | H34 | 104.1° | 109.4° |
| C29 | N34 | C30 | 117.8° | 109.5° |
| N34 | C29 | H291 | 110.3° | 109.5° |
| N34 | C29 | H292 | 110.3° | 109.5° |
| C29 | N34 | H34 | 103.8° | 109.5° |
| N34 | C30 | H301 | 108.1° | 109.5° |
| N34 | C30 | H302 | 108.1° | 109.5° |
| C30 | N34 | H34 | 104.0° | 109.5° |
| C32 | C31 | H311 | 110.2° | 109.4° |
| C32 | C31 | H312 | 110.2° | 109.5° |
| C31 | C32 | H321 | 108.6° | 109.5° |
| C31 | C32 | H322 | 108.6° | 109.4° |
| H271 | C27 | H272 | 109.5° | 109.5° |
| H281 | C28 | H282 | 109.5° | 109.5° |
| H291 | C29 | H292 | 109.4° | 109.5° |
| H191 | C19 | H192 | 120.0° | 120.0° |
| H301 | C30 | H302 | 109.5° | 109.4° |
| H311 | C31 | H312 | 109.5° | 109.5° |
| H241 | C24 | H242 | 109.5° | 109.7° |
| H321 | C32 | H322 | 109.5° | 109.5° |
| H261 | C26 | H262 | 109.5° | 109.5° |
| H261 | C26 | H263 | 109.5° | 109.4° |
| H262 | C26 | H263 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C3 | H1 | 180.0° | 179.7° |
| C1 | C2 | C4 | H2 | 180.0° | 180.0° |
| C2 | C1 | C3 | C11 | 0.3° | 0.0° |
| C1 | C2 | C4 | C14 | 0.3° | 0.0° |
| C2 | C1 | C3 | H3 | 179.7° | 180.0° |
| C1 | C2 | C4 | H4 | 179.7° | 180.0° |
| C3 | C1 | C2 | C4 | 0.3° | 0.0° |
| C1 | C3 | C11 | H3 | 180.0° | 180.0° |
| C1 | C3 | C11 | C14 | 0.3° | 0.0° |
| C1 | C3 | C11 | C21 | 179.9° | 180.0° |
| C3 | C1 | C2 | H2 | 179.7° | 180.0° |
| C2 | C4 | C14 | H4 | 180.0° | 180.0° |
| C2 | C4 | C14 | C11 | 0.4° | 0.0° |
| C2 | C4 | C14 | C28 | 179.9° | 180.0° |
| C4 | C2 | C1 | H1 | 179.7° | 179.7° |
| C3 | C11 | C14 | C4 | 0.4° | 0.0° |
| C3 | C11 | C14 | C21 | 179.5° | 180.0° |
| C3 | C11 | C14 | C28 | 179.9° | 180.0° |
| C3 | C11 | C21 | N33 | 46.3° | 0.0° |
| C3 | C11 | C21 | O37 | 133.3° | 180.0° |
| C11 | C3 | C1 | H1 | 179.7° | 179.7° |
| C4 | C14 | C11 | C28 | 179.5° | 180.0° |
| C4 | C14 | C11 | C21 | 179.9° | 180.0° |
| C4 | C14 | C28 | N34 | 76.5° | 100.0° |
| C14 | C4 | C2 | H2 | 179.7° | 180.0° |
| C4 | C14 | C28 | H281 | 44.3° | 20.0° |
| C4 | C14 | C28 | H282 | 162.8° | 140.0° |
| C8 | C5 | C15 | H5 | 180.0° | 179.7° |
| C5 | C8 | C16 | H8 | 180.0° | 179.9° |
| C8 | C5 | C15 | C12 | 0.5° | 0.1° |
| C8 | C5 | C15 | C29 | 178.9° | 179.9° |
| C5 | C8 | C16 | C17 | 1.8° | 0.1° |
| C5 | C8 | C16 | O41 | 179.4° | 179.6° |
| C15 | C5 | C8 | C16 | 1.2° | 0.0° |
| C5 | C15 | C12 | C29 | 178.3° | 180.0° |
| C5 | C15 | C12 | C17 | 0.5° | 0.1° |
| C5 | C15 | C12 | C22 | 177.9° | 180.0° |
