SQ3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL1 | C9 | sing | 1.74Å | 1.80Å | |
| C16 | C13 | sing | 1.54Å | 1.53Å | |
| C16 | C34 | sing | 1.54Å | 1.49Å | |
| C16 | C18 | sing | 1.53Å | 1.56Å | |
| C13 | N13 | sing | 1.48Å | 1.47Å | |
| O1 | C3 | sing | 1.36Å | 1.36Å | |
| O1 | C11 | sing | 1.43Å | 1.42Å | |
| C9 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | C7 | sing | 1.38Å | 1.40Å | Aromatic |
| O38 | C15 | doub | 1.21Å | 1.22Å | |
| C23 | C18 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| C7 | C6 | doub | 1.38Å | 1.41Å | Aromatic |
| C34 | C18 | sing | 1.53Å | 1.56Å | |
| C34 | C14 | sing | 1.54Å | 1.53Å | |
| C11 | C12 | sing | 1.51Å | 1.50Å | |
| N13 | C12 | sing | 1.35Å | 1.33Å | |
| N13 | C14 | sing | 1.48Å | 1.45Å | |
| C4 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C25 | sing | 1.53Å | 1.54Å | |
| C6 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | CL2 | sing | 1.74Å | 1.83Å | |
| C15 | C14 | sing | 1.51Å | 1.51Å | |
| C15 | N16 | sing | 1.35Å | 1.33Å | |
| C12 | O33 | doub | 1.21Å | 1.22Å | |
| C21 | C22 | sing | 1.54Å | 1.53Å | |
| C21 | C20 | sing | 1.55Å | 1.53Å | |
| C22 | N23 | sing | 1.47Å | 1.46Å | |
| C17 | N16 | sing | 1.46Å | 1.46Å | |
| C17 | C8 | sing | 1.53Å | 1.54Å | |
| C17 | C19 | sing | 1.53Å | 1.55Å | |
| O9 | C8 | sing | 1.43Å | 1.45Å | |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| C20 | C24 | sing | 1.51Å | 1.50Å | |
| N23 | C24 | sing | 1.34Å | 1.34Å | |
| C24 | O26 | doub | 1.21Å | 1.22Å | |
| C11 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C14 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C34 | H21 | sing | 1.09Å | 1.10Å | |
| C4 | H22 | sing | 1.08Å | 1.08Å | |
| C5 | H23 | sing | 1.08Å | 1.08Å | |
| C7 | H24 | sing | 1.08Å | 1.08Å | |
| C8 | H25 | sing | 1.09Å | 1.10Å | |
| C8 | H26 | sing | 1.09Å | 1.10Å | |
| N16 | H27 | sing | 0.97Å | 1.00Å | |
| N23 | H28 | sing | 0.97Å | 1.00Å | |
| O9 | H29 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL1 | C9 | C3 | 119.2° | 120.0° |
| CL1 | C9 | C7 | 121.3° | 120.0° |
| C13 | C16 | C34 | 105.3° | 105.0° |
| C13 | C16 | C18 | 119.1° | 118.1° |
| C16 | C13 | N13 | 106.3° | 104.6° |
| C16 | C13 | H3 | 110.3° | 110.4° |
| C16 | C13 | H4 | 110.2° | 110.5° |
| C13 | C16 | H6 | 118.8° | 117.6° |
| C34 | C16 | C18 | 61.3° | 59.7° |
| C16 | C34 | C18 | 61.5° | 59.7° |
| C16 | C34 | C14 | 110.2° | 105.0° |
| C34 | C16 | H6 | 119.6° | 121.8° |
