NJC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C18 | sing | 1.51Å | 1.49Å | |
| C21 | C20 | sing | 1.53Å | 1.50Å | |
| C21 | C15 | sing | 1.52Å | 1.54Å | |
| C14 | C13 | sing | 1.54Å | 1.53Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| C13 | C22 | sing | 1.54Å | 1.53Å | |
| C18 | N3 | sing | 1.35Å | 1.31Å | |
| C18 | O2 | doub | 1.21Å | 1.21Å | |
| C20 | N3 | sing | 1.47Å | 1.45Å | |
| N3 | C17 | sing | 1.47Å | 1.48Å | |
| C12 | N2 | sing | 1.46Å | 1.45Å | |
| C15 | C22 | sing | 1.53Å | 1.52Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| N2 | C11 | sing | 1.35Å | 1.33Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C24 | O3 | sing | 1.43Å | 1.42Å | |
| C11 | O1 | doub | 1.21Å | 1.24Å | |
| C11 | C4 | sing | 1.51Å | 1.49Å | |
| C23 | C4 | sing | 1.53Å | 1.51Å | |
| O3 | C2 | sing | 1.43Å | 1.43Å | |
| C4 | N1 | sing | 1.47Å | 1.47Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| N1 | C5 | sing | 1.40Å | 1.36Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C5 | C10 | doub | 1.39Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.37Å | Aromatic |
| C9 | C8 | doub | 1.38Å | 1.37Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | CL1 | sing | 1.74Å | 1.77Å | |
| C19 | H1 | sing | 1.09Å | 1.10Å | |
| C19 | H2 | sing | 1.09Å | 1.10Å | |
| C19 | CL2 | sing | 1.80Å | 1.07Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| N2 | H19 | sing | 0.97Å | 1.00Å | |
| C3 | H20 | sing | 1.09Å | 1.10Å | |
| C3 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C2 | H28 | sing | 1.09Å | 1.10Å | |
| C1 | H29 | sing | 1.09Å | 1.10Å | |
| C1 | H30 | sing | 1.09Å | 1.10Å | |
| C1 | H31 | sing | 1.09Å | 1.10Å | |
| N1 | H32 | sing | 0.97Å | 1.00Å | |
| C10 | H33 | sing | 1.08Å | 1.08Å | |
| C9 | H34 | sing | 1.08Å | 1.08Å | |
| C7 | H35 | sing | 1.08Å | 1.08Å | |
| C6 | H36 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C18 | N3 | 119.6° | 120.0° |
| C19 | C18 | O2 | 121.4° | 120.0° |
| C18 | C19 | H1 | 109.5° | 109.4° |
| C18 | C19 | H2 | 109.6° | 109.5° |
| C18 | C19 | CL2 | 109.2° | 109.5° |
| C20 | C21 | C15 | 110.7° | 109.2° |
| C21 | C20 | N3 | 106.2° | 108.8° |
| C21 | C20 | H8 | 110.3° | 109.6° |
| C21 | C20 | H9 | 110.3° | 109.7° |
| C20 | C21 | H10 | 109.2° | 109.6° |
| C20 | C21 | H11 | 109.2° | 109.6° |
| C21 | C15 | C14 | 108.5° | 113.5° |
| C21 | C15 | C22 | 110.1° | 113.5° |
