HJ4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C2 | doub | 1.21Å | 1.21Å | |
| C36 | C2 | sing | 1.40Å | 1.39Å | |
| C36 | C35 | doub | 1.35Å | 1.36Å | |
| C2 | C3 | sing | 1.51Å | 1.50Å | |
| C34 | C35 | sing | 1.51Å | 1.51Å | |
| C34 | C33 | sing | 1.53Å | 1.53Å | |
| C35 | C5 | sing | 1.46Å | 1.48Å | |
| C33 | C32 | sing | 1.52Å | 1.54Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C5 | C4 | sing | 1.51Å | 1.53Å | |
| C5 | C6 | doub | 1.33Å | 1.39Å | |
| C30 | C27 | sing | 1.53Å | 1.53Å | |
| C32 | C6 | sing | 1.51Å | 1.52Å | |
| C32 | C21 | sing | 1.52Å | 1.50Å | |
| C6 | C7 | sing | 1.52Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.53Å | |
| C22 | C23 | sing | 1.55Å | 1.55Å | |
| C29 | C27 | sing | 1.53Å | 1.53Å | |
| C21 | C19 | sing | 1.55Å | 1.57Å | |
| C27 | C26 | sing | 1.47Å | 1.48Å | |
| C27 | C28 | sing | 1.53Å | 1.52Å | |
| C26 | C25 | trip | 1.17Å | 1.19Å | |
| C23 | C24 | sing | 1.55Å | 1.55Å | |
| C7 | C18 | sing | 1.54Å | 1.56Å | |
| C7 | C9 | sing | 1.51Å | 1.54Å | |
| C25 | C24 | sing | 1.47Å | 1.49Å | |
| C19 | C18 | sing | 1.52Å | 1.55Å | |
| C19 | C24 | sing | 1.53Å | 1.56Å | |
| C19 | C20 | sing | 1.53Å | 1.56Å | |
| C24 | O31 | sing | 1.43Å | 1.43Å | |
| C17 | C9 | doub | 1.38Å | 1.41Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.39Å | 1.41Å | Aromatic |
| C12 | N13 | sing | 1.40Å | 1.41Å | |
| N13 | C15 | sing | 1.47Å | 1.48Å | |
| N13 | C14 | sing | 1.47Å | 1.47Å | |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.08Å | 1.08Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.08Å | 1.08Å | |
| C17 | H11 | sing | 1.08Å | 1.08Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C30 | H17 | sing | 1.09Å | 1.10Å | |
| C30 | H18 | sing | 1.09Å | 1.10Å | |
| C30 | H19 | sing | 1.09Å | 1.10Å | |
| C32 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.09Å | 1.10Å | |
| C33 | H22 | sing | 1.09Å | 1.10Å | |
| C34 | H23 | sing | 1.09Å | 1.10Å | |
| C34 | H24 | sing | 1.09Å | 1.10Å | |
| C36 | H25 | sing | 1.08Å | 1.08Å | |
| C10 | H26 | sing | 1.08Å | 1.08Å | |
| C14 | H27 | sing | 1.09Å | 1.10Å | |
| C14 | H28 | sing | 1.09Å | 1.10Å | |
| C14 | H29 | sing | 1.09Å | 1.10Å | |
| C20 | H30 | sing | 1.09Å | 1.10Å | |
| C20 | H31 | sing | 1.09Å | 1.10Å | |
| C20 | H32 | sing | 1.09Å | 1.10Å | |
| C22 | H33 | sing | 1.09Å | 1.10Å | |
| C22 | H34 | sing | 1.09Å | 1.10Å | |
| C28 | H35 | sing | 1.09Å | 1.10Å | |
| C28 | H36 | sing | 1.09Å | 1.10Å | |
| C28 | H37 | sing | 1.09Å | 1.10Å | |
| C29 | H38 | sing | 1.09Å | 1.10Å | |
| C29 | H39 | sing | 1.09Å | 1.10Å | |
| C29 | H40 | sing | 1.09Å | 1.10Å | |
| O31 | H41 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C2 | C36 | 118.7° | 119.5° |
| O1 | C2 | C3 | 118.7° | 119.4° |
| C2 | C36 | C35 | 122.4° | 120.7° |
