5SS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | N29 | doub | 1.32Å | 1.36Å | Aromatic |
| C11 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| N29 | C17 | sing | 1.32Å | 1.36Å | Aromatic |
| C23 | C21 | sing | 1.53Å | 1.54Å | |
| C23 | C25 | sing | 1.53Å | 1.54Å | |
| N32 | C27 | sing | 1.47Å | 1.43Å | |
| C21 | C24 | sing | 1.53Å | 1.54Å | |
| C5 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C14 | doub | 1.40Å | 1.40Å | Aromatic |
| C26 | C15 | sing | 1.51Å | 1.52Å | |
| C26 | C28 | sing | 1.53Å | 1.56Å | |
| C27 | C25 | sing | 1.53Å | 1.53Å | |
| N33 | C28 | sing | 1.46Å | 1.46Å | |
| N33 | C19 | sing | 1.35Å | 1.39Å | |
| C24 | C19 | sing | 1.51Å | 1.51Å | |
| C24 | C20 | sing | 1.53Å | 1.54Å | |
| C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C25 | C22 | sing | 1.53Å | 1.54Å | |
| C17 | C28 | sing | 1.51Å | 1.52Å | |
| C17 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C6 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | O34 | doub | 1.21Å | 1.22Å | |
| C22 | C20 | sing | 1.53Å | 1.53Å | |
| C14 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.48Å | 1.45Å | |
| C1 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | C13 | doub | 1.39Å | 1.41Å | Aromatic |
| C9 | C12 | sing | 1.40Å | 1.41Å | Aromatic |
| C13 | C4 | sing | 1.40Å | 1.41Å | Aromatic |
| O35 | C18 | sing | 1.36Å | 1.35Å | |
| C12 | C18 | sing | 1.46Å | 1.41Å | Aromatic |
| C12 | C16 | doub | 1.41Å | 1.41Å | Aromatic |
| C4 | C7 | doub | 1.36Å | 1.41Å | Aromatic |
| C18 | N30 | doub | 1.30Å | 1.34Å | Aromatic |
| C16 | C7 | sing | 1.39Å | 1.41Å | Aromatic |
| C16 | N31 | sing | 1.37Å | 1.38Å | Aromatic |
| N30 | N31 | sing | 1.40Å | 1.35Å | Aromatic |
| C20 | H1 | sing | 1.09Å | 1.10Å | |
| C20 | H2 | sing | 1.09Å | 1.10Å | |
| C21 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H6 | sing | 1.09Å | 1.10Å | |
| C23 | H7 | sing | 1.09Å | 1.10Å | |
| C23 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.08Å | 1.08Å | |
| C27 | H11 | sing | 1.09Å | 1.10Å | |
| C27 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.08Å | 1.08Å | |
| C2 | H14 | sing | 1.08Å | 1.08Å | |
| C3 | H15 | sing | 1.08Å | 1.08Å | |
| C4 | H16 | sing | 1.08Å | 1.08Å | |
| C5 | H17 | sing | 1.08Å | 1.08Å | |
| C6 | H18 | sing | 1.08Å | 1.08Å | |
| C7 | H19 | sing | 1.08Å | 1.08Å | |
| C8 | H20 | sing | 1.08Å | 1.08Å | |
| C9 | H21 | sing | 1.08Å | 1.08Å | |
| C10 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C26 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.09Å | 1.10Å | |
| N32 | H27 | sing | 1.01Å | 1.00Å | |