| C5 | C15 | C29 | N34 | 108.0° | 100.0° |
| C15 | C5 | C8 | H8 | 178.9° | 180.0° |
| C5 | C15 | C29 | H291 | 132.5° | 20.1° |
| C5 | C15 | C29 | H292 | 11.5° | 140.1° |
| C9 | C6 | C13 | H6 | 180.0° | 179.6° |
| C9 | C6 | C13 | C7 | 0.4° | 0.0° |
| C6 | C9 | C18 | H9 | 180.0° | 179.9° |
| C6 | C9 | C18 | C10 | 0.3° | 0.1° |
| C9 | C6 | C13 | C27 | 179.5° | 180.0° |
| C6 | C9 | C18 | O42 | 179.1° | 179.9° |
| C6 | C13 | C7 | C10 | 0.9° | 0.0° |
| C6 | C13 | C7 | C27 | 179.1° | 180.0° |
| C13 | C6 | C9 | C18 | 0.1° | 0.1° |
| C6 | C13 | C27 | N33 | 112.5° | 90.0° |
| C13 | C6 | C9 | H9 | 179.9° | 180.0° |
| C6 | C13 | C7 | H7 | 179.1° | 179.9° |
| C6 | C13 | C27 | H271 | 127.1° | 150.1° |
| C6 | C13 | C27 | H272 | 7.7° | 30.1° |
| C10 | C7 | C13 | H7 | 180.0° | 179.9° |
| C7 | C10 | C18 | C9 | 0.8° | 0.0° |
| C7 | C10 | C18 | H10 | 180.0° | 180.0° |
| C10 | C7 | C13 | C27 | 180.0° | 180.0° |
| C7 | C10 | C18 | O42 | 179.5° | 180.0° |
| C13 | C7 | C10 | C18 | 1.1° | 0.0° |
| C7 | C13 | C27 | N33 | 68.4° | 90.0° |
| C7 | C13 | C6 | H6 | 179.6° | 179.7° |
| C13 | C7 | C10 | H10 | 178.9° | 180.0° |
| C7 | C13 | C27 | H271 | 52.0° | 30.0° |
| C7 | C13 | C27 | H272 | 171.4° | 149.9° |
| C8 | C16 | C17 | C12 | 1.8° | 0.1° |
| C8 | C16 | C17 | O41 | 178.7° | 179.7° |
| C8 | C16 | C17 | O40 | 179.2° | 179.7° |
| C8 | C16 | O41 | C25 | 157.1° | 163.0° |
| C16 | C8 | C5 | H5 | 178.8° | 179.7° |
| C9 | C18 | C10 | O42 | 178.7° | 180.0° |
| C9 | C18 | O42 | C26 | 166.5° | 180.0° |
| C18 | C9 | C6 | H6 | 179.9° | 179.7° |
| C9 | C18 | C10 | H10 | 179.2° | 179.9° |
| C10 | C18 | O42 | C26 | 14.8° | 0.0° |
| C10 | C18 | C9 | H9 | 179.7° | 180.0° |
| C18 | C10 | C7 | H7 | 178.9° | 179.9° |
| C14 | C11 | C21 | N33 | 133.2° | 180.0° |
| C14 | C11 | C21 | O37 | 47.2° | 0.0° |
| C11 | C14 | C28 | N34 | 104.0° | 80.0° |
| C14 | C11 | C3 | H3 | 179.7° | 180.0° |
| C11 | C14 | C4 | H4 | 179.6° | 180.0° |
| C11 | C14 | C28 | H281 | 135.3° | 160.0° |
| C11 | C14 | C28 | H282 | 16.8° | 40.0° |
| C21 | C11 | C14 | C28 | 0.5° | 0.0° |
| C11 | C21 | N33 | O37 | 179.6° | 180.0° |
| C11 | C21 | N33 | C27 | 172.2° | 180.0° |
| C21 | C11 | C3 | H3 | 0.1° | 0.0° |
| C11 | C21 | N33 | H33 | 7.8° | 0.0° |
| C15 | C12 | C17 | C22 | 177.4° | 179.9° |
| C15 | C12 | C17 | C16 | 1.2° | 0.0° |
| C15 | C12 | C17 | O40 | 178.6° | 179.8° |
| C15 | C12 | C22 | O35 | 134.6° | 95.1° |