| C21 | C15 | C16 | 112.7° | 112.9° |
| C15 | C21 | H10 | 109.1° | 109.6° |
| C15 | C21 | H11 | 109.2° | 109.4° |
| C13 | C14 | C15 | 88.2° | 87.0° |
| C14 | C13 | C12 | 114.8° | 113.6° |
| C14 | C13 | C22 | 89.3° | 87.2° |
| C13 | C14 | H12 | 114.5° | 113.6° |
| C13 | C14 | H13 | 114.5° | 113.6° |
| C14 | C13 | H16 | 110.0° | 113.6° |
| C14 | C15 | C22 | 89.9° | 87.4° |
| C14 | C15 | C16 | 115.9° | 113.4° |
| C15 | C14 | H12 | 114.5° | 113.6° |
| C15 | C14 | H13 | 114.5° | 113.6° |
| C12 | C13 | C22 | 120.8° | 113.6° |
| C13 | C12 | N2 | 107.4° | 109.5° |
| C12 | C13 | H16 | 110.2° | 112.8° |
| C13 | C12 | H17 | 110.0° | 109.4° |
| C13 | C12 | H18 | 110.0° | 109.5° |
| C13 | C22 | C15 | 88.6° | 87.0° |
| C13 | C22 | H14 | 114.4° | 113.6° |
| C13 | C22 | H15 | 114.4° | 113.7° |
| C22 | C13 | H16 | 110.1° | 113.7° |
| N3 | C18 | O2 | 119.0° | 120.0° |
| C18 | N3 | C20 | 120.4° | 120.4° |
| C18 | N3 | C17 | 119.0° | 120.5° |
| C20 | N3 | C17 | 120.4° | 119.0° |
| N3 | C20 | H8 | 110.3° | 109.6° |
| N3 | C20 | H9 | 110.3° | 109.6° |
| N3 | C17 | C16 | 105.8° | 108.8° |
| N3 | C17 | H4 | 110.4° | 109.6° |
| N3 | C17 | H5 | 110.4° | 109.6° |
| C12 | N2 | C11 | 121.4° | 120.0° |
| N2 | C12 | H17 | 110.0° | 109.4° |
| N2 | C12 | H18 | 110.0° | 109.5° |
| C12 | N2 | H19 | 119.3° | 120.0° |
| C22 | C15 | C16 | 117.6° | 113.8° |
| C15 | C22 | H14 | 114.4° | 113.6° |
| C15 | C22 | H15 | 114.4° | 113.6° |
| C15 | C16 | C17 | 107.6° | 109.1° |
| C15 | C16 | H6 | 109.9° | 109.5° |
| C15 | C16 | H7 | 109.9° | 109.6° |
| C16 | C17 | H4 | 110.4° | 109.6° |
| C16 | C17 | H5 | 110.4° | 109.6° |
| C17 | C16 | H6 | 109.9° | 109.5° |
| C17 | C16 | H7 | 109.9° | 109.5° |
| C25 | C24 | C23 | 110.0° | 109.5° |
| C25 | C24 | O3 | 108.5° | 109.5° |
| C25 | C24 | H24 | 108.5° | 109.5° |
| C24 | C25 | H25 | 109.5° | 109.5° |
| C24 | C25 | H26 | 109.5° | 109.5° |
| C24 | C25 | H27 | 109.5° | 109.5° |
| N2 | C11 | O1 | 122.9° | 120.0° |
| N2 | C11 | C4 | 114.5° | 120.0° |
| C11 | N2 | H19 | 119.3° | 120.0° |
| C23 | C24 | O3 | 111.2° | 109.4° |
| C24 | C23 | C4 | 112.7° | 109.2° |
| C24 | C23 | H22 | 108.6° | 109.5° |
| C24 | C23 | H23 | 108.7° | 109.6° |
| C23 | C24 | H24 | 108.5° | 109.5° |
| C24 | O3 | C2 | 111.4° | 114.1° |
| O3 | C24 | H24 | 110.1° | 109.5° |
| O1 | C11 | C4 | 122.5° | 120.0° |
| C11 | C4 | C23 | 108.3° | 109.6° |
| C11 | C4 | N1 | 110.4° | 109.5° |