| N32 | H28 | sing | 1.01Å | 1.00Å | |
| N33 | H30 | sing | 0.97Å | 1.00Å | |
| N31 | H31 | sing | 0.97Å | 1.00Å | |
| O35 | H29 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N29 | C11 | C8 | 122.8° | 120.9° |
| C11 | N29 | C17 | 117.8° | 122.0° |
| N29 | C11 | H10 | 118.6° | 119.6° |
| C11 | C8 | C14 | 118.0° | 119.0° |
| C8 | C11 | H10 | 118.6° | 119.6° |
| C11 | C8 | H20 | 121.0° | 120.5° |
| N29 | C17 | C28 | 117.6° | 119.5° |
| N29 | C17 | C10 | 123.3° | 120.9° |
| C21 | C23 | C25 | 111.3° | 109.5° |
| C23 | C21 | C24 | 111.5° | 109.5° |
| C23 | C21 | H3 | 108.9° | 109.5° |
| C23 | C21 | H4 | 108.9° | 109.5° |
| C21 | C23 | H7 | 109.0° | 109.5° |
| C21 | C23 | H8 | 109.0° | 109.4° |
| C23 | C25 | C27 | 113.4° | 109.5° |
| C23 | C25 | C22 | 110.1° | 109.5° |
| C25 | C23 | H7 | 109.0° | 109.5° |
| C25 | C23 | H8 | 109.0° | 109.4° |
| C23 | C25 | H23 | 107.3° | 109.5° |
| N32 | C27 | C25 | 109.7° | 109.5° |
| N32 | C27 | H11 | 109.4° | 109.5° |
| N32 | C27 | H12 | 109.4° | 109.5° |
| C27 | N32 | H27 | 109.5° | 111.0° |
| C27 | N32 | H28 | 109.5° | 111.0° |
| C21 | C24 | C19 | 114.0° | 109.5° |
| C21 | C24 | C20 | 112.9° | 109.5° |
| C24 | C21 | H3 | 109.0° | 109.5° |
| C24 | C21 | H4 | 109.0° | 109.4° |
| C21 | C24 | H9 | 106.6° | 109.5° |
| C2 | C5 | C15 | 119.3° | 120.0° |
| C5 | C2 | C1 | 120.5° | 120.0° |
| C5 | C2 | H14 | 119.7° | 120.0° |
| C2 | C5 | H17 | 120.3° | 120.0° |
| C5 | C15 | C26 | 120.2° | 120.0° |
| C5 | C15 | C6 | 119.9° | 120.0° |
| C15 | C5 | H17 | 120.4° | 120.0° |
| C8 | C14 | C10 | 120.2° | 118.2° |
| C8 | C14 | C13 | 119.3° | 120.9° |
| C14 | C8 | H20 | 121.0° | 120.5° |
| C15 | C26 | C28 | 110.3° | 109.4° |
| C26 | C15 | C6 | 119.7° | 120.0° |
| C15 | C26 | H24 | 109.2° | 109.5° |
| C15 | C26 | H25 | 109.2° | 109.5° |
| C26 | C28 | N33 | 111.1° | 109.5° |
| C26 | C28 | C17 | 110.9° | 109.5° |
| C28 | C26 | H24 | 109.3° | 109.5° |
| C28 | C26 | H25 | 109.3° | 109.4° |
| C26 | C28 | H26 | 105.7° | 109.5° |
| C27 | C25 | C22 | 110.8° | 109.4° |
| C25 | C27 | H11 | 109.4° | 109.4° |
| C25 | C27 | H12 | 109.4° | 109.5° |
| C27 | C25 | H23 | 107.5° | 109.5° |
| C28 | N33 | C19 | 122.9° | 120.0° |
| N33 | C28 | C17 | 115.6° | 109.5° |
| N33 | C28 | H26 | 106.8° | 109.5° |
| C28 | N33 | H30 | 118.5° | 120.0° |
| N33 | C19 | C24 | 115.7° | 120.0° |
| N33 | C19 | O34 | 124.5° | 120.0° |
| C19 | N33 | H30 | 118.5° | 120.0° |
| C19 | C24 | C20 | 109.4° | 109.5° |
| C24 | C19 | O34 | 119.7° | 120.0° |
| C19 | C24 | H9 | 106.9° | 109.5° |
| C24 | C20 | C22 | 113.2° | 109.5° |