| C36 | C2 | C3 | 122.5° | 121.1° |
| C2 | C36 | H25 | 118.8° | 119.7° |
| C36 | C35 | C34 | 117.8° | 121.6° |
| C36 | C35 | C5 | 121.5° | 120.2° |
| C35 | C36 | H25 | 118.8° | 119.6° |
| C2 | C3 | C4 | 114.6° | 109.9° |
| C2 | C3 | H1 | 108.2° | 109.4° |
| C2 | C3 | H2 | 108.2° | 109.4° |
| C35 | C34 | C33 | 107.3° | 107.8° |
| C34 | C35 | C5 | 120.7° | 118.2° |
| C35 | C34 | H23 | 110.0° | 109.8° |
| C35 | C34 | H24 | 110.0° | 109.8° |
| C34 | C33 | C32 | 109.0° | 111.6° |
| C34 | C33 | H21 | 109.6° | 109.1° |
| C34 | C33 | H22 | 109.6° | 109.0° |
| C33 | C34 | H23 | 110.0° | 109.8° |
| C33 | C34 | H24 | 110.0° | 109.8° |
| C35 | C5 | C4 | 117.3° | 118.6° |
| C35 | C5 | C6 | 119.4° | 121.0° |
| C33 | C32 | C6 | 116.0° | 113.4° |
| C33 | C32 | C21 | 113.2° | 109.3° |
| C33 | C32 | H20 | 103.2° | 108.6° |
| C32 | C33 | H21 | 109.6° | 109.1° |
| C32 | C33 | H22 | 109.6° | 109.0° |
| C3 | C4 | C5 | 114.9° | 108.8° |
| C4 | C3 | H1 | 108.2° | 109.4° |
| C4 | C3 | H2 | 108.2° | 109.4° |
| C3 | C4 | H3 | 108.1° | 109.6° |
| C3 | C4 | H4 | 108.1° | 109.6° |
| C4 | C5 | C6 | 123.3° | 120.3° |
| C5 | C4 | H3 | 108.1° | 109.6° |
| C5 | C4 | H4 | 108.1° | 109.6° |
| C5 | C6 | C32 | 119.3° | 122.4° |
| C5 | C6 | C7 | 122.1° | 117.4° |
| C30 | C27 | C29 | 111.1° | 109.5° |
| C30 | C27 | C26 | 111.0° | 109.4° |
| C30 | C27 | C28 | 106.7° | 109.5° |
| C27 | C30 | H17 | 109.5° | 109.5° |
| C27 | C30 | H18 | 109.5° | 109.5° |
| C27 | C30 | H19 | 109.5° | 109.5° |
| C6 | C32 | C21 | 115.4° | 107.5° |
| C32 | C6 | C7 | 118.4° | 120.2° |
| C6 | C32 | H20 | 103.3° | 109.0° |
| C32 | C21 | C22 | 117.4° | 114.8° |
| C32 | C21 | C19 | 116.7° | 107.4° |
| C32 | C21 | H14 | 107.4° | 111.3° |
| C21 | C32 | H20 | 103.5° | 109.0° |
| C6 | C7 | C18 | 113.9° | 110.9° |
| C6 | C7 | C9 | 109.9° | 109.2° |
| C6 | C7 | H5 | 106.7° | 109.2° |
| C21 | C22 | C23 | 103.8° | 103.1° |
| C22 | C21 | C19 | 100.8° | 101.8° |
| C22 | C21 | H14 | 107.0° | 110.5° |
| C21 | C22 | H33 | 110.9° | 110.7° |
| C21 | C22 | H34 | 110.9° | 110.7° |
| C22 | C23 | C24 | 107.2° | 106.4° |
| C22 | C23 | H15 | 110.0° | 110.0° |
| C22 | C23 | H16 | 110.0° | 110.2° |
| C23 | C22 | H33 | 110.9° | 110.6° |
| C23 | C22 | H34 | 110.9° | 110.7° |
| C29 | C27 | C26 | 110.8° | 109.5° |
| C29 | C27 | C28 | 108.4° | 109.5° |
| C27 | C29 | H38 | 109.5° | 109.5° |
| C27 | C29 | H39 | 109.5° | 109.5° |
| C27 | C29 | H40 | 109.5° | 109.5° |
| C21 | C19 | C18 | 104.9° | 107.2° |
| C21 | C19 | C24 | 99.7° | 103.4° |
| C21 | C19 | C20 | 114.9° | 110.5° |
| C19 | C21 | H14 | 106.7° | 110.6° |
| C26 | C27 | C28 | 108.6° | 109.5° |
| C27 | C26 | C25 | 175.2° | 180.0° |
| C27 | C28 | H35 | 109.5° | 109.5° |
| C27 | C28 | H36 | 109.5° | 109.5° |
| C27 | C28 | H37 | 109.5° | 109.5° |