| C11 | C4 | C3 | 111.3° | 109.5° |
| C23 | C4 | N1 | 106.6° | 109.6° |
| C23 | C4 | C3 | 107.7° | 109.1° |
| C4 | C23 | H22 | 108.7° | 109.5° |
| C4 | C23 | H23 | 108.7° | 109.5° |
| O3 | C2 | C3 | 110.8° | 109.4° |
| O3 | C2 | C1 | 106.6° | 109.5° |
| O3 | C2 | H28 | 110.8° | 109.5° |
| N1 | C4 | C3 | 112.4° | 109.5° |
| C4 | N1 | C5 | 125.9° | 120.0° |
| C4 | N1 | H32 | 105.2° | 120.0° |
| C4 | C3 | C2 | 113.7° | 109.2° |
| C4 | C3 | H20 | 108.4° | 109.5° |
| C4 | C3 | H21 | 108.4° | 109.6° |
| N1 | C5 | C10 | 125.0° | 120.1° |
| N1 | C5 | C6 | 116.8° | 120.1° |
| C5 | N1 | H32 | 105.2° | 120.0° |
| C3 | C2 | C1 | 110.2° | 109.6° |
| C2 | C3 | H20 | 108.4° | 109.5° |
| C2 | C3 | H21 | 108.4° | 109.6° |
| C3 | C2 | H28 | 109.3° | 109.4° |
| C1 | C2 | H28 | 109.3° | 109.5° |
| C2 | C1 | H29 | 109.5° | 109.5° |
| C2 | C1 | H30 | 109.5° | 109.5° |
| C2 | C1 | H31 | 109.5° | 109.4° |
| C10 | C5 | C6 | 118.2° | 119.9° |
| C5 | C10 | C9 | 120.7° | 120.0° |
| C5 | C10 | H33 | 119.7° | 120.0° |
| C5 | C6 | C7 | 120.7° | 119.9° |
| C5 | C6 | H36 | 119.6° | 120.0° |
| C10 | C9 | C8 | 119.3° | 120.0° |
| C9 | C10 | H33 | 119.6° | 120.0° |
| C10 | C9 | H34 | 120.3° | 120.0° |
| C6 | C7 | C8 | 120.3° | 120.1° |
| C6 | C7 | H35 | 119.8° | 119.9° |
| C7 | C6 | H36 | 119.6° | 120.1° |
| C9 | C8 | C7 | 120.7° | 120.1° |
| C9 | C8 | CL1 | 121.6° | 119.9° |
| C8 | C9 | H34 | 120.3° | 119.9° |
| C7 | C8 | CL1 | 117.7° | 119.9° |
| C8 | C7 | H35 | 119.9° | 120.0° |
| H1 | C19 | H2 | 109.5° | 109.5° |
| H1 | C19 | CL2 | 109.5° | 109.5° |
| H2 | C19 | CL2 | 109.5° | 109.4° |
| H4 | C17 | H5 | 109.5° | 109.7° |
| H6 | C16 | H7 | 109.5° | 109.5° |
| H8 | C20 | H9 | 109.4° | 109.5° |
| H10 | C21 | H11 | 109.5° | 109.6° |
| H12 | C14 | H13 | 109.5° | 112.9° |
| H14 | C22 | H15 | 109.5° | 112.9° |
| H17 | C12 | H18 | 109.5° | 109.5° |
| H20 | C3 | H21 | 109.5° | 109.5° |
| H22 | C23 | H23 | 109.5° | 109.5° |
| H25 | C25 | H26 | 109.4° | 109.4° |
| H25 | C25 | H27 | 109.5° | 109.5° |
| H26 | C25 | H27 | 109.5° | 109.5° |
| H29 | C1 | H30 | 109.5° | 109.5° |
| H29 | C1 | H31 | 109.4° | 109.4° |
| H30 | C1 | H31 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C18 | N3 | O2 | 179.8° | 179.7° |
| C19 | C18 | N3 | C20 | 46.1° | 0.6° |
| C19 | C18 | N3 | C17 | 138.3° | 179.7° |
| C18 | C19 | H1 | H2 | 120.1° | 120.0° |
| C18 | C19 | H1 | CL2 | 119.8° | 120.0° |