| C15 | C12 | C22 | O38 | 38.7° | 85.0° |
| C12 | C15 | C29 | N34 | 70.4° | 80.1° |
| C12 | C15 | C5 | H5 | 179.5° | 179.8° |
| C12 | C15 | C29 | H291 | 49.1° | 159.9° |
| C12 | C15 | C29 | H292 | 170.1° | 39.9° |
| C17 | C12 | C15 | C29 | 178.8° | 180.0° |
| C12 | C17 | C16 | O40 | 177.4° | 179.8° |
| C12 | C17 | C16 | O41 | 179.5° | 179.6° |
| C17 | C12 | C22 | O35 | 42.8° | 84.9° |
| C17 | C12 | C22 | O38 | 143.9° | 95.1° |
| C12 | C17 | O40 | C24 | 170.9° | 162.7° |
| C22 | C12 | C15 | C29 | 3.8° | 0.0° |
| C22 | C12 | C17 | C16 | 178.6° | 179.9° |
| C22 | C12 | C17 | O40 | 4.0° | 0.3° |
| C12 | C22 | O35 | O38 | 173.0° | 180.0° |
| C12 | C22 | O35 | H35 | 173.0° | 180.0° |
| C13 | C27 | N33 | C21 | 84.8° | 180.0° |
| C13 | C27 | N33 | H271 | 120.3° | 119.9° |
| C13 | C27 | N33 | H272 | 120.3° | 120.0° |
| C27 | C13 | C6 | H6 | 0.5° | 0.3° |
| C27 | C13 | C7 | H7 | 0.0° | 0.1° |
| C13 | C27 | H271 | H272 | 119.1° | 120.0° |
| C13 | C27 | N33 | H33 | 95.2° | 0.0° |
| C14 | C28 | N34 | H281 | 120.8° | 119.9° |
| C14 | C28 | N34 | H282 | 120.8° | 120.0° |
| C14 | C28 | N34 | C29 | 68.7° | 175.0° |
| C14 | C28 | N34 | C30 | 155.4° | 64.9° |
| C28 | C14 | C4 | H4 | 0.0° | 0.0° |
| C14 | C28 | H281 | H282 | 117.6° | 120.0° |
| C14 | C28 | N34 | H34 | 45.2° | 55.1° |
| C15 | C29 | N34 | C28 | 172.0° | 66.3° |
| C15 | C29 | N34 | H291 | 119.5° | 120.0° |
| C15 | C29 | N34 | H292 | 119.5° | 120.0° |
| C15 | C29 | N34 | C30 | 40.4° | 173.7° |
| C29 | C15 | C5 | H5 | 1.1° | 0.2° |
| C15 | C29 | H291 | H292 | 121.5° | 120.0° |
| C15 | C29 | N34 | H34 | 74.0° | 53.6° |
| C16 | C17 | O40 | C24 | 11.7° | 17.5° |
| C17 | C16 | O41 | C25 | 24.2° | 17.3° |
| C17 | C16 | C8 | H8 | 178.2° | 179.8° |
| O41 | C16 | C17 | O40 | 2.1° | 0.6° |
| C16 | O41 | C25 | C24 | 53.3° | 46.2° |
| C16 | O41 | C25 | C32 | 172.2° | 165.8° |
| O41 | C16 | C8 | H8 | 0.5° | 0.4° |
| C16 | O41 | C25 | H25 | 66.9° | 73.5° |
| C17 | O40 | C24 | C25 | 41.6° | 46.3° |
| C17 | O40 | C24 | H241 | 161.8° | 165.9° |
| C17 | O40 | C24 | H242 | 78.6° | 73.4° |
| O42 | C18 | C9 | H9 | 0.9° | 0.0° |
| O42 | C18 | C10 | H10 | 0.5° | 0.0° |
| C18 | O42 | C26 | H261 | 180.0° | 60.0° |
| C18 | O42 | C26 | H262 | 60.0° | 60.1° |
| C18 | O42 | C26 | H263 | 60.0° | 179.9° |
| C19 | C20 | C30 | H20 | 180.0° | 180.0° |
| C19 | C20 | C30 | N34 | 117.2° | 123.7° |
| C20 | C19 | H191 | H192 | 180.0° | 180.0° |
| C19 | C20 | C30 | H301 | 3.6° | 116.3° |