| C16 | C34 | H21 | 120.1° | 121.8° |
| C16 | C18 | C23 | 96.7° | 117.4° |
| C16 | C18 | C34 | 57.2° | 60.5° |
| C16 | C18 | C25 | 97.1° | 117.5° |
| C18 | C16 | H6 | 118.2° | 120.3° |
| C13 | N13 | C12 | 125.9° | 127.8° |
| C13 | N13 | C14 | 113.1° | 104.3° |
| N13 | C13 | H3 | 110.3° | 110.4° |
| N13 | C13 | H4 | 110.2° | 110.4° |
| C3 | O1 | C11 | 121.3° | 117.0° |
| O1 | C3 | C9 | 120.6° | 120.1° |
| O1 | C3 | C4 | 118.8° | 120.0° |
| O1 | C11 | C12 | 106.7° | 109.5° |
| O1 | C11 | H1 | 110.2° | 109.5° |
| O1 | C11 | H2 | 110.2° | 109.5° |
| C3 | C9 | C7 | 119.4° | 120.0° |
| C9 | C3 | C4 | 120.6° | 119.9° |
| C9 | C7 | C6 | 120.1° | 120.0° |
| C9 | C7 | H24 | 120.0° | 120.0° |
| O38 | C15 | C14 | 120.5° | 120.0° |
| O38 | C15 | N16 | 122.3° | 120.0° |
| C23 | C18 | C34 | 117.1° | 117.4° |
| C23 | C18 | C25 | 111.5° | 115.5° |
| C18 | C23 | H15 | 109.5° | 109.5° |
| C18 | C23 | H16 | 109.4° | 109.5° |
| C18 | C23 | H17 | 109.4° | 109.4° |
| C3 | C4 | C5 | 120.0° | 119.9° |
| C3 | C4 | H22 | 120.0° | 120.0° |
| C7 | C6 | C5 | 119.2° | 120.1° |
| C7 | C6 | CL2 | 123.5° | 119.9° |
| C6 | C7 | H24 | 120.0° | 120.0° |
| C18 | C34 | C14 | 113.5° | 118.1° |
| C34 | C18 | C25 | 126.4° | 117.5° |
| C18 | C34 | H21 | 118.8° | 119.5° |
| C34 | C14 | N13 | 104.1° | 104.6° |
| C34 | C14 | C15 | 110.0° | 110.4° |
| C34 | C14 | H5 | 110.2° | 110.4° |
| C14 | C34 | H21 | 119.4° | 118.2° |
| C11 | C12 | N13 | 115.4° | 120.0° |
| C11 | C12 | O33 | 120.3° | 120.0° |
| C12 | C11 | H1 | 110.2° | 109.5° |
| C12 | C11 | H2 | 110.2° | 109.5° |
| C12 | N13 | C14 | 121.0° | 127.9° |
| N13 | C12 | O33 | 124.4° | 120.0° |
| N13 | C14 | C15 | 110.6° | 110.5° |
| N13 | C14 | H5 | 111.3° | 110.4° |
| C4 | C5 | C6 | 120.6° | 120.1° |
| C5 | C4 | H22 | 120.0° | 120.1° |
| C4 | C5 | H23 | 119.7° | 119.9° |
| C18 | C25 | H18 | 109.5° | 109.5° |
| C18 | C25 | H19 | 109.5° | 109.5° |
| C18 | C25 | H20 | 109.5° | 109.5° |
| C5 | C6 | CL2 | 117.3° | 119.9° |
| C6 | C5 | H23 | 119.7° | 120.0° |
| C14 | C15 | N16 | 117.2° | 120.0° |
| C15 | C14 | H5 | 110.5° | 110.4° |
| C15 | N16 | C17 | 120.9° | 120.0° |
| C15 | N16 | H27 | 119.5° | 119.9° |
| C22 | C21 | C20 | 104.6° | 101.8° |
| C21 | C22 | N23 | 104.8° | 105.5° |
| C22 | C21 | H11 | 110.7° | 111.0° |
| C22 | C21 | H12 | 110.7° | 110.9° |
| C21 | C22 | H13 | 110.6° | 110.2° |
| C21 | C22 | H14 | 110.6° | 110.3° |
| C21 | C20 | C19 | 114.5° | 110.5° |
