U50
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C22 | C21 | sing | 1.51Å | 1.54Å | |
| O2 | C21 | doub | 1.21Å | 1.23Å | |
| C21 | N7 | sing | 1.35Å | 1.32Å | |
| N7 | C19 | sing | 1.47Å | 1.47Å | |
| N7 | C20 | sing | 1.47Å | 1.46Å | |
| C19 | C18 | sing | 1.53Å | 1.51Å | |
| C20 | C18 | sing | 1.54Å | 1.54Å | |
| C18 | N6 | sing | 1.46Å | 1.49Å | |
| CL2 | C15 | sing | 1.74Å | 1.72Å | |
| N6 | C17 | sing | 1.35Å | 1.32Å | |
| C15 | N5 | sing | 1.33Å | 1.31Å | Aromatic |
| C15 | C14 | doub | 1.37Å | 1.37Å | Aromatic |
| C17 | C14 | sing | 1.47Å | 1.57Å | |
| C17 | O1 | doub | 1.22Å | 1.24Å | |
| N5 | C13 | doub | 1.31Å | 1.34Å | Aromatic |
| C14 | N4 | sing | 1.38Å | 1.32Å | Aromatic |
| N4 | C13 | sing | 1.34Å | 1.33Å | Aromatic |
| N4 | C16 | sing | 1.46Å | 1.47Å | |
| C13 | C12 | sing | 1.51Å | 1.53Å | |
| C12 | N3 | sing | 1.46Å | 1.49Å | |
| N3 | C7 | sing | 1.40Å | 1.32Å | |
| C7 | N1 | doub | 1.31Å | 1.30Å | Aromatic |
| C7 | C6 | sing | 1.46Å | 1.38Å | Aromatic |
| C9 | C8 | sing | 1.53Å | 1.58Å | |
| C5 | C6 | doub | 1.40Å | 1.38Å | Aromatic |
| C5 | C4 | sing | 1.37Å | 1.39Å | Aromatic |
| N1 | N2 | sing | 1.40Å | 1.24Å | Aromatic |
| C6 | C1 | sing | 1.41Å | 1.36Å | Aromatic |
| C8 | C10 | sing | 1.53Å | 1.52Å | |
| C8 | C4 | sing | 1.51Å | 1.58Å | |
| C8 | C11 | sing | 1.53Å | 1.51Å | |
| C4 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| N2 | C1 | sing | 1.37Å | 1.29Å | Aromatic |
| C1 | C2 | doub | 1.39Å | 1.35Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.36Å | Aromatic |
| C3 | CL1 | sing | 1.74Å | 1.67Å | |
| C23 | H1 | sing | 1.09Å | 1.10Å | |
| C23 | H2 | sing | 1.09Å | 1.10Å | |
| C23 | H3 | sing | 1.09Å | 1.10Å | |
| C22 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C18 | H10 | sing | 1.09Å | 1.10Å | |
| N6 | H11 | sing | 0.97Å | 1.00Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| N3 | H17 | sing | 0.97Å | 1.00Å | |
| C5 | H18 | sing | 1.08Å | 1.08Å | |
| C10 | H19 | sing | 1.09Å | 1.10Å | |
| C10 | H20 | sing | 1.09Å | 1.10Å | |
| C10 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C11 | H24 | sing | 1.09Å | 1.10Å | |
| C9 | H25 | sing | 1.09Å | 1.10Å | |
| C9 | H26 | sing | 1.09Å | 1.10Å | |
| C9 | H27 | sing | 1.09Å | 1.10Å | |
| C2 | H28 | sing | 1.08Å | 1.08Å | |
| N2 | H29 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C22 | C21 | 117.7° | 109.5° |
| C22 | C23 | H1 | 109.5° | 109.5° |