| C18 | C19 | H2 | CL2 | 119.8° | 120.0° |
| C20 | C21 | C15 | H10 | 120.2° | 120.0° |
| C20 | C21 | C15 | H11 | 120.2° | 119.9° |
| C20 | C21 | C15 | C14 | 154.8° | 171.1° |
| C21 | C20 | N3 | C18 | 149.7° | 124.5° |
| C21 | C20 | N3 | H8 | 119.5° | 119.8° |
| C21 | C20 | N3 | H9 | 119.5° | 119.9° |
| C21 | C20 | N3 | C17 | 34.7° | 55.2° |
| C20 | C21 | C15 | C22 | 108.3° | 73.2° |
| C20 | C21 | C15 | C16 | 25.1° | 58.1° |
| C21 | C20 | H8 | H9 | 121.5° | 120.4° |
| C20 | C21 | H10 | H11 | 119.4° | 120.2° |
| C21 | C15 | C14 | C13 | 96.1° | 89.3° |
| C21 | C15 | C14 | C22 | 111.2° | 114.6° |
| C21 | C15 | C14 | C16 | 127.9° | 130.6° |
| C21 | C15 | C22 | C13 | 94.6° | 89.4° |
| C15 | C21 | C20 | N3 | 62.1° | 52.6° |
| C21 | C15 | C22 | C16 | 130.9° | 130.9° |
| C21 | C15 | C16 | C17 | 39.2° | 58.0° |
| C21 | C15 | C16 | H6 | 158.9° | 177.9° |
| C21 | C15 | C16 | H7 | 80.5° | 61.9° |
| C15 | C21 | C20 | H8 | 57.4° | 172.5° |
| C15 | C21 | C20 | H9 | 178.4° | 67.2° |
| C15 | C21 | H10 | H11 | 119.4° | 120.0° |
| C21 | C15 | C14 | H12 | 20.1° | 156.1° |
| C21 | C15 | C14 | H13 | 147.7° | 25.2° |
| C21 | C15 | C22 | H14 | 149.2° | 25.1° |
| C21 | C15 | C22 | H15 | 21.7° | 156.0° |
| C13 | C14 | C15 | H12 | 116.2° | 114.5° |
| C13 | C14 | C15 | H13 | 116.2° | 114.5° |
| C14 | C13 | C12 | C22 | 105.0° | 97.6° |
| C14 | C13 | C12 | H16 | 124.8° | 131.1° |
| C14 | C13 | C22 | H16 | 111.1° | 114.6° |
| C14 | C13 | C12 | N2 | 151.0° | 175.0° |
| C13 | C14 | C15 | C22 | 15.1° | 25.2° |
| C13 | C14 | C15 | C16 | 136.0° | 140.1° |
| C13 | C14 | H12 | H13 | 130.1° | 131.3° |
| C14 | C13 | C22 | H14 | 101.2° | 139.6° |
| C14 | C13 | C22 | H15 | 131.4° | 89.3° |
| C14 | C13 | C12 | H17 | 31.3° | 65.0° |
| C14 | C13 | C12 | H18 | 89.3° | 55.0° |
| C15 | C14 | C13 | C12 | 139.0° | 139.8° |
| C14 | C15 | C22 | C16 | 119.4° | 114.5° |
| C14 | C15 | C16 | C17 | 86.7° | 171.1° |
| C14 | C15 | C16 | H6 | 33.0° | 51.2° |
| C14 | C15 | C16 | H7 | 153.6° | 69.0° |
| C14 | C15 | C21 | H10 | 34.6° | 68.9° |
| C14 | C15 | C21 | H11 | 85.1° | 51.2° |
| C15 | C14 | H12 | H13 | 130.1° | 131.3° |
| C14 | C15 | C22 | H14 | 101.1° | 139.7° |
| C14 | C15 | C22 | H15 | 131.4° | 89.4° |
| C15 | C14 | C13 | H16 | 96.1° | 89.5° |
| C12 | C13 | C22 | H16 | 130.2° | 130.9° |
| C13 | C12 | N2 | H17 | 119.7° | 119.9° |
| C13 | C12 | N2 | H18 | 119.7° | 120.0° |