| C21 | C20 | C24 | 103.0° | 104.2° |
| C21 | C20 | H10 | 108.4° | 110.6° |
| C20 | C21 | H11 | 110.7° | 111.0° |
| C20 | C21 | H12 | 110.6° | 111.0° |
| C22 | N23 | C24 | 112.0° | 111.3° |
| N23 | C22 | H13 | 110.6° | 110.2° |
| N23 | C22 | H14 | 110.6° | 110.2° |
| C22 | N23 | H28 | 124.0° | 124.3° |
| N16 | C17 | C8 | 106.4° | 109.5° |
| N16 | C17 | C19 | 110.8° | 109.5° |
| N16 | C17 | H7 | 109.9° | 109.5° |
| C17 | N16 | H27 | 119.5° | 120.1° |
| C8 | C17 | C19 | 112.2° | 109.5° |
| C17 | C8 | O9 | 111.7° | 109.5° |
| C8 | C17 | H7 | 108.8° | 109.5° |
| C17 | C8 | H25 | 108.9° | 109.5° |
| C17 | C8 | H26 | 108.9° | 109.5° |
| C17 | C19 | C20 | 110.7° | 109.5° |
| C19 | C17 | H7 | 108.6° | 109.5° |
| C17 | C19 | H8 | 109.1° | 109.4° |
| C17 | C19 | H9 | 109.1° | 109.5° |
| O9 | C8 | H25 | 108.9° | 109.5° |
| O9 | C8 | H26 | 108.9° | 109.5° |
| C8 | O9 | H29 | 109.5° | 114.0° |
| C19 | C20 | C24 | 113.5° | 110.5° |
| C20 | C19 | H8 | 109.2° | 109.5° |
| C20 | C19 | H9 | 109.2° | 109.5° |
| C19 | C20 | H10 | 108.4° | 110.4° |
| C20 | C24 | N23 | 111.0° | 110.1° |
| C20 | C24 | O26 | 122.4° | 125.0° |
| C24 | C20 | H10 | 108.8° | 110.5° |
| N23 | C24 | O26 | 126.6° | 124.9° |
| C24 | N23 | H28 | 124.0° | 124.4° |
| H1 | C11 | H2 | 109.4° | 109.4° |
| H3 | C13 | H4 | 109.5° | 110.4° |
| H8 | C19 | H9 | 109.5° | 109.5° |
| H11 | C21 | H12 | 109.5° | 110.9° |
| H13 | C22 | H14 | 109.5° | 110.3° |
| H15 | C23 | H16 | 109.5° | 109.5° |
| H15 | C23 | H17 | 109.5° | 109.5° |
| H16 | C23 | H17 | 109.5° | 109.5° |
| H18 | C25 | H19 | 109.5° | 109.5° |
| H18 | C25 | H20 | 109.5° | 109.5° |
| H19 | C25 | H20 | 109.4° | 109.5° |
| H25 | C8 | H26 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL1 | C9 | C3 | O1 | 0.5° | 0.4° |
| CL1 | C9 | C3 | C7 | 179.8° | 179.9° |
| CL1 | C9 | C3 | C4 | 178.6° | 179.9° |
| CL1 | C9 | C7 | C6 | 179.8° | 179.9° |
| CL1 | C9 | C7 | H24 | 0.2° | 0.1° |
| C13 | C16 | C34 | C18 | 115.1° | 114.1° |
| C13 | C16 | C34 | H6 | 136.9° | 136.9° |
| C13 | C16 | C18 | H6 | 157.5° | 156.9° |
| C16 | C13 | N13 | H3 | 119.5° | 118.8° |
| C16 | C13 | N13 | H4 | 119.5° | 118.9° |
| C13 | C16 | C18 | C23 | 149.6° | 160.9° |
| C13 | C16 | C34 | C14 | 8.6° | 0.0° |
| C16 | C13 | N13 | C12 | 171.1° | 140.4° |
| C16 | C13 | N13 | C14 | 7.6° | 39.6° |
| C13 | C16 | C18 | C25 | 36.8° | 16.1° |
| C16 | C13 | H3 | H4 | 121.4° | 122.5° |
| C13 | C16 | C34 | H21 | 136.3° | 137.8° |