| C24 | C20 | H1 | 108.6° | 109.5° |
| C24 | C20 | H2 | 108.6° | 109.5° |
| C20 | C24 | H9 | 106.6° | 109.4° |
| C2 | C1 | C3 | 120.1° | 120.0° |
| C2 | C1 | H13 | 119.9° | 120.0° |
| C1 | C2 | H14 | 119.7° | 120.0° |
| C25 | C22 | C20 | 110.8° | 109.4° |
| C25 | C22 | H5 | 109.1° | 109.5° |
| C25 | C22 | H6 | 109.1° | 109.5° |
| C22 | C25 | H23 | 107.4° | 109.4° |
| C28 | C17 | C10 | 118.8° | 119.6° |
| C17 | C28 | H26 | 106.0° | 109.5° |
| C17 | C10 | C14 | 117.7° | 119.0° |
| C17 | C10 | H22 | 121.1° | 120.5° |
| C15 | C6 | C3 | 120.8° | 120.0° |
| C15 | C6 | H18 | 119.6° | 120.0° |
| C22 | C20 | H1 | 108.5° | 109.5° |
| C22 | C20 | H2 | 108.5° | 109.5° |
| C20 | C22 | H5 | 109.1° | 109.5° |
| C20 | C22 | H6 | 109.1° | 109.5° |
| C10 | C14 | C13 | 120.2° | 120.9° |
| C14 | C10 | H22 | 121.2° | 120.5° |
| C14 | C13 | C9 | 119.0° | 119.9° |
| C14 | C13 | C4 | 119.6° | 119.9° |
| C1 | C3 | C6 | 119.3° | 120.0° |
| C3 | C1 | H13 | 120.0° | 120.0° |
| C1 | C3 | H15 | 120.3° | 120.0° |
| C6 | C3 | H15 | 120.3° | 120.0° |
| C3 | C6 | H18 | 119.6° | 120.0° |
| C13 | C9 | C12 | 118.6° | 119.5° |
| C9 | C13 | C4 | 120.9° | 120.2° |
| C13 | C9 | H21 | 120.7° | 120.2° |
| C9 | C12 | C18 | 135.7° | 133.9° |
| C9 | C12 | C16 | 119.6° | 119.8° |
| C12 | C9 | H21 | 120.7° | 120.3° |
| C13 | C4 | C7 | 121.2° | 120.7° |
| C13 | C4 | H16 | 119.4° | 119.6° |
| O35 | C18 | C12 | 128.3° | 126.2° |
| O35 | C18 | N30 | 119.8° | 126.2° |
| C18 | O35 | H29 | 109.5° | 114.0° |
| C18 | C12 | C16 | 104.8° | 106.3° |
| C12 | C18 | N30 | 111.9° | 107.6° |
| C12 | C16 | C7 | 122.6° | 119.7° |
| C12 | C16 | N31 | 105.2° | 106.8° |
| C4 | C7 | C16 | 117.0° | 120.2° |
| C7 | C4 | H16 | 119.4° | 119.7° |
| C4 | C7 | H19 | 121.5° | 119.9° |
| C18 | N30 | N31 | 104.7° | 110.1° |
| C7 | C16 | N31 | 132.1° | 133.6° |
| C16 | C7 | H19 | 121.5° | 119.9° |
| C16 | N31 | N30 | 113.4° | 109.2° |
| C16 | N31 | H31 | 123.3° | 125.4° |
| N30 | N31 | H31 | 123.3° | 125.4° |
| H1 | C20 | H2 | 109.4° | 109.4° |
| H3 | C21 | H4 | 109.5° | 109.5° |
| H5 | C22 | H6 | 109.5° | 109.5° |
| H7 | C23 | H8 | 109.5° | 109.5° |
| H11 | C27 | H12 | 109.5° | 109.5° |
| H24 | C26 | H25 | 109.5° | 109.5° |
| H27 | N32 | H28 | 109.4° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N29 | C11 | C8 | H10 | 180.0° | 179.9° |
| N29 | C11 | C8 | C14 | 1.5° | 0.2° |
| C11 | N29 | C17 | C28 | 176.5° | 180.0° |
| C11 | N29 | C17 | C10 | 3.7° | 0.3° |
| N29 | C11 | C8 | H20 | 178.5° | 180.0° |
| C8 | C11 | N29 | C17 | 1.6° | 0.1° |
| C11 | C8 | C14 | H20 | 180.0° | 179.8° |