| C22 | C23 | H2 | 109.4° | 109.5° |
| C22 | C23 | H3 | 109.4° | 109.4° |
| C23 | C22 | H4 | 107.4° | 109.5° |
| C23 | C22 | H5 | 107.4° | 109.4° |
| C22 | C21 | O2 | 120.1° | 120.0° |
| C22 | C21 | N7 | 117.0° | 120.0° |
| C21 | C22 | H4 | 107.4° | 109.5° |
| C21 | C22 | H5 | 107.4° | 109.5° |
| O2 | C21 | N7 | 122.9° | 120.0° |
| C21 | N7 | C19 | 132.9° | 136.1° |
| C21 | N7 | C20 | 134.5° | 136.0° |
| C19 | N7 | C20 | 92.6° | 87.9° |
| N7 | C19 | C18 | 89.9° | 88.1° |
| N7 | C19 | H8 | 114.1° | 113.5° |
| N7 | C19 | H9 | 114.1° | 113.5° |
| N7 | C20 | C18 | 89.0° | 88.0° |
| N7 | C20 | H6 | 114.3° | 113.5° |
| N7 | C20 | H7 | 114.3° | 113.5° |
| C19 | C18 | C20 | 88.4° | 83.4° |
| C19 | C18 | N6 | 110.0° | 114.4° |
| C18 | C19 | H8 | 114.1° | 113.4° |
| C18 | C19 | H9 | 114.1° | 113.5° |
| C19 | C18 | H10 | 115.4° | 114.0° |
| C20 | C18 | N6 | 109.3° | 114.3° |
| C18 | C20 | H6 | 114.3° | 113.4° |
| C18 | C20 | H7 | 114.3° | 113.5° |
| C20 | C18 | H10 | 114.8° | 114.2° |
| C18 | N6 | C17 | 119.8° | 120.0° |
| N6 | C18 | H10 | 115.7° | 113.4° |
| C18 | N6 | H11 | 120.1° | 119.9° |
| CL2 | C15 | N5 | 125.5° | 126.1° |
| CL2 | C15 | C14 | 124.4° | 126.2° |
| N6 | C17 | C14 | 116.5° | 120.0° |
| N6 | C17 | O1 | 122.3° | 120.0° |
| C17 | N6 | H11 | 120.1° | 120.1° |
| N5 | C15 | C14 | 110.1° | 107.7° |
| C15 | N5 | C13 | 106.5° | 109.7° |
| C15 | C14 | C17 | 129.2° | 126.9° |
| C15 | C14 | N4 | 105.0° | 106.3° |
| C14 | C17 | O1 | 121.2° | 120.0° |
| C17 | C14 | N4 | 125.8° | 126.8° |
| N5 | C13 | N4 | 108.5° | 109.3° |
| N5 | C13 | C12 | 127.7° | 125.3° |
| C14 | N4 | C13 | 109.9° | 107.0° |
| C14 | N4 | C16 | 123.2° | 126.5° |
| C13 | N4 | C16 | 126.9° | 126.5° |
| N4 | C13 | C12 | 123.7° | 125.4° |
| N4 | C16 | H12 | 109.5° | 109.5° |
| N4 | C16 | H13 | 109.5° | 109.4° |
| N4 | C16 | H14 | 109.5° | 109.5° |
| C13 | C12 | N3 | 112.4° | 109.5° |
| C13 | C12 | H15 | 108.7° | 109.5° |
| C13 | C12 | H16 | 108.7° | 109.4° |
| C12 | N3 | C7 | 114.2° | 120.0° |
| N3 | C12 | H15 | 108.7° | 109.5° |
| N3 | C12 | H16 | 108.7° | 109.4° |
| C12 | N3 | H17 | 108.3° | 120.0° |
| N3 | C7 | N1 | 125.0° | 126.1° |
| N3 | C7 | C6 | 127.8° | 126.2° |
| C7 | N3 | H17 | 108.3° | 120.0° |
| N1 | C7 | C6 | 107.0° | 107.7° |
| C7 | N1 | N2 | 109.8° | 110.0° |
| C7 | C6 | C5 | 134.7° | 133.9° |
| C7 | C6 | C1 | 104.1° | 106.3° |
| C9 | C8 | C10 | 106.8° | 109.5° |
| C9 | C8 | C4 | 112.2° | 109.5° |