| C12 | C13 | C22 | C15 | 133.8° | 139.7° |
| C13 | C12 | N2 | C11 | 143.3° | 180.0° |
| C12 | C13 | C14 | H12 | 104.8° | 25.2° |
| C12 | C13 | C14 | H13 | 22.8° | 105.8° |
| C12 | C13 | C22 | H14 | 17.5° | 105.8° |
| C12 | C13 | C22 | H15 | 109.9° | 25.2° |
| C13 | C12 | H17 | H18 | 120.9° | 120.0° |
| C13 | C12 | N2 | H19 | 36.8° | 0.1° |
| C22 | C13 | C12 | N2 | 46.0° | 87.4° |
| C13 | C22 | C15 | H14 | 116.3° | 114.5° |
| C13 | C22 | C15 | H15 | 116.3° | 114.6° |
| C13 | C22 | C15 | C16 | 134.6° | 139.8° |
| C22 | C13 | C14 | H12 | 131.3° | 89.4° |
| C22 | C13 | C14 | H13 | 101.2° | 139.7° |
| C13 | C22 | H14 | H15 | 129.9° | 131.4° |
| C22 | C13 | C12 | H17 | 73.7° | 32.5° |
| C22 | C13 | C12 | H18 | 165.7° | 152.6° |
| C18 | N3 | C20 | C17 | 175.6° | 179.7° |
| C18 | N3 | C17 | C16 | 147.2° | 124.5° |
| N3 | C18 | C19 | H1 | 120.4° | 60.0° |
| N3 | C18 | C19 | H2 | 0.3° | 60.0° |
| N3 | C18 | C19 | CL2 | 119.7° | 180.0° |
| C18 | N3 | C17 | H4 | 27.8° | 115.7° |
| C18 | N3 | C17 | H5 | 93.4° | 4.7° |
| C18 | N3 | C20 | H8 | 90.7° | 4.7° |
| C18 | N3 | C20 | H9 | 30.3° | 115.5° |
| O2 | C18 | N3 | C20 | 133.7° | 179.7° |
| O2 | C18 | N3 | C17 | 41.9° | 0.0° |
| O2 | C18 | C19 | H1 | 59.4° | 119.7° |
| O2 | C18 | C19 | H2 | 179.5° | 120.2° |
| O2 | C18 | C19 | CL2 | 60.5° | 0.3° |
| C20 | N3 | C17 | C16 | 28.4° | 55.2° |
| C20 | N3 | C17 | H4 | 147.8° | 64.6° |
| C20 | N3 | C17 | H5 | 91.0° | 175.0° |
| N3 | C20 | H8 | H9 | 121.5° | 120.3° |
| N3 | C20 | C21 | H10 | 58.1° | 67.4° |
| N3 | C20 | C21 | H11 | 177.8° | 172.4° |
| N3 | C17 | C16 | C15 | 65.8° | 52.6° |
| N3 | C17 | C16 | H4 | 119.4° | 119.8° |
| N3 | C17 | C16 | H5 | 119.4° | 119.8° |
| N3 | C17 | H4 | H5 | 121.7° | 120.4° |
| N3 | C17 | C16 | H6 | 174.5° | 172.4° |
| N3 | C17 | C16 | H7 | 54.0° | 67.4° |
| C17 | N3 | C20 | H8 | 84.8° | 175.0° |
| C17 | N3 | C20 | H9 | 154.2° | 64.8° |
| C12 | N2 | C11 | H19 | 180.0° | 180.0° |
| C12 | N2 | C11 | O1 | 3.0° | 5.0° |
| C12 | N2 | C11 | C4 | 179.5° | 174.9° |
| N2 | C12 | C13 | H16 | 84.2° | 43.9° |
| N2 | C12 | H17 | H18 | 121.0° | 120.0° |
| C22 | C15 | C16 | C17 | 168.9° | 73.1° |
| C22 | C15 | C16 | H6 | 71.4° | 46.7° |
| C22 | C15 | C16 | H7 | 49.2° | 166.9° |
| C22 | C15 | C21 | H10 | 131.5° | 166.8° |
| C22 | C15 | C21 | H11 | 11.8° | 46.6° |
| C22 | C15 | C14 | H12 | 131.3° | 89.3° |