| C11 | C8 | C14 | C10 | 3.5° | 0.1° |
| C11 | C8 | C14 | C13 | 176.3° | 179.8° |
| N29 | C17 | C28 | C26 | 71.4° | 56.3° |
| N29 | C17 | C28 | N33 | 56.2° | 63.7° |
| N29 | C17 | C28 | C10 | 173.2° | 179.7° |
| N29 | C17 | C10 | C14 | 5.6° | 0.3° |
| C17 | N29 | C11 | H10 | 178.4° | 180.0° |
| N29 | C17 | C10 | H22 | 174.5° | 179.7° |
| N29 | C17 | C28 | H26 | 174.3° | 176.3° |
| C21 | C23 | C25 | H7 | 120.3° | 120.0° |
| C21 | C23 | C25 | H8 | 120.3° | 120.0° |
| C23 | C21 | C24 | H3 | 120.3° | 120.0° |
| C23 | C21 | C24 | H4 | 120.3° | 120.0° |
| C21 | C23 | C25 | C27 | 176.5° | 180.0° |
| C23 | C21 | C24 | C19 | 175.4° | 180.0° |
| C23 | C21 | C24 | C20 | 49.8° | 60.0° |
| C21 | C23 | C25 | C22 | 58.7° | 60.0° |
| C23 | C21 | H3 | H4 | 119.0° | 120.0° |
| C21 | C23 | H7 | H8 | 119.2° | 120.0° |
| C23 | C21 | C24 | H9 | 66.9° | 60.0° |
| C21 | C23 | C25 | H23 | 57.9° | 60.0° |
| C23 | C25 | C27 | N32 | 54.5° | 175.0° |
| C25 | C23 | C21 | C24 | 54.6° | 60.0° |
| C23 | C25 | C27 | C22 | 124.4° | 120.0° |
| C23 | C25 | C27 | H23 | 118.5° | 120.0° |
| C23 | C25 | C22 | H23 | 116.6° | 120.0° |
| C23 | C25 | C22 | C20 | 57.6° | 60.0° |
| C25 | C23 | C21 | H3 | 174.9° | 180.0° |
| C25 | C23 | C21 | H4 | 65.8° | 60.0° |
| C23 | C25 | C22 | H5 | 177.8° | 60.0° |
| C23 | C25 | C22 | H6 | 62.7° | 180.0° |
| C25 | C23 | H7 | H8 | 119.2° | 120.0° |
| C23 | C25 | C27 | H11 | 174.6° | 55.0° |
| C23 | C25 | C27 | H12 | 65.5° | 64.9° |
| N32 | C27 | C25 | H11 | 120.0° | 120.0° |
| N32 | C27 | C25 | H12 | 120.0° | 120.1° |
| N32 | C27 | C25 | C22 | 178.9° | 65.0° |
| N32 | C27 | H11 | H12 | 119.9° | 120.1° |
| N32 | C27 | C25 | H23 | 63.9° | 54.9° |
| C27 | N32 | H27 | H28 | 120.0° | 123.9° |
| C21 | C24 | C19 | N33 | 103.6° | 180.0° |
| C21 | C24 | C19 | C20 | 127.5° | 120.0° |
| C21 | C24 | C19 | H9 | 117.5° | 120.0° |
| C21 | C24 | C20 | H9 | 116.7° | 120.0° |
| C21 | C24 | C19 | O34 | 78.8° | 0.0° |
| C21 | C24 | C20 | C22 | 49.8° | 60.0° |
| C21 | C24 | C20 | H1 | 170.3° | 60.1° |
| C21 | C24 | C20 | H2 | 70.8° | 180.0° |
| C24 | C21 | H3 | H4 | 119.1° | 119.9° |
| C24 | C21 | C23 | H7 | 174.9° | 180.0° |
| C24 | C21 | C23 | H8 | 65.7° | 60.0° |
| C2 | C5 | C15 | H17 | 180.0° | 179.9° |
| C2 | C5 | C15 | C26 | 175.5° | 179.8° |
| C5 | C2 | C1 | H14 | 180.0° | 180.0° |
| C2 | C5 | C15 | C6 | 1.9° | 0.0° |
| C5 | C2 | C1 | C3 | 0.2° | 0.0° |
| C5 | C2 | C1 | H13 | 179.8° | 180.0° |
| C5 | C15 | C26 | C6 | 173.7° | 179.7° |
| C5 | C15 | C26 | C28 | 106.1° | 89.8° |
| C15 | C5 | C2 | C1 | 0.7° | 0.0° |