| C26 | C25 | C24 | 178.6° | 179.9° |
| C23 | C24 | C25 | 108.9° | 110.3° |
| C23 | C24 | C19 | 101.9° | 105.5° |
| C23 | C24 | O31 | 108.3° | 110.2° |
| C24 | C23 | H15 | 110.0° | 110.0° |
| C24 | C23 | H16 | 110.0° | 110.1° |
| C18 | C7 | C9 | 112.9° | 109.2° |
| C7 | C18 | C19 | 115.0° | 107.2° |
| C18 | C7 | H5 | 106.3° | 109.2° |
| C7 | C18 | H12 | 108.1° | 110.0° |
| C7 | C18 | H13 | 108.1° | 109.9° |
| C7 | C9 | C17 | 125.4° | 119.9° |
| C7 | C9 | C10 | 117.8° | 119.9° |
| C9 | C7 | H5 | 106.6° | 109.2° |
| C25 | C24 | C19 | 116.7° | 110.2° |
| C25 | C24 | O31 | 107.2° | 110.3° |
| C18 | C19 | C24 | 118.8° | 115.6° |
| C18 | C19 | C20 | 109.3° | 109.9° |
| C19 | C18 | H12 | 108.1° | 109.9° |
| C19 | C18 | H13 | 108.1° | 110.0° |
| C24 | C19 | C20 | 109.2° | 109.9° |
| C19 | C24 | O31 | 113.5° | 110.2° |
| C19 | C20 | H30 | 109.5° | 109.5° |
| C19 | C20 | H31 | 109.5° | 109.5° |
| C19 | C20 | H32 | 109.5° | 109.5° |
| C24 | O31 | H41 | 109.5° | 113.9° |
| C9 | C17 | C16 | 121.5° | 120.1° |
| C17 | C9 | C10 | 116.8° | 120.1° |
| C9 | C17 | H11 | 119.2° | 119.9° |
| C17 | C16 | C12 | 121.4° | 119.9° |
| C17 | C16 | H10 | 119.3° | 120.0° |
| C16 | C17 | H11 | 119.2° | 120.0° |
| C9 | C10 | C11 | 122.0° | 120.1° |
| C9 | C10 | H26 | 119.0° | 120.0° |
| C16 | C12 | C11 | 117.3° | 119.9° |
| C16 | C12 | N13 | 121.4° | 120.1° |
| C12 | C16 | H10 | 119.3° | 120.0° |
| C10 | C11 | C12 | 121.0° | 119.9° |
| C10 | C11 | H6 | 119.5° | 120.1° |
| C11 | C10 | H26 | 119.0° | 119.9° |
| C11 | C12 | N13 | 121.3° | 120.0° |
| C12 | C11 | H6 | 119.5° | 120.1° |
| C12 | N13 | C15 | 120.6° | 120.0° |
| C12 | N13 | C14 | 121.5° | 120.0° |
| C15 | N13 | C14 | 117.7° | 120.0° |
| N13 | C15 | H7 | 109.5° | 109.4° |
| N13 | C15 | H8 | 109.5° | 109.5° |
| N13 | C15 | H9 | 109.5° | 109.4° |
| N13 | C14 | H27 | 109.5° | 109.4° |
| N13 | C14 | H28 | 109.5° | 109.5° |
| N13 | C14 | H29 | 109.5° | 109.4° |
| H1 | C3 | H2 | 109.4° | 109.4° |
| H3 | C4 | H4 | 109.5° | 109.6° |
| H7 | C15 | H8 | 109.5° | 109.5° |
| H7 | C15 | H9 | 109.5° | 109.5° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H12 | C18 | H13 | 109.5° | 109.9° |
| H15 | C23 | H16 | 109.5° | 110.1° |
| H17 | C30 | H18 | 109.4° | 109.4° |
| H17 | C30 | H19 | 109.5° | 109.5° |
| H18 | C30 | H19 | 109.4° | 109.4° |
| H21 | C33 | H22 | 109.5° | 109.1° |
| H23 | C34 | H24 | 109.5° | 109.8° |
| H27 | C14 | H28 | 109.5° | 109.5° |
| H27 | C14 | H29 | 109.5° | 109.5° |
| H28 | C14 | H29 | 109.5° | 109.5° |
| H30 | C20 | H31 | 109.5° | 109.5° |
| H30 | C20 | H32 | 109.5° | 109.5° |
| H31 | C20 | H32 | 109.5° | 109.4° |
| H33 | C22 | H34 | 109.4° | 110.7° |
| H35 | C28 | H36 | 109.5° | 109.4° |
| H35 | C28 | H37 | 109.5° | 109.5° |
| H36 | C28 | H37 | 109.5° | 109.4° |
| H38 | C29 | H39 | 109.4° | 109.4° |