| C22 | C15 | C14 | H13 | 101.1° | 139.7° |
| C15 | C22 | H14 | H15 | 129.9° | 131.2° |
| C15 | C22 | C13 | H16 | 96.0° | 89.4° |
| C15 | C16 | C17 | H6 | 119.7° | 119.8° |
| C15 | C16 | C17 | H7 | 119.7° | 120.0° |
| C15 | C16 | C17 | H4 | 174.8° | 67.2° |
| C15 | C16 | C17 | H5 | 53.6° | 172.4° |
| C15 | C16 | H6 | H7 | 120.9° | 120.3° |
| C16 | C15 | C21 | H10 | 95.1° | 61.9° |
| C16 | C15 | C21 | H11 | 145.2° | 178.0° |
| C16 | C15 | C14 | H12 | 107.8° | 25.6° |
| C16 | C15 | C14 | H13 | 19.8° | 105.4° |
| C16 | C15 | C22 | H14 | 18.3° | 105.8° |
| C16 | C15 | C22 | H15 | 109.2° | 25.1° |
| C16 | C17 | H4 | H5 | 121.7° | 120.3° |
| C17 | C16 | H6 | H7 | 120.8° | 120.1° |
| C25 | C24 | C23 | O3 | 120.2° | 120.0° |
| C25 | C24 | C23 | H24 | 118.6° | 120.0° |
| C25 | C24 | O3 | H24 | 118.6° | 120.0° |
| C25 | C24 | C23 | C4 | 177.2° | 177.6° |
| C25 | C24 | O3 | C2 | 178.3° | 178.9° |
| C25 | C24 | C23 | H22 | 56.7° | 62.5° |
| C25 | C24 | C23 | H23 | 62.3° | 57.7° |
| C24 | C25 | H25 | H26 | 120.0° | 120.0° |
| C24 | C25 | H25 | H27 | 120.0° | 120.0° |
| C24 | C25 | H26 | H27 | 120.0° | 120.0° |
| N2 | C11 | O1 | C4 | 176.3° | 179.9° |
| N2 | C11 | C4 | C23 | 65.9° | 82.1° |
| N2 | C11 | C4 | N1 | 50.5° | 38.1° |
| N2 | C11 | C4 | C3 | 176.0° | 158.3° |
| C11 | N2 | C12 | H17 | 23.6° | 60.0° |
| C11 | N2 | C12 | H18 | 97.1° | 60.0° |
| C23 | C24 | O3 | H24 | 120.3° | 120.0° |
| C24 | C23 | C4 | C11 | 70.3° | 62.9° |
| C24 | C23 | C4 | H22 | 120.5° | 119.9° |
| C24 | C23 | C4 | H23 | 120.5° | 120.0° |
| C23 | C24 | O3 | C2 | 60.6° | 61.2° |
| C24 | C23 | C4 | N1 | 170.9° | 176.9° |
| C24 | C23 | C4 | C3 | 50.1° | 57.0° |
| C24 | C23 | H22 | H23 | 118.5° | 120.2° |
| C23 | C24 | C25 | H25 | 180.0° | 60.0° |
| C23 | C24 | C25 | H26 | 60.0° | 180.0° |
| C23 | C24 | C25 | H27 | 60.0° | 60.0° |
| O3 | C24 | C23 | C4 | 57.0° | 57.6° |
| C24 | O3 | C2 | C3 | 59.2° | 61.1° |
| C24 | O3 | C2 | C1 | 179.1° | 178.8° |
| O3 | C24 | C23 | H22 | 63.5° | 177.5° |
| O3 | C24 | C23 | H23 | 177.5° | 62.3° |
| O3 | C24 | C25 | H25 | 58.2° | 59.9° |
| O3 | C24 | C25 | H26 | 178.2° | 60.1° |
| O3 | C24 | C25 | H27 | 61.8° | 179.9° |
| C24 | O3 | C2 | H28 | 62.1° | 58.8° |
| O1 | C11 | C4 | C23 | 117.5° | 97.8° |
| O1 | C11 | C4 | N1 | 126.1° | 142.0° |
| O1 | C11 | C4 | C3 | 0.6° | 21.8° |
| O1 | C11 | N2 | H19 | 177.0° | 175.1° |