| C5 | C15 | C6 | C3 | 2.2° | 0.0° |
| C15 | C5 | C2 | H14 | 179.3° | 180.0° |
| C5 | C15 | C6 | H18 | 177.8° | 179.9° |
| C5 | C15 | C26 | H24 | 14.0° | 30.3° |
| C5 | C15 | C26 | H25 | 133.7° | 150.3° |
| C8 | C14 | C10 | C17 | 5.3° | 0.1° |
| C8 | C14 | C10 | C13 | 172.8° | 179.9° |
| C8 | C14 | C13 | C9 | 23.6° | 0.4° |
| C8 | C14 | C13 | C4 | 149.0° | 179.9° |
| C14 | C8 | C11 | H10 | 178.5° | 179.8° |
| C8 | C14 | C10 | H22 | 174.7° | 179.9° |
| C15 | C26 | C28 | H24 | 120.1° | 120.0° |
| C15 | C26 | C28 | H25 | 120.1° | 120.0° |
| C15 | C26 | C28 | N33 | 174.1° | 65.0° |
| C15 | C26 | C28 | C17 | 55.8° | 175.0° |
| C26 | C15 | C6 | C3 | 175.9° | 179.7° |
| C26 | C15 | C5 | H17 | 4.5° | 0.3° |
| C26 | C15 | C6 | H18 | 4.1° | 0.2° |
| C15 | C26 | H24 | H25 | 119.6° | 120.0° |
| C15 | C26 | C28 | H26 | 58.7° | 55.0° |
| C26 | C28 | N33 | C17 | 127.6° | 120.0° |
| C26 | C28 | N33 | H26 | 114.8° | 120.0° |
| C26 | C28 | N33 | C19 | 154.6° | 153.4° |
| C26 | C28 | C17 | H26 | 114.3° | 120.0° |
| C26 | C28 | C17 | C10 | 101.8° | 124.0° |
| C28 | C26 | C15 | C6 | 67.5° | 90.0° |
| C28 | C26 | H24 | H25 | 119.6° | 120.0° |
| C26 | C28 | N33 | H30 | 25.4° | 26.6° |
| C27 | C25 | C22 | H23 | 117.2° | 120.0° |
| C27 | C25 | C22 | C20 | 176.2° | NaN° |
| C27 | C25 | C22 | H5 | 56.0° | 60.0° |
| C27 | C25 | C22 | H6 | 63.6° | 60.0° |
| C27 | C25 | C23 | H7 | 56.2° | 60.0° |
| C27 | C25 | C23 | H8 | 63.3° | 60.0° |
| C25 | C27 | H11 | H12 | 119.9° | 119.9° |
| C25 | C27 | N32 | H27 | 180.0° | 56.1° |
| C25 | C27 | N32 | H28 | 60.0° | 180.0° |
| C28 | N33 | C19 | H30 | 180.0° | 179.9° |
| C28 | N33 | C19 | C24 | 177.0° | 180.0° |
| N33 | C28 | C17 | H26 | 118.1° | 120.0° |
| N33 | C28 | C17 | C10 | 130.6° | 116.0° |
| C28 | N33 | C19 | O34 | 0.5° | 0.0° |
| N33 | C28 | C26 | H24 | 65.7° | 175.0° |
| N33 | C28 | C26 | H25 | 54.0° | 55.0° |
| N33 | C19 | C24 | O34 | 177.6° | 180.0° |
| N33 | C19 | C24 | C20 | 128.9° | 60.0° |
| C19 | N33 | C28 | C17 | 77.8° | 86.6° |
| N33 | C19 | C24 | H9 | 13.9° | 60.0° |
| C19 | N33 | C28 | H26 | 39.8° | 33.3° |
| C19 | C24 | C20 | H9 | 115.3° | 120.0° |
| C19 | C24 | C20 | C22 | 177.8° | 180.0° |
| C19 | C24 | C20 | H1 | 61.6° | 60.0° |
| C19 | C24 | C20 | H2 | 57.3° | 60.0° |
| C19 | C24 | C21 | H3 | 64.3° | 60.0° |
| C19 | C24 | C21 | H4 | 55.1° | 60.0° |
| C24 | C19 | N33 | H30 | 3.0° | 0.1° |
| C24 | C20 | C22 | C25 | 53.5° | 60.0° |
| C20 | C24 | C19 | O34 | 48.7° | 120.0° |
| C24 | C20 | C22 | H1 | 120.6° | 120.0° |
| C24 | C20 | C22 | H2 | 120.6° | 120.0° |