| C34 | C16 | C18 | H6 | 110.2° | 111.5° |
| C34 | C16 | C13 | N13 | 9.6° | 23.9° |
| C16 | C34 | C18 | C23 | 79.9° | 107.6° |
| C16 | C34 | C18 | C14 | 101.1° | 91.6° |
| C16 | C34 | C18 | H21 | 110.7° | 111.8° |
| C16 | C34 | C14 | H21 | 145.2° | 139.7° |
| C16 | C34 | C14 | N13 | 4.2° | 23.9° |
| C34 | C16 | C18 | C25 | 129.1° | 107.7° |
| C16 | C34 | C14 | C15 | 122.7° | 95.0° |
| C34 | C16 | C13 | H3 | 109.9° | 94.9° |
| C34 | C16 | C13 | H4 | 129.1° | 142.7° |
| C16 | C34 | C14 | H5 | 115.2° | 142.6° |
| C18 | C16 | C13 | N13 | 55.7° | 39.5° |
| C16 | C18 | C23 | C25 | 100.4° | 145.4° |
| C18 | C16 | C13 | H3 | 175.2° | 158.2° |
| C18 | C16 | C13 | H4 | 63.8° | 79.4° |
| C16 | C18 | C23 | H15 | 180.0° | 8.6° |
| C16 | C18 | C23 | H16 | 60.0° | 128.6° |
| C16 | C18 | C23 | H17 | 60.0° | 111.4° |
| C16 | C18 | C25 | H18 | 180.0° | 111.4° |
| C16 | C18 | C25 | H19 | 60.0° | 128.6° |
| C16 | C18 | C25 | H20 | 60.0° | 8.6° |
| C13 | N13 | C14 | C34 | 2.2° | 39.6° |
| C13 | N13 | C12 | C11 | 10.9° | 0.0° |
| C13 | N13 | C12 | C14 | 178.6° | 180.0° |
| C13 | N13 | C14 | C15 | 115.8° | 79.3° |
| C13 | N13 | C12 | O33 | 169.2° | 180.0° |
| N13 | C13 | H3 | H4 | 121.4° | 122.3° |
| C13 | N13 | C14 | H5 | 120.9° | 158.3° |
| N13 | C13 | C16 | H6 | 146.9° | 163.0° |
| O1 | C3 | C9 | C4 | 178.1° | 179.7° |
| O1 | C3 | C9 | C7 | 179.3° | 179.8° |
| C3 | O1 | C11 | C12 | 104.2° | 180.0° |
| O1 | C3 | C4 | C5 | 179.3° | 179.7° |
| C3 | O1 | C11 | H1 | 15.4° | 60.0° |
| C3 | O1 | C11 | H2 | 136.3° | 60.0° |
| O1 | C3 | C4 | H22 | 0.6° | 0.3° |
| C11 | O1 | C3 | C9 | 136.8° | 179.7° |
| C11 | O1 | C3 | C4 | 45.0° | 0.0° |
| O1 | C11 | C12 | H1 | 119.6° | 120.0° |
| O1 | C11 | C12 | H2 | 119.6° | 120.0° |
| O1 | C11 | C12 | N13 | 110.6° | 180.0° |
| O1 | C11 | C12 | O33 | 69.5° | 0.1° |
| O1 | C11 | H1 | H2 | 121.3° | 120.0° |
| C3 | C9 | C7 | C6 | 0.4° | 0.1° |
| C9 | C3 | C4 | C5 | 2.5° | 0.0° |
| C9 | C3 | C4 | H22 | 177.5° | 180.0° |
| C3 | C9 | C7 | H24 | 179.6° | 179.9° |
| C7 | C9 | C3 | C4 | 1.2° | 0.1° |
| C9 | C7 | C6 | H24 | 180.0° | 180.0° |
| C9 | C7 | C6 | C5 | 0.7° | 0.0° |
| C9 | C7 | C6 | CL2 | 179.3° | 179.9° |
| O38 | C15 | C14 | C34 | 70.6° | 98.4° |
| O38 | C15 | C14 | N13 | 43.8° | 16.9° |
| O38 | C15 | C14 | N16 | 179.6° | 180.0° |
| O38 | C15 | N16 | C17 | 0.4° | 0.0° |
| O38 | C15 | C14 | H5 | 167.5° | 139.3° |
| O38 | C15 | N16 | H27 | 179.7° | 180.0° |