| C11 | C4 | C23 | N1 | 118.8° | 120.2° |
| C11 | C4 | C23 | C3 | 120.4° | 119.9° |
| C11 | C4 | N1 | C3 | 124.9° | 120.1° |
| C11 | C4 | N1 | C5 | 50.4° | 60.7° |
| C11 | C4 | C3 | C2 | 68.9° | 62.9° |
| C4 | C11 | N2 | H19 | 0.5° | 5.0° |
| C11 | C4 | C3 | H20 | 170.5° | 177.2° |
| C11 | C4 | C3 | H21 | 51.8° | 57.0° |
| C11 | C4 | C23 | H22 | 169.2° | 57.0° |
| C11 | C4 | C23 | H23 | 50.1° | 177.1° |
| C11 | C4 | N1 | H32 | 172.7° | 119.4° |
| C23 | C4 | N1 | C3 | 117.7° | 119.7° |
| C23 | C4 | N1 | C5 | 167.8° | 179.1° |
| C23 | C4 | C3 | C2 | 49.6° | 57.0° |
| C23 | C4 | C3 | H20 | 71.0° | 62.9° |
| C23 | C4 | C3 | H21 | 170.3° | 177.0° |
| C4 | C23 | H22 | H23 | 118.5° | 120.1° |
| C4 | C23 | C24 | H24 | 64.2° | 62.4° |
| C23 | C4 | N1 | H32 | 69.9° | 0.9° |
| O3 | C2 | C3 | C4 | 55.0° | 57.5° |
| O3 | C2 | C3 | C1 | 117.6° | 120.0° |
| O3 | C2 | C3 | H28 | 122.3° | 120.0° |
| O3 | C2 | C1 | H28 | 119.7° | 120.1° |
| O3 | C2 | C3 | H20 | 65.6° | 62.4° |
| O3 | C2 | C3 | H21 | 175.7° | 177.5° |
| C2 | O3 | C24 | H24 | 59.7° | 58.8° |
| O3 | C2 | C1 | H29 | 180.0° | 59.9° |
| O3 | C2 | C1 | H30 | 60.0° | 180.0° |
| O3 | C2 | C1 | H31 | 60.0° | 60.0° |
| C4 | N1 | C5 | H32 | 122.2° | 180.0° |
| N1 | C4 | C3 | C2 | 166.8° | 176.9° |
| C4 | N1 | C5 | C10 | 3.9° | 172.4° |
| C4 | N1 | C5 | C6 | 178.3° | 7.9° |
| N1 | C4 | C3 | H20 | 46.1° | 57.1° |
| N1 | C4 | C3 | H21 | 72.6° | 63.1° |
| N1 | C4 | C23 | H22 | 50.4° | 63.2° |
| N1 | C4 | C23 | H23 | 68.7° | 56.9° |
| C3 | C4 | N1 | C5 | 74.4° | 59.5° |
| C4 | C3 | C2 | H20 | 120.6° | 119.9° |
| C4 | C3 | C2 | H21 | 120.6° | 120.0° |
| C4 | C3 | C2 | C1 | 172.7° | 177.5° |
| C4 | C3 | H20 | H21 | 118.0° | 120.2° |
| C3 | C4 | C23 | H22 | 70.4° | 176.9° |
| C3 | C4 | C23 | H23 | 170.5° | 63.0° |
| C4 | C3 | C2 | H28 | 67.2° | 62.5° |
| C3 | C4 | N1 | H32 | 47.8° | 120.5° |
| N1 | C5 | C10 | C6 | 177.7° | 179.7° |
| N1 | C5 | C10 | C9 | 179.2° | 179.9° |
| N1 | C5 | C6 | C7 | 179.1° | 179.7° |
| N1 | C5 | C10 | H33 | 0.8° | 0.0° |
| N1 | C5 | C6 | H36 | 0.8° | 0.0° |
| C3 | C2 | C1 | H28 | 120.1° | 120.0° |
| C2 | C3 | H20 | H21 | 118.1° | 120.2° |
| C3 | C2 | C1 | H29 | 59.7° | 60.0° |
| C3 | C2 | C1 | H30 | 179.8° | 60.0° |
| C3 | C2 | C1 | H31 | 60.2° | 179.9° |
| C1 | C2 | C3 | H20 | 52.1° | 57.7° |
| C1 | C2 | C3 | H21 | 66.7° | 62.5° |
| C2 | C1 | H29 | H30 | 120.0° | 120.0° |