| C24 | C20 | H1 | H2 | 118.3° | 120.0° |
| C20 | C24 | C21 | H3 | 170.1° | 180.0° |
| C20 | C24 | C21 | H4 | 70.5° | 60.0° |
| C24 | C20 | C22 | H5 | 173.7° | 60.0° |
| C24 | C20 | C22 | H6 | 66.7° | 180.0° |
| C2 | C1 | C3 | H13 | 180.0° | 180.0° |
| C2 | C1 | C3 | C6 | 0.1° | 0.1° |
| C2 | C1 | C3 | H15 | 179.9° | 180.0° |
| C1 | C2 | C5 | H17 | 179.3° | 180.0° |
| C25 | C22 | C20 | H5 | 120.2° | 120.0° |
| C25 | C22 | C20 | H6 | 120.2° | 120.0° |
| C25 | C22 | C20 | H1 | 174.1° | 60.1° |
| C25 | C22 | C20 | H2 | 67.0° | 180.0° |
| C25 | C22 | H5 | H6 | 119.4° | 120.0° |
| C22 | C25 | C23 | H7 | 179.0° | 180.0° |
| C22 | C25 | C23 | H8 | 61.5° | 60.0° |
| C22 | C25 | C27 | H11 | 61.0° | 175.0° |
| C22 | C25 | C27 | H12 | 58.9° | 55.1° |
| C28 | C17 | C10 | C14 | 178.3° | 180.0° |
| C28 | C17 | C10 | H22 | 1.7° | 0.0° |
| C17 | C28 | C26 | H24 | 64.3° | 55.0° |
| C17 | C28 | C26 | H25 | 175.9° | 65.0° |
| C17 | C28 | N33 | H30 | 102.2° | 93.4° |
| C17 | C10 | C14 | H22 | 180.0° | 180.0° |
| C17 | C10 | C14 | C13 | 178.1° | 180.0° |
| C10 | C17 | C28 | H26 | 12.5° | 4.0° |
| C15 | C6 | C3 | C1 | 1.3° | 0.1° |
| C15 | C6 | C3 | H18 | 180.0° | 179.9° |
| C15 | C6 | C3 | H15 | 178.7° | 180.0° |
| C6 | C15 | C5 | H17 | 178.1° | 180.0° |
| C6 | C15 | C26 | H24 | 172.4° | 150.0° |
| C6 | C15 | C26 | H25 | 52.6° | 29.9° |
| O34 | C19 | C24 | H9 | 163.7° | 120.0° |
| O34 | C19 | N33 | H30 | 179.5° | 180.0° |
| C22 | C20 | H1 | H2 | 118.3° | 120.0° |
| C20 | C22 | H5 | H6 | 119.4° | 120.0° |
| C22 | C20 | C24 | H9 | 66.9° | 60.0° |
| C20 | C22 | C25 | H23 | 59.0° | 60.0° |
| C10 | C14 | C13 | C9 | 163.6° | 179.7° |
| C10 | C14 | C13 | C4 | 23.9° | 0.0° |
| C10 | C14 | C8 | H20 | 176.6° | 180.0° |
| C14 | C13 | C9 | C4 | 172.4° | 179.7° |
| C14 | C13 | C9 | C12 | 174.2° | 179.8° |
| C14 | C13 | C4 | C7 | 174.4° | 179.7° |
| C14 | C13 | C4 | H16 | 5.5° | 0.4° |
| C13 | C14 | C8 | H20 | 3.7° | 0.1° |
| C14 | C13 | C9 | H21 | 5.8° | 0.3° |
| C13 | C14 | C10 | H22 | 1.9° | 0.0° |
| C1 | C3 | C6 | H15 | 180.0° | 179.9° |
| C3 | C1 | C2 | H14 | 179.8° | 180.0° |
| C1 | C3 | C6 | H18 | 178.7° | 180.0° |
| C6 | C3 | C1 | H13 | 179.9° | 180.0° |
| C13 | C9 | C12 | H21 | 180.0° | 179.9° |
| C13 | C9 | C12 | C18 | 178.9° | 180.0° |
| C13 | C9 | C12 | C16 | 0.2° | 0.1° |
| C9 | C13 | C4 | C7 | 2.0° | 0.0° |
| C9 | C13 | C4 | H16 | 177.9° | 180.0° |
| C12 | C9 | C13 | C4 | 1.7° | 0.1° |
| C9 | C12 | C18 | O35 | 2.2° | 0.0° |
| C9 | C12 | C18 | C16 | 178.9° | 179.9° |
| C9 | C12 | C18 | N30 | 179.7° | 179.9° |