| C23 | C18 | C34 | C25 | 152.9° | 144.7° |
| C23 | C18 | C34 | C14 | 179.0° | 160.8° |
| C23 | C18 | C16 | H6 | 7.9° | 3.9° |
| C18 | C23 | H15 | H16 | 120.0° | 120.0° |
| C18 | C23 | H15 | H17 | 120.0° | 120.0° |
| C18 | C23 | H16 | H17 | 120.0° | 120.0° |
| C23 | C18 | C25 | H18 | 79.9° | 34.0° |
| C23 | C18 | C25 | H19 | 160.1° | 85.9° |
| C23 | C18 | C25 | H20 | 40.1° | 154.1° |
| C23 | C18 | C34 | H21 | 30.8° | 4.1° |
| C3 | C4 | C5 | H22 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 2.3° | 0.1° |
| C3 | C4 | C5 | H23 | 177.7° | 180.0° |
| C7 | C6 | C5 | C4 | 0.7° | 0.1° |
| C7 | C6 | C5 | CL2 | 180.0° | 179.9° |
| C7 | C6 | C5 | H23 | 179.3° | 180.0° |
| C18 | C34 | C14 | H21 | 147.9° | 157.0° |
| C18 | C34 | C14 | N13 | 71.0° | 39.5° |
| C18 | C34 | C14 | C15 | 170.4° | 158.4° |
| C18 | C34 | C14 | H5 | 48.4° | 79.3° |
| C34 | C18 | C23 | H15 | 123.6° | 60.6° |
| C34 | C18 | C23 | H16 | 116.4° | 59.4° |
| C34 | C18 | C23 | H17 | 3.6° | 179.4° |
| C34 | C18 | C25 | H18 | 125.9° | 179.4° |
| C34 | C18 | C25 | H19 | 5.9° | 59.4° |
| C34 | C18 | C25 | H20 | 114.1° | 60.6° |
| C34 | C14 | N13 | C12 | 176.5° | 140.4° |
| C34 | C14 | N13 | C15 | 118.1° | 118.8° |
| C34 | C14 | N13 | H5 | 118.7° | 118.8° |
| C14 | C34 | C18 | C25 | 28.1° | 16.1° |
| C34 | C14 | C15 | H5 | 121.9° | 122.3° |
| C34 | C14 | C15 | N16 | 109.8° | 81.7° |
| C14 | C34 | C16 | H6 | 145.5° | 136.9° |
| C11 | C12 | N13 | O33 | 179.9° | 180.0° |
| C11 | C12 | N13 | C14 | 167.7° | 180.0° |
| C12 | C11 | H1 | H2 | 121.3° | 120.0° |
| C12 | N13 | C14 | C15 | 65.4° | 100.7° |
| N13 | C12 | C11 | H1 | 129.8° | 60.0° |
| N13 | C12 | C11 | H2 | 9.0° | 60.0° |
| C12 | N13 | C13 | H3 | 69.3° | 100.8° |
| C12 | N13 | C13 | H4 | 51.6° | 21.5° |
| C12 | N13 | C14 | H5 | 57.9° | 21.7° |
| N13 | C14 | C15 | H5 | 123.7° | 122.4° |
| N13 | C14 | C15 | N16 | 135.8° | 163.1° |
| C14 | N13 | C12 | O33 | 12.2° | 0.0° |
| C14 | N13 | C13 | H3 | 112.0° | 79.2° |
| C14 | N13 | C13 | H4 | 127.1° | 158.5° |
| N13 | C14 | C34 | H21 | 141.0° | 163.6° |
| C4 | C5 | C6 | H23 | 180.0° | 179.9° |
| C4 | C5 | C6 | CL2 | 179.3° | 180.0° |
| C25 | C18 | C16 | H6 | 120.7° | 140.8° |
| C25 | C18 | C23 | H15 | 79.6° | 154.0° |
| C25 | C18 | C23 | H16 | 40.4° | 86.0° |
| C25 | C18 | C23 | H17 | 160.4° | 34.0° |
| C18 | C25 | H18 | H19 | 120.0° | 120.0° |
| C18 | C25 | H18 | H20 | 120.0° | 120.0° |
| C18 | C25 | H19 | H20 | 120.0° | 120.0° |