| H38 | C29 | H40 | 109.5° | 109.4° |
| H39 | C29 | H40 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C2 | C36 | C3 | 179.2° | 179.8° |
| O1 | C2 | C36 | C35 | 180.0° | 171.5° |
| O1 | C2 | C3 | C4 | 165.3° | 142.7° |
| O1 | C2 | C3 | H1 | 73.9° | 97.2° |
| O1 | C2 | C3 | H2 | 44.6° | 22.6° |
| O1 | C2 | C36 | H25 | 0.0° | 8.4° |
| C2 | C36 | C35 | H25 | 180.0° | 180.0° |
| C2 | C36 | C35 | C34 | 179.8° | 175.7° |
| C2 | C36 | C35 | C5 | 0.2° | 4.6° |
| C36 | C2 | C3 | C4 | 13.9° | 37.1° |
| C36 | C2 | C3 | H1 | 106.9° | 83.1° |
| C36 | C2 | C3 | H2 | 134.6° | 157.2° |
| C35 | C36 | C2 | C3 | 0.9° | 8.2° |
| C36 | C35 | C34 | C5 | 179.6° | 179.7° |
| C36 | C35 | C34 | C33 | 136.3° | 137.4° |
| C36 | C35 | C5 | C4 | 15.5° | 14.1° |
| C36 | C35 | C5 | C6 | 165.6° | 167.1° |
| C36 | C35 | C34 | H23 | 104.1° | 17.9° |
| C36 | C35 | C34 | H24 | 16.6° | 103.0° |
| C2 | C3 | C4 | H1 | 120.8° | 120.1° |
| C2 | C3 | C4 | H2 | 120.8° | 120.1° |
| C2 | C3 | C4 | C5 | 27.9° | 50.5° |
| C2 | C3 | H1 | H2 | 117.7° | 119.8° |
| C2 | C3 | C4 | H3 | 148.7° | 170.3° |
| C2 | C3 | C4 | H4 | 92.9° | 69.3° |
| C3 | C2 | C36 | H25 | 179.1° | 171.8° |
| C35 | C34 | C33 | H23 | 119.6° | 119.5° |
| C35 | C34 | C33 | H24 | 119.6° | 119.6° |
| C35 | C34 | C33 | C32 | 58.7° | 57.6° |
| C34 | C35 | C5 | C4 | 164.0° | 165.6° |
| C34 | C35 | C5 | C6 | 14.8° | 13.3° |
| C35 | C34 | C33 | H21 | 178.6° | 63.0° |
| C35 | C34 | C33 | H22 | 61.2° | 178.1° |
| C35 | C34 | H23 | H24 | 121.0° | 120.8° |
| C34 | C35 | C36 | H25 | 0.2° | 4.3° |
| C33 | C34 | C35 | C5 | 44.1° | 42.9° |
| C34 | C33 | C32 | H21 | 119.9° | 120.6° |
| C34 | C33 | C32 | H22 | 119.9° | 120.4° |
| C34 | C33 | C32 | C6 | 49.5° | 44.2° |
| C34 | C33 | C32 | C21 | 173.8° | 164.2° |
| C34 | C33 | C32 | H20 | 62.7° | 77.0° |
| C34 | C33 | H21 | H22 | 120.2° | 118.9° |
| C33 | C34 | H23 | H24 | 121.0° | 120.9° |
| C35 | C5 | C4 | C3 | 29.3° | 42.0° |
| C35 | C5 | C4 | C6 | 178.8° | 178.9° |
| C35 | C5 | C6 | C32 | 1.1° | 3.0° |
| C35 | C5 | C6 | C7 | 176.6° | 177.0° |
| C35 | C5 | C4 | H3 | 150.1° | 161.8° |
| C35 | C5 | C4 | H4 | 91.5° | 77.8° |
| C5 | C35 | C34 | H23 | 75.5° | 162.4° |
| C5 | C35 | C34 | H24 | 163.8° | 76.7° |
| C5 | C35 | C36 | H25 | 179.8° | 175.3° |
| C33 | C32 | C6 | C5 | 19.7° | 13.2° |
| C33 | C32 | C6 | C21 | 135.8° | 121.0° |
| C33 | C32 | C6 | H20 | 112.1° | 121.0° |
| C33 | C32 | C21 | H20 | 110.9° | 118.5° |
| C33 | C32 | C6 | C7 | 164.7° | 166.8° |
| C33 | C32 | C21 | C22 | 58.8° | 66.6° |
| C33 | C32 | C21 | C19 | 178.7° | 179.0° |
| C33 | C32 | C21 | H14 | 61.7° | 59.8° |
| C32 | C33 | H21 | H22 | 120.2° | 119.0° |
| C32 | C33 | C34 | H23 | 60.9° | 177.2° |
| C32 | C33 | C34 | H24 | 178.3° | 62.0° |
| C3 | C4 | C5 | H3 | 120.8° | 119.8° |