| C19 | C20 | C30 | H302 | 122.0° | 3.6° |
| C20 | C30 | N34 | C28 | 66.7° | 174.8° |
| C20 | C30 | N34 | C29 | 68.8° | 65.3° |
| C20 | C30 | N34 | H301 | 120.8° | 120.0° |
| C20 | C30 | N34 | H302 | 120.8° | 120.0° |
| C30 | C20 | C19 | H191 | 0.0° | 0.1° |
| C30 | C20 | C19 | H192 | 180.0° | 179.9° |
| C20 | C30 | H301 | H302 | 117.6° | 120.0° |
| C20 | C30 | N34 | H34 | 177.0° | 54.8° |
| C21 | N33 | C27 | H33 | 180.0° | 180.0° |
| C21 | N33 | C27 | H271 | 154.9° | 60.1° |
| C21 | N33 | C27 | H272 | 35.5° | 60.0° |
| O37 | C21 | N33 | C27 | 8.2° | 0.0° |
| O37 | C21 | N33 | H33 | 171.8° | 180.0° |
| O38 | C22 | O35 | H35 | 0.0° | 0.1° |
| C31 | C23 | O36 | O39 | 179.4° | 180.0° |
| C23 | C31 | C32 | C25 | 75.7° | 180.0° |
| C23 | C31 | C32 | H311 | 119.5° | 120.0° |
| C23 | C31 | C32 | H312 | 119.5° | 120.0° |
| C23 | C31 | H311 | H312 | 121.4° | 120.0° |
| C31 | C23 | O36 | H36 | 179.4° | 180.0° |
| C23 | C31 | C32 | H321 | 163.8° | 60.0° |
| C23 | C31 | C32 | H322 | 44.8° | 60.0° |
| O36 | C23 | C31 | C32 | 40.5° | 180.0° |
| O36 | C23 | C31 | H311 | 79.1° | 60.0° |
| O36 | C23 | C31 | H312 | 160.0° | 60.0° |
| O39 | C23 | C31 | C32 | 140.1° | 0.1° |
| O39 | C23 | C31 | H311 | 100.4° | 120.0° |
| O39 | C23 | C31 | H312 | 20.6° | 120.0° |
| O39 | C23 | O36 | H36 | 0.0° | 0.0° |
| C25 | C24 | O40 | H241 | 120.2° | 119.6° |
| C25 | C24 | O40 | H242 | 120.2° | 119.8° |
| C24 | C25 | C32 | O41 | 119.4° | 118.8° |
| C24 | C25 | C32 | H25 | 119.1° | 120.6° |
| C24 | C25 | O41 | H25 | 120.3° | 119.7° |
| C24 | C25 | C32 | C31 | 177.6° | 175.0° |
| C25 | C24 | H241 | H242 | 119.5° | 120.6° |
| C24 | C25 | C32 | H321 | 57.1° | 65.0° |
| C24 | C25 | C32 | H322 | 61.9° | 55.0° |
| O40 | C24 | C25 | C32 | 175.5° | 179.4° |
| O40 | C24 | C25 | O41 | 64.4° | 59.7° |
| O40 | C24 | H241 | H242 | 119.5° | 120.7° |
| O40 | C24 | C25 | H25 | 56.5° | 60.1° |
| C32 | C25 | O41 | H25 | 120.9° | 120.6° |
| C25 | C32 | C31 | H321 | 120.5° | 120.0° |
| C25 | C32 | C31 | H322 | 120.5° | 120.0° |
| C25 | C32 | C31 | H311 | 164.8° | 60.0° |
| C25 | C32 | C31 | H312 | 43.8° | 60.0° |
| C32 | C25 | C24 | H241 | 55.3° | 61.0° |
| C32 | C25 | C24 | H242 | 64.3° | 59.6° |
| C25 | C32 | H321 | H322 | 118.4° | 120.0° |
| O41 | C25 | C32 | C31 | 58.3° | 66.2° |
| O41 | C25 | C24 | H241 | 175.4° | 179.3° |
| O41 | C25 | C24 | H242 | 55.7° | 60.1° |
| O41 | C25 | C32 | H321 | 62.3° | 53.8° |