| C9 | C12 | C16 | C7 | 1.9° | 0.1° |
| C9 | C12 | C16 | N31 | 179.8° | 179.9° |
| C13 | C4 | C7 | H16 | 180.0° | 179.9° |
| C13 | C4 | C7 | C16 | 0.4° | 0.0° |
| C13 | C4 | C7 | H19 | 179.6° | 179.9° |
| C4 | C13 | C9 | H21 | 178.3° | 180.0° |
| O35 | C18 | C12 | N30 | 178.0° | 180.0° |
| O35 | C18 | C12 | C16 | 176.6° | 180.0° |
| O35 | C18 | N30 | N31 | 177.1° | 180.0° |
| C18 | C12 | C16 | C7 | 179.0° | 180.0° |
| C18 | C12 | C16 | N31 | 1.1° | 0.0° |
| C12 | C18 | N30 | N31 | 1.1° | 0.0° |
| C18 | C12 | C9 | H21 | 1.1° | 0.1° |
| C12 | C18 | O35 | H29 | 177.9° | 90.1° |
| C12 | C16 | C7 | C4 | 1.6° | 0.0° |
| C16 | C12 | C18 | N30 | 1.4° | 0.0° |
| C12 | C16 | C7 | N31 | 177.3° | 180.0° |
| C12 | C16 | N31 | N30 | 0.5° | 0.0° |
| C12 | C16 | C7 | H19 | 178.4° | 179.9° |
| C16 | C12 | C9 | H21 | 179.8° | 180.0° |
| C12 | C16 | N31 | H31 | 179.5° | 180.0° |
| C4 | C7 | C16 | H19 | 180.0° | 179.9° |
| C4 | C7 | C16 | N31 | 178.9° | 180.0° |
| C18 | N30 | N31 | C16 | 0.3° | 0.0° |
| C18 | N30 | N31 | H31 | 179.7° | 180.0° |
| N30 | C18 | O35 | H29 | 0.0° | 89.9° |
| C7 | C16 | N31 | N30 | 178.1° | 180.0° |
| C16 | C7 | C4 | H16 | 179.6° | 179.9° |
| C7 | C16 | N31 | H31 | 1.9° | 0.0° |
| C16 | N31 | N30 | H31 | 180.0° | 180.0° |
| N31 | C16 | C7 | H19 | 1.1° | 0.0° |
| H1 | C20 | C22 | H5 | 65.7° | 180.0° |
| H1 | C20 | C22 | H6 | 53.9° | 59.9° |
| H1 | C20 | C24 | H9 | 53.7° | 180.0° |
| H2 | C20 | C22 | H5 | 53.2° | 60.0° |
| H2 | C20 | C22 | H6 | 172.7° | 60.0° |
| H2 | C20 | C24 | H9 | 172.5° | 60.0° |
| H3 | C21 | C23 | H7 | 64.8° | 60.0° |
| H3 | C21 | C23 | H8 | 54.7° | 60.0° |
| H3 | C21 | C24 | H9 | 53.4° | 60.0° |
| H4 | C21 | C23 | H7 | 54.5° | 60.0° |
| H4 | C21 | C23 | H8 | 174.0° | 180.0° |
| H4 | C21 | C24 | H9 | 172.8° | 180.0° |
| H5 | C22 | C25 | H23 | 61.2° | 180.0° |
| H6 | C22 | C25 | H23 | 179.2° | 60.0° |
| H7 | C23 | C25 | H23 | 62.4° | 60.0° |
| H8 | C23 | C25 | H23 | 178.2° | 180.0° |
| H10 | C11 | C8 | H20 | 1.5° | 0.1° |
| H11 | C27 | C25 | H23 | 56.1° | 65.0° |
| H11 | C27 | N32 | H27 | 60.0° | 63.9° |
| H11 | C27 | N32 | H28 | 60.0° | 60.1° |
| H12 | C27 | C25 | H23 | 176.0° | 175.0° |
| H12 | C27 | N32 | H27 | 60.0° | 176.1° |
| H12 | C27 | N32 | H28 | 180.0° | 60.0° |
| H13 | C1 | C2 | H14 | 0.3° | 0.0° |
| H13 | C1 | C3 | H15 | 0.0° | 0.1° |
| H14 | C2 | C5 | H17 | 0.6° | 0.0° |
| H15 | C3 | C6 | H18 | 1.2° | 0.1° |
| H16 | C4 | C7 | H19 | 0.4° | 0.1° |
| H24 | C26 | C28 | H26 | 178.8° | 65.0° |
| H25 | C26 | C28 | H26 | 61.4° | 175.0° |
| H26 | C28 | N33 | H30 | 140.2° | 146.6° |