| C25 | C18 | C34 | H21 | 176.3° | 140.6° |
| C6 | C5 | C4 | H22 | 177.7° | 179.9° |
| C5 | C6 | C7 | H24 | 179.3° | 180.0° |
| CL2 | C6 | C5 | H23 | 0.7° | 0.1° |
| CL2 | C6 | C7 | H24 | 0.7° | 0.0° |
| C14 | C15 | N16 | C17 | 179.2° | 180.0° |
| C15 | C14 | C34 | H21 | 22.5° | 44.7° |
| C14 | C15 | N16 | H27 | 0.8° | 0.0° |
| C15 | N16 | C17 | H27 | 180.0° | 180.0° |
| C15 | N16 | C17 | C8 | 120.4° | 85.0° |
| C15 | N16 | C17 | C19 | 117.4° | 155.0° |
| N16 | C15 | C14 | H5 | 12.0° | 40.7° |
| C15 | N16 | C17 | H7 | 2.7° | 35.0° |
| O33 | C12 | C11 | H1 | 50.1° | 120.1° |
| O33 | C12 | C11 | H2 | 170.9° | 120.0° |
| C22 | C21 | C20 | H11 | 119.2° | 118.2° |
| C22 | C21 | C20 | H12 | 119.2° | 118.1° |
| C21 | C22 | N23 | H13 | 119.3° | 119.0° |
| C21 | C22 | N23 | H14 | 119.3° | 119.1° |
| C22 | C21 | C20 | C19 | 144.7° | 93.9° |
| C22 | C21 | C20 | C24 | 20.9° | 24.8° |
| C21 | C22 | N23 | C24 | 9.4° | 16.9° |
| C22 | C21 | C20 | H10 | 94.3° | 143.5° |
| C22 | C21 | H11 | H12 | 122.3° | 123.8° |
| C21 | C22 | H13 | H14 | 122.1° | 122.0° |
| C21 | C22 | N23 | H28 | 170.6° | 162.9° |
| C20 | C21 | C22 | N23 | 18.9° | 25.4° |
| C21 | C20 | C19 | C17 | 70.2° | 178.8° |
| C21 | C20 | C19 | C24 | 117.9° | 114.8° |
| C21 | C20 | C19 | H10 | 121.1° | 122.7° |
| C21 | C20 | C24 | H10 | 114.9° | 118.8° |
| C21 | C20 | C24 | N23 | 16.4° | 16.3° |
| C21 | C20 | C24 | O26 | 164.2° | 163.8° |
| C21 | C20 | C19 | H8 | 169.6° | 61.2° |
| C21 | C20 | C19 | H9 | 50.0° | 58.8° |
| C20 | C21 | H11 | H12 | 122.2° | 123.8° |
| C20 | C21 | C22 | H13 | 138.2° | 93.6° |
| C20 | C21 | C22 | H14 | 100.4° | 144.4° |
| C22 | N23 | C24 | C20 | 4.6° | 0.3° |
| C22 | N23 | C24 | H28 | 180.0° | 179.9° |
| C22 | N23 | C24 | O26 | 176.1° | 179.6° |
| N23 | C22 | C21 | H11 | 138.1° | 143.5° |
| N23 | C22 | C21 | H12 | 100.3° | 92.8° |
| N23 | C22 | H13 | H14 | 122.2° | 121.9° |
| N16 | C17 | C8 | C19 | 121.4° | 120.0° |
| N16 | C17 | C8 | H7 | 118.4° | 120.0° |
| N16 | C17 | C19 | H7 | 120.8° | 120.0° |
| N16 | C17 | C8 | O9 | 176.7° | 65.0° |
| N16 | C17 | C19 | C20 | 67.7° | 65.0° |
| N16 | C17 | C19 | H8 | 52.5° | 55.0° |
| N16 | C17 | C19 | H9 | 172.1° | 175.0° |
| N16 | C17 | C8 | H25 | 63.0° | 55.0° |
| N16 | C17 | C8 | H26 | 56.3° | 175.0° |
| C8 | C17 | C19 | H7 | 120.4° | 120.0° |
| C17 | C8 | O9 | H25 | 120.3° | 120.0° |
| C17 | C8 | O9 | H26 | 120.3° | 120.0° |
| C8 | C17 | C19 | C20 | 173.5° | 175.0° |