| O41 | C25 | C32 | H322 | 178.8° | 173.8° |
| O42 | C26 | H261 | H262 | 120.0° | 120.0° |
| O42 | C26 | H261 | H263 | 120.0° | 119.9° |
| O42 | C26 | H262 | H263 | 120.0° | 120.0° |
| N33 | C27 | H271 | H272 | 119.1° | 120.1° |
| C28 | N34 | C29 | C30 | 131.6° | 120.0° |
| C28 | N34 | C29 | H34 | 114.0° | 119.9° |
| C28 | N34 | C30 | H34 | 110.3° | 120.0° |
| N34 | C28 | H281 | H282 | 117.6° | 120.0° |
| C28 | N34 | C29 | H291 | 68.5° | 53.7° |
| C28 | N34 | C29 | H292 | 52.5° | 173.7° |
| C28 | N34 | C30 | H301 | 54.1° | 65.2° |
| C28 | N34 | C30 | H302 | 172.5° | 54.7° |
| C29 | N34 | C30 | H34 | 114.2° | 120.1° |
| C29 | N34 | C28 | H281 | 170.6° | 65.0° |
| C29 | N34 | C28 | H282 | 52.1° | 55.0° |
| N34 | C29 | H291 | H292 | 121.5° | 120.0° |
| C29 | N34 | C30 | H301 | 170.4° | 54.7° |
| C29 | N34 | C30 | H302 | 52.0° | 174.7° |
| C30 | N34 | C28 | H281 | 34.6° | 55.0° |
| C30 | N34 | C28 | H282 | 83.8° | 175.0° |
| C30 | N34 | C29 | H291 | 159.8° | 66.3° |
| C30 | N34 | C29 | H292 | 79.1° | 53.7° |
| N34 | C30 | C20 | H20 | 62.8° | 56.3° |
| N34 | C30 | H301 | H302 | 117.5° | 120.0° |
| C32 | C31 | H311 | H312 | 121.4° | 120.0° |
| C31 | C32 | C25 | H25 | 63.3° | 54.4° |
| C31 | C32 | H321 | H322 | 118.5° | 120.0° |
| H1 | C1 | C2 | H2 | 0.3° | 0.3° |
| H1 | C1 | C3 | H3 | 0.3° | 0.3° |
| H2 | C2 | C4 | H4 | 0.4° | 0.0° |
| H5 | C5 | C8 | H8 | 1.1° | 0.3° |
| H6 | C6 | C9 | H9 | 0.1° | 0.4° |
| H7 | C7 | C10 | H10 | 1.1° | 0.1° |
| H271 | C27 | N33 | H33 | 25.2° | 120.0° |
| H272 | C27 | N33 | H33 | 144.5° | 120.0° |
| H281 | C28 | N34 | H34 | 75.6° | 175.0° |
| H282 | C28 | N34 | H34 | 166.0° | 65.0° |
| H291 | C29 | N34 | H34 | 45.5° | 173.7° |
| H292 | C29 | N34 | H34 | 166.5° | 66.3° |
| H191 | C19 | C20 | H20 | 180.0° | 180.0° |
| H192 | C19 | C20 | H20 | 0.0° | 0.0° |
| H20 | C20 | C30 | H301 | 176.4° | 63.7° |
| H20 | C20 | C30 | H302 | 58.0° | 176.3° |
| H301 | C30 | N34 | H34 | 56.2° | 174.8° |
| H302 | C30 | N34 | H34 | 62.2° | 65.2° |
| H311 | C31 | C32 | H321 | 44.3° | 60.0° |
| H311 | C31 | C32 | H322 | 74.7° | 180.0° |
| H312 | C31 | C32 | H321 | 76.7° | 180.0° |
| H312 | C31 | C32 | H322 | 164.3° | 60.0° |
| H241 | C24 | C25 | H25 | 63.7° | 59.6° |
| H242 | C24 | C25 | H25 | 176.7° | 179.8° |
| H25 | C25 | C32 | H321 | 176.2° | 174.5° |
| H25 | C25 | C32 | H322 | 57.2° | 65.5° |
| H261 | C26 | H262 | H263 | 120.0° | 120.0° |