| C3 | C4 | C5 | H4 | 120.8° | 119.8° |
| C3 | C4 | C5 | C6 | 151.9° | 139.1° |
| C4 | C3 | H1 | H2 | 117.7° | 119.8° |
| C3 | C4 | H3 | H4 | 117.6° | 120.3° |
| C4 | C5 | C6 | C32 | 177.7° | 178.2° |
| C4 | C5 | C6 | C7 | 2.2° | 1.9° |
| C5 | C4 | C3 | H1 | 92.9° | 69.6° |
| C5 | C4 | C3 | H2 | 148.7° | 170.6° |
| C5 | C4 | H3 | H4 | 117.5° | 120.4° |
| C5 | C6 | C32 | C7 | 175.6° | 180.0° |
| C5 | C6 | C32 | C21 | 155.5° | 134.2° |
| C5 | C6 | C7 | C18 | 154.9° | 136.9° |
| C5 | C6 | C7 | C9 | 77.3° | 102.7° |
| C6 | C5 | C4 | H3 | 31.1° | 19.3° |
| C6 | C5 | C4 | H4 | 87.3° | 101.1° |
| C5 | C6 | C7 | H5 | 37.9° | 16.6° |
| C5 | C6 | C32 | H20 | 92.4° | 107.8° |
| C30 | C27 | C29 | C26 | 123.9° | 120.0° |
| C30 | C27 | C29 | C28 | 117.0° | 120.0° |
| C30 | C27 | C26 | C28 | 117.1° | 120.0° |
| C30 | C27 | C26 | C25 | 97.0° | 49.3° |
| C27 | C30 | H17 | H18 | 120.0° | 120.0° |
| C27 | C30 | H17 | H19 | 120.0° | 120.1° |
| C27 | C30 | H18 | H19 | 120.0° | 120.0° |
| C30 | C27 | C28 | H35 | 180.0° | 60.0° |
| C30 | C27 | C28 | H36 | 60.0° | 60.0° |
| C30 | C27 | C28 | H37 | 60.0° | 180.0° |
| C30 | C27 | C29 | H38 | 180.0° | 180.0° |
| C30 | C27 | C29 | H39 | 60.0° | 60.0° |
| C30 | C27 | C29 | H40 | 60.0° | 60.0° |
| C6 | C32 | C21 | H20 | 112.1° | 118.0° |
| C6 | C32 | C21 | C22 | 164.2° | 169.9° |
| C6 | C32 | C21 | C19 | 44.3° | 57.5° |
| C32 | C6 | C7 | C18 | 29.6° | 43.2° |
| C32 | C6 | C7 | C9 | 98.2° | 77.2° |
| C32 | C6 | C7 | H5 | 146.6° | 163.5° |
| C6 | C32 | C21 | H14 | 75.3° | 63.6° |
| C6 | C32 | C33 | H21 | 169.4° | 76.4° |
| C6 | C32 | C33 | H22 | 70.4° | 164.6° |
| C21 | C32 | C6 | C7 | 28.9° | 45.8° |
| C32 | C21 | C22 | C19 | 128.0° | 115.6° |
| C32 | C21 | C22 | H14 | 120.7° | 126.8° |
| C32 | C21 | C22 | C23 | 166.7° | 156.8° |
| C32 | C21 | C19 | H14 | 120.0° | 121.6° |
| C32 | C21 | C19 | C18 | 56.9° | 72.8° |
| C32 | C21 | C19 | C24 | 179.6° | 164.6° |
| C32 | C21 | C19 | C20 | 63.1° | 47.0° |
| C21 | C32 | C33 | H21 | 53.8° | 43.6° |
| C21 | C32 | C33 | H22 | 66.3° | 75.4° |
| C32 | C21 | C22 | H33 | 47.7° | 38.4° |
| C32 | C21 | C22 | H34 | 74.1° | 84.8° |
| C6 | C7 | C18 | C9 | 126.3° | 120.4° |
| C6 | C7 | C18 | H5 | 117.2° | 120.3° |
| C6 | C7 | C9 | H5 | 115.3° | 119.3° |
| C6 | C7 | C18 | C19 | 46.3° | 51.5° |
| C6 | C7 | C9 | C17 | 14.0° | 16.4° |
| C6 | C7 | C9 | C10 | 168.4° | 163.9° |
| C6 | C7 | C18 | H12 | 74.5° | 67.9° |
| C6 | C7 | C18 | H13 | 167.1° | 171.0° |
| C7 | C6 | C32 | H20 | 83.3° | 72.1° |
| C21 | C22 | C23 | H33 | 119.1° | 118.4° |
| C21 | C22 | C23 | H34 | 119.1° | 118.5° |
| C22 | C21 | C19 | H14 | 111.6° | 117.5° |
| C21 | C22 | C23 | C24 | 11.9° | 23.8° |
| C22 | C21 | C19 | C18 | 174.7° | 166.2° |
| C22 | C21 | C19 | C24 | 51.2° | 43.6° |