| C8 | C17 | C19 | H8 | 66.3° | 65.0° |
| C8 | C17 | C19 | H9 | 53.3° | 55.0° |
| C17 | C8 | H25 | H26 | 119.0° | 120.0° |
| C8 | C17 | N16 | H27 | 59.7° | 95.0° |
| C17 | C8 | O9 | H29 | 180.0° | 180.0° |
| C19 | C17 | C8 | O9 | 62.0° | 55.0° |
| C17 | C19 | C20 | H8 | 120.2° | 120.0° |
| C17 | C19 | C20 | H9 | 120.2° | 120.0° |
| C17 | C19 | C20 | C24 | 171.9° | 66.4° |
| C17 | C19 | H8 | H9 | 119.4° | 120.0° |
| C17 | C19 | C20 | H10 | 51.0° | 56.1° |
| C19 | C17 | C8 | H25 | 58.3° | 175.0° |
| C19 | C17 | C8 | H26 | 177.7° | 65.0° |
| C19 | C17 | N16 | H27 | 62.6° | 25.0° |
| O9 | C8 | C17 | H7 | 58.3° | 175.0° |
| O9 | C8 | H25 | H26 | 119.0° | 120.0° |
| C19 | C20 | C24 | H10 | 120.7° | 122.5° |
| C19 | C20 | C24 | N23 | 140.8° | 102.4° |
| C19 | C20 | C24 | O26 | 39.9° | 77.5° |
| C20 | C19 | C17 | H7 | 53.1° | 55.0° |
| C20 | C19 | H8 | H9 | 119.4° | 120.0° |
| C19 | C20 | C21 | H11 | 96.1° | 24.3° |
| C19 | C20 | C21 | H12 | 25.4° | 148.0° |
| C20 | C24 | N23 | O26 | 179.3° | 179.9° |
| C24 | C20 | C19 | H8 | 51.7° | 53.5° |
| C24 | C20 | C19 | H9 | 67.9° | 173.6° |
| C24 | C20 | C21 | H11 | 140.1° | 142.9° |
| C24 | C20 | C21 | H12 | 98.3° | 93.3° |
| C20 | C24 | N23 | H28 | 175.4° | 179.5° |
| N23 | C24 | C20 | H10 | 98.5° | 135.1° |
| C24 | N23 | C22 | H13 | 128.6° | 102.0° |
| C24 | N23 | C22 | H14 | 109.9° | 136.0° |
| O26 | C24 | C20 | H10 | 80.9° | 45.0° |
| O26 | C24 | N23 | H28 | 3.9° | 0.5° |
| H3 | C13 | C16 | H6 | 27.4° | 44.2° |
| H4 | C13 | C16 | H6 | 93.6° | 78.2° |
| H5 | C14 | C34 | H21 | 99.6° | 77.7° |
| H6 | C16 | C34 | H21 | 0.6° | 1.0° |
| H7 | C17 | C19 | H8 | 173.3° | 175.0° |
| H7 | C17 | C19 | H9 | 67.1° | 65.0° |
| H7 | C17 | C8 | H25 | 178.6° | 65.0° |
| H7 | C17 | C8 | H26 | 62.0° | 55.0° |
| H7 | C17 | N16 | H27 | 177.3° | 145.0° |
| H8 | C19 | C20 | H10 | 69.2° | 176.1° |
| H9 | C19 | C20 | H10 | 171.1° | 63.9° |
| H10 | C20 | C21 | H11 | 25.0° | 98.3° |
| H10 | C20 | C21 | H12 | 146.5° | 25.4° |
| H11 | C21 | C22 | H13 | 102.6° | 24.5° |
| H11 | C21 | C22 | H14 | 18.8° | 97.4° |
| H12 | C21 | C22 | H13 | 19.0° | 148.3° |
| H12 | C21 | C22 | H14 | 140.4° | 26.3° |
| H13 | C22 | N23 | H28 | 51.4° | 78.1° |
| H14 | C22 | N23 | H28 | 70.1° | 43.9° |
| H15 | C23 | H16 | H17 | 120.0° | 120.0° |
| H18 | C25 | H19 | H20 | 120.0° | 120.0° |
| H22 | C4 | C5 | H23 | 2.2° | 0.0° |
| H25 | C8 | O9 | H29 | 59.7° | 60.0° |
| H26 | C8 | O9 | H29 | 59.6° | 60.0° |