| C2 | C1 | H29 | H31 | 120.0° | 119.9° |
| C2 | C1 | H30 | H31 | 120.0° | 120.0° |
| C5 | C10 | C9 | H33 | 180.0° | 180.0° |
| C10 | C5 | C6 | C7 | 1.2° | 0.6° |
| C5 | C10 | C9 | C8 | 0.3° | 0.1° |
| C10 | C5 | N1 | H32 | 118.3° | 7.6° |
| C5 | C10 | C9 | H34 | 179.7° | 180.0° |
| C10 | C5 | C6 | H36 | 178.8° | 179.7° |
| C6 | C5 | C10 | C9 | 1.5° | 0.2° |
| C5 | C6 | C7 | H36 | 180.0° | 179.7° |
| C5 | C6 | C7 | C8 | 0.3° | 0.6° |
| C6 | C5 | N1 | H32 | 59.5° | 172.1° |
| C6 | C5 | C10 | H33 | 178.5° | 179.7° |
| C5 | C6 | C7 | H35 | 179.7° | 179.7° |
| C10 | C9 | C8 | H34 | 180.0° | 179.9° |
| C10 | C9 | C8 | C7 | 1.2° | 0.0° |
| C10 | C9 | C8 | CL1 | 178.7° | 180.0° |
| C6 | C7 | C8 | C9 | 1.5° | 0.3° |
| C6 | C7 | C8 | H35 | 180.0° | 179.7° |
| C6 | C7 | C8 | CL1 | 179.1° | 179.7° |
| C9 | C8 | C7 | CL1 | 177.6° | 180.0° |
| C8 | C9 | C10 | H33 | 179.7° | 180.0° |
| C9 | C8 | C7 | H35 | 178.5° | 180.0° |
| C7 | C8 | C9 | H34 | 178.8° | 179.9° |
| C8 | C7 | C6 | H36 | 179.8° | 179.7° |
| CL1 | C8 | C9 | H34 | 1.3° | 0.1° |
| CL1 | C8 | C7 | H35 | 0.9° | 0.0° |
| H1 | C19 | H2 | CL2 | 120.1° | 120.0° |
| H4 | C17 | C16 | H6 | 55.1° | 52.6° |
| H4 | C17 | C16 | H7 | 65.5° | 172.7° |
| H5 | C17 | C16 | H6 | 66.1° | 67.8° |
| H5 | C17 | C16 | H7 | 173.4° | 52.4° |
| H8 | C20 | C21 | H10 | 177.6° | 52.4° |
| H8 | C20 | C21 | H11 | 62.7° | 67.8° |
| H9 | C20 | C21 | H10 | 61.4° | 172.8° |
| H9 | C20 | C21 | H11 | 58.2° | 52.5° |
| H12 | C14 | C13 | H16 | 20.1° | 155.9° |
| H13 | C14 | C13 | H16 | 147.7° | 25.0° |
| H14 | C22 | C13 | H16 | 147.7° | 25.1° |
| H15 | C22 | C13 | H16 | 20.3° | 156.1° |
| H16 | C13 | C12 | H17 | 156.1° | 163.9° |
| H16 | C13 | C12 | H18 | 35.5° | 76.1° |
| H17 | C12 | N2 | H19 | 156.4° | 120.0° |
| H18 | C12 | N2 | H19 | 82.9° | 120.0° |
| H20 | C3 | C2 | H28 | 172.2° | 177.7° |
| H21 | C3 | C2 | H28 | 53.4° | 57.5° |
| H22 | C23 | C24 | H24 | 175.3° | 57.5° |
| H23 | C23 | C24 | H24 | 56.3° | 177.7° |
| H24 | C24 | C25 | H25 | 61.4° | 180.0° |
| H24 | C24 | C25 | H26 | 58.6° | 60.0° |
| H24 | C24 | C25 | H27 | 178.6° | 60.0° |
| H25 | C25 | H26 | H27 | 120.0° | 120.0° |
| H28 | C2 | C1 | H29 | 60.3° | 180.0° |
| H28 | C2 | C1 | H30 | 59.7° | 59.9° |
| H28 | C2 | C1 | H31 | 179.7° | 60.1° |
| H29 | C1 | H30 | H31 | 120.0° | 120.0° |
| H33 | C10 | C9 | H34 | 0.3° | 0.1° |
| H35 | C7 | C6 | H36 | 0.2° | 0.0° |