| C22 | C21 | C19 | C20 | 65.3° | 74.0° |
| C21 | C22 | C23 | H15 | 131.5° | 95.3° |
| C21 | C22 | C23 | H16 | 107.8° | 143.1° |
| C22 | C21 | C32 | H20 | 52.1° | 51.9° |
| C21 | C22 | H33 | H34 | 122.6° | 123.2° |
| C23 | C22 | C21 | C19 | 38.8° | 41.1° |
| C22 | C23 | C24 | H15 | 119.6° | 119.2° |
| C22 | C23 | C24 | H16 | 119.7° | 119.3° |
| C22 | C23 | C24 | C25 | 104.0° | 115.8° |
| C22 | C23 | C24 | C19 | 19.9° | 3.1° |
| C22 | C23 | C24 | O31 | 139.8° | 122.1° |
| C23 | C22 | C21 | H14 | 72.5° | 76.4° |
| C22 | C23 | H15 | H16 | 121.0° | 121.6° |
| C23 | C22 | H33 | H34 | 122.6° | 123.1° |
| C29 | C27 | C26 | C28 | 119.0° | 120.1° |
| C29 | C27 | C26 | C25 | 27.0° | 169.3° |
| C29 | C27 | C30 | H17 | 180.0° | 60.0° |
| C29 | C27 | C30 | H18 | 60.0° | 60.0° |
| C29 | C27 | C30 | H19 | 60.0° | 180.0° |
| C29 | C27 | C28 | H35 | 60.2° | 180.0° |
| C29 | C27 | C28 | H36 | 59.8° | 60.0° |
| C29 | C27 | C28 | H37 | 179.8° | 60.0° |
| C27 | C29 | H38 | H39 | 120.0° | 120.0° |
| C27 | C29 | H38 | H40 | 120.0° | 120.0° |
| C27 | C29 | H39 | H40 | 120.0° | 120.1° |
| C21 | C19 | C24 | C23 | 43.2° | 28.6° |
| C21 | C19 | C18 | C7 | 57.2° | 68.0° |
| C21 | C19 | C24 | C25 | 75.3° | 90.4° |
| C21 | C19 | C18 | C24 | 110.2° | 114.7° |
| C21 | C19 | C18 | C20 | 123.7° | 120.2° |
| C21 | C19 | C24 | C20 | 120.8° | 118.0° |
| C21 | C19 | C24 | O31 | 159.4° | 147.6° |
| C21 | C19 | C18 | H12 | 63.6° | 51.5° |
| C21 | C19 | C18 | H13 | 178.0° | 172.6° |
| C19 | C21 | C32 | H20 | 67.7° | 60.5° |
| C21 | C19 | C20 | H30 | 180.0° | 49.4° |
| C21 | C19 | C20 | H31 | 60.0° | 70.6° |
| C21 | C19 | C20 | H32 | 60.0° | 169.4° |
| C19 | C21 | C22 | H33 | 80.3° | 77.2° |
| C19 | C21 | C22 | H34 | 157.9° | 159.6° |
| C27 | C26 | C25 | C24 | 124.0° | 106.0° |
| C26 | C27 | C30 | H17 | 56.3° | 60.0° |
| C26 | C27 | C30 | H18 | 176.3° | 180.0° |
| C26 | C27 | C30 | H19 | 63.8° | 60.0° |
| C26 | C27 | C28 | H35 | 60.2° | 60.0° |
| C26 | C27 | C28 | H36 | 179.8° | 180.0° |
| C26 | C27 | C28 | H37 | 59.8° | 60.1° |
| C26 | C27 | C29 | H38 | 56.1° | 60.0° |
| C26 | C27 | C29 | H39 | 63.9° | 180.0° |
| C26 | C27 | C29 | H40 | 176.1° | 59.9° |
| C28 | C27 | C26 | C25 | 146.0° | 70.7° |
| C28 | C27 | C30 | H17 | 62.0° | 180.0° |
| C28 | C27 | C30 | H18 | 58.0° | 60.0° |
| C28 | C27 | C30 | H19 | 178.0° | 59.9° |
| C27 | C28 | H35 | H36 | 120.0° | 120.0° |
| C27 | C28 | H35 | H37 | 120.0° | 120.1° |
| C27 | C28 | H36 | H37 | 120.0° | 120.0° |
| C28 | C27 | C29 | H38 | 63.0° | 60.0° |
| C28 | C27 | C29 | H39 | 177.0° | 60.0° |
| C28 | C27 | C29 | H40 | 57.0° | 180.0° |
| C26 | C25 | C24 | C23 | 115.4° | 99.3° |
| C26 | C25 | C24 | C19 | 0.8° | 144.7° |
| C26 | C25 | C24 | O31 | 127.6° | 22.8° |
| C23 | C24 | C25 | C19 | 114.6° | 116.0° |
| C23 | C24 | C25 | O31 | 117.0° | 122.0° |
| C23 | C24 | C19 | C18 | 156.2° | 145.4° |
| C23 | C24 | C19 | O31 | 116.2° | 119.0° |
| C23 | C24 | C19 | C20 | 77.6° | 89.4° |
| C24 | C23 | H15 | H16 | 121.1° | 121.5° |
| C24 | C23 | C22 | H33 | 107.2° | 94.6° |
| C24 | C23 | C22 | H34 | 131.0° | 142.3° |
| C23 | C24 | O31 | H41 | 180.0° | 64.0° |
| C18 | C7 | C9 | H5 | 116.3° | 119.3° |
| C7 | C18 | C19 | H12 | 120.8° | 119.5° |
| C7 | C18 | C19 | H13 | 120.8° | 119.4° |
| C7 | C18 | C19 | C24 | 167.4° | 177.4° |
| C7 | C18 | C19 | C20 | 66.5° | 52.2° |
| C18 | C7 | C9 | C17 | 114.3° | 137.8° |
| C18 | C7 | C9 | C10 | 63.2° | 42.5° |
| C7 | C18 | H12 | H13 | 117.5° | 121.1° |
| C9 | C7 | C18 | C19 | 80.0° | 68.9° |
| C7 | C9 | C17 | C10 | 177.6° | 179.7° |
| C7 | C9 | C17 | C16 | 178.8° | 180.0° |
| C7 | C9 | C10 | C11 | 178.9° | 179.8° |
| C7 | C9 | C17 | H11 | 1.2° | 0.2° |
| C9 | C7 | C18 | H12 | 159.2° | 171.7° |
| C9 | C7 | C18 | H13 | 40.8° | 50.6° |
| C7 | C9 | C10 | H26 | 1.1° | 0.0° |
| C25 | C24 | C19 | C18 | 37.7° | 26.4° |
| C25 | C24 | C19 | O31 | 125.3° | 122.0° |
| C25 | C24 | C19 | C20 | 163.9° | 151.6° |
| C25 | C24 | C23 | H15 | 136.4° | 3.3° |
| C25 | C24 | C23 | H16 | 15.7° | 124.8° |
| C25 | C24 | O31 | H41 | 62.6° | 58.1° |
| C18 | C19 | C24 | C20 | 126.2° | 125.2° |
| C18 | C19 | C24 | O31 | 87.6° | 95.6° |
| C19 | C18 | C7 | H5 | 163.5° | 171.8° |
| C19 | C18 | H12 | H13 | 117.5° | 121.1° |
| C18 | C19 | C21 | H14 | 63.1° | 48.8° |
| C18 | C19 | C20 | H30 | 62.5° | 68.7° |
| C18 | C19 | C20 | H31 | 57.5° | 171.3° |
| C18 | C19 | C20 | H32 | 177.5° | 51.3° |
| C24 | C19 | C18 | H12 | 46.6° | 63.1° |
| C24 | C19 | C18 | H13 | 71.8° | 58.0° |
| C24 | C19 | C21 | H14 | 60.4° | 73.8° |
| C19 | C24 | C23 | H15 | 99.7° | 122.3° |
| C19 | C24 | C23 | H16 | 139.5° | 116.2° |
| C24 | C19 | C20 | H30 | 69.0° | 163.0° |
| C24 | C19 | C20 | H31 | 171.0° | 42.9° |
| C24 | C19 | C20 | H32 | 51.0° | 77.1° |
| C19 | C24 | O31 | H41 | 67.6° | 180.0° |
| C20 | C19 | C24 | O31 | 38.6° | 29.6° |
| C20 | C19 | C18 | H12 | 172.7° | 171.7° |
| C20 | C19 | C18 | H13 | 54.3° | 67.2° |
| C20 | C19 | C21 | H14 | 176.9° | 168.6° |
| C19 | C20 | H30 | H31 | 120.0° | 120.0° |
| C19 | C20 | H30 | H32 | 120.0° | 120.0° |
| C19 | C20 | H31 | H32 | 120.0° | 120.0° |
| O31 | C24 | C23 | H15 | 20.2° | 118.8° |
| O31 | C24 | C23 | H16 | 100.5° | 2.7° |
| C9 | C17 | C16 | H11 | 180.0° | 179.8° |
| C9 | C17 | C16 | C12 | 0.3° | 0.0° |
| C17 | C9 | C10 | C11 | 1.1° | 0.5° |
| C17 | C9 | C7 | H5 | 129.4° | 102.9° |
| C9 | C17 | C16 | H10 | 179.7° | 180.0° |
| C17 | C9 | C10 | H26 | 178.9° | 179.7° |
| C16 | C17 | C9 | C10 | 1.2° | 0.3° |
| C17 | C16 | C12 | H10 | 180.0° | 180.0° |
| C17 | C16 | C12 | C11 | 0.7° | 0.0° |
| C17 | C16 | C12 | N13 | 178.9° | 180.0° |
| C9 | C10 | C11 | H26 | 180.0° | 179.7° |
| C9 | C10 | C11 | C12 | 0.2° | 0.5° |
| C10 | C9 | C7 | H5 | 53.1° | 76.8° |
| C9 | C10 | C11 | H6 | 179.8° | 179.8° |
| C10 | C9 | C17 | H11 | 178.8° | 179.9° |
| C16 | C12 | C11 | C10 | 0.7° | 0.3° |
| C16 | C12 | C11 | N13 | 178.2° | 180.0° |
| C16 | C12 | N13 | C15 | 46.3° | 174.1° |
| C16 | C12 | N13 | C14 | 138.2° | 5.9° |
| C16 | C12 | C11 | H6 | 179.3° | 180.0° |
| C12 | C16 | C17 | H11 | 179.7° | 179.8° |
| C10 | C11 | C12 | H6 | 180.0° | 179.7° |
| C10 | C11 | C12 | N13 | 178.9° | 179.7° |
| C11 | C12 | N13 | C15 | 131.9° | 5.9° |
| C11 | C12 | N13 | C14 | 43.7° | 174.1° |
| C11 | C12 | C16 | H10 | 179.3° | 180.0° |
| C12 | C11 | C10 | H26 | 179.8° | 179.8° |
| C12 | N13 | C15 | C14 | 175.7° | 180.0° |
| N13 | C12 | C11 | H6 | 1.0° | 0.0° |
| C12 | N13 | C15 | H7 | 180.0° | 5.2° |
| C12 | N13 | C15 | H8 | 60.0° | 125.2° |
| C12 | N13 | C15 | H9 | 60.0° | 114.9° |
| N13 | C12 | C16 | H10 | 1.1° | 0.0° |
| C12 | N13 | C14 | H27 | 180.0° | 89.9° |
| C12 | N13 | C14 | H28 | 60.0° | 150.0° |
| C12 | N13 | C14 | H29 | 60.0° | 30.0° |
| N13 | C15 | H7 | H8 | 120.0° | 120.0° |
| N13 | C15 | H7 | H9 | 120.0° | 120.0° |
| N13 | C15 | H8 | H9 | 120.0° | 119.9° |
| C15 | N13 | C14 | H27 | 4.3° | 90.1° |
| C15 | N13 | C14 | H28 | 115.7° | 30.0° |
| C15 | N13 | C14 | H29 | 124.3° | 150.0° |
| C14 | N13 | C15 | H7 | 4.3° | 174.8° |
| C14 | N13 | C15 | H8 | 124.3° | 54.8° |
| C14 | N13 | C15 | H9 | 115.7° | 65.1° |
| N13 | C14 | H27 | H28 | 120.0° | 120.0° |
| N13 | C14 | H27 | H29 | 120.0° | 119.9° |
| N13 | C14 | H28 | H29 | 120.0° | 120.0° |
| H1 | C3 | C4 | H3 | 27.9° | 50.2° |
| H1 | C3 | C4 | H4 | 146.3° | 170.5° |
| H2 | C3 | C4 | H3 | 90.6° | 69.6° |
| H2 | C3 | C4 | H4 | 27.9° | 50.7° |
| H5 | C7 | C18 | H12 | 42.7° | 52.4° |
| H5 | C7 | C18 | H13 | 75.6° | 68.7° |
| H6 | C11 | C10 | H26 | 0.2° | 0.0° |
| H7 | C15 | H8 | H9 | 120.0° | 120.1° |
| H10 | C16 | C17 | H11 | 0.3° | 0.2° |
| H14 | C21 | C32 | H20 | 172.7° | 178.3° |
| H14 | C21 | C22 | H33 | 168.4° | 165.2° |
| H14 | C21 | C22 | H34 | 46.6° | 42.0° |
| H15 | C23 | C22 | H33 | 12.4° | 146.3° |
| H15 | C23 | C22 | H34 | 109.4° | 23.1° |
| H16 | C23 | C22 | H33 | 133.1° | 24.7° |
| H16 | C23 | C22 | H34 | 11.3° | 98.4° |
| H17 | C30 | H18 | H19 | 120.0° | 120.0° |
| H20 | C32 | C33 | H21 | 57.3° | 162.3° |
| H20 | C32 | C33 | H22 | 177.4° | 43.3° |
| H21 | C33 | C34 | H23 | 59.0° | 56.6° |
| H21 | C33 | C34 | H24 | 61.7° | 177.4° |
| H22 | C33 | C34 | H23 | 179.1° | 62.4° |
| H22 | C33 | C34 | H24 | 58.4° | 58.5° |
| H27 | C14 | H28 | H29 | 120.0° | 120.0° |
| H30 | C20 | H31 | H32 | 120.0° | 120.0° |
| H35 | C28 | H36 | H37 | 120.0° | 119.9° |
| H38 | C29 | H39 | H40 | 120.0° | 119.9° |