| C9 | C8 | C11 | 110.0° | 109.4° |
| C8 | C9 | H25 | 109.5° | 109.5° |
| C8 | C9 | H26 | 109.5° | 109.5° |
| C8 | C9 | H27 | 109.5° | 109.4° |
| C6 | C5 | C4 | 120.5° | 119.8° |
| C5 | C6 | C1 | 121.1° | 119.8° |
| C6 | C5 | H18 | 119.7° | 120.1° |
| C5 | C4 | C8 | 122.0° | 119.7° |
| C5 | C4 | C3 | 115.3° | 120.6° |
| C4 | C5 | H18 | 119.8° | 120.1° |
| N1 | N2 | C1 | 112.0° | 109.2° |
| N1 | N2 | H29 | 124.0° | 125.4° |
| C6 | C1 | N2 | 107.0° | 106.8° |
| C6 | C1 | C2 | 120.6° | 119.4° |
| C10 | C8 | C4 | 110.0° | 109.5° |
| C10 | C8 | C11 | 108.8° | 109.5° |
| C8 | C10 | H19 | 109.5° | 109.5° |
| C8 | C10 | H20 | 109.4° | 109.5° |
| C8 | C10 | H21 | 109.5° | 109.5° |
| C4 | C8 | C11 | 109.0° | 109.5° |
| C8 | C4 | C3 | 122.6° | 119.7° |
| C8 | C11 | H22 | 109.5° | 109.4° |
| C8 | C11 | H23 | 109.5° | 109.5° |
| C8 | C11 | H24 | 109.5° | 109.5° |
| C4 | C3 | C2 | 124.6° | 120.6° |
| C4 | C3 | CL1 | 121.4° | 119.7° |
| N2 | C1 | C2 | 132.4° | 133.7° |
| C1 | N2 | H29 | 124.0° | 125.4° |
| C1 | C2 | C3 | 117.9° | 119.7° |
| C1 | C2 | H28 | 121.1° | 120.2° |
| C2 | C3 | CL1 | 114.0° | 119.7° |
| C3 | C2 | H28 | 121.1° | 120.1° |
| H1 | C23 | H2 | 109.5° | 109.5° |
| H1 | C23 | H3 | 109.5° | 109.5° |
| H2 | C23 | H3 | 109.5° | 109.5° |
| H4 | C22 | H5 | 109.4° | 109.5° |
| H6 | C20 | H7 | 109.5° | 112.8° |
| H8 | C19 | H9 | 109.4° | 112.7° |
| H12 | C16 | H13 | 109.4° | 109.4° |
| H12 | C16 | H14 | 109.4° | 109.5° |
| H13 | C16 | H14 | 109.5° | 109.5° |
| H15 | C12 | H16 | 109.5° | 109.5° |
| H19 | C10 | H20 | 109.5° | 109.5° |
| H19 | C10 | H21 | 109.5° | 109.4° |
| H20 | C10 | H21 | 109.5° | 109.5° |
| H22 | C11 | H23 | 109.5° | 109.5° |
| H22 | C11 | H24 | 109.5° | 109.5° |
| H23 | C11 | H24 | 109.4° | 109.4° |
| H25 | C9 | H26 | 109.5° | 109.5° |
| H25 | C9 | H27 | 109.4° | 109.5° |
| H26 | C9 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C22 | C21 | H4 | 121.2° | 120.0° |
| C23 | C22 | C21 | H5 | 121.2° | 120.0° |
| C23 | C22 | C21 | O2 | 13.0° | 0.0° |
| C23 | C22 | C21 | N7 | 165.0° | 180.0° |
| C22 | C23 | H1 | H2 | 120.0° | 120.0° |
| C22 | C23 | H1 | H3 | 120.0° | 120.0° |
| C22 | C23 | H2 | H3 | 120.0° | 120.0° |
| C23 | C22 | H4 | H5 | 116.3° | 120.0° |
| C22 | C21 | O2 | N7 | 177.8° | 179.9° |
| C22 | C21 | N7 | C19 | 0.2° | 180.0° |
| C22 | C21 | N7 | C20 | 177.0° | 0.3° |
| C21 | C22 | C23 | H1 | 180.0° | 60.0° |
| C21 | C22 | C23 | H2 | 60.0° | 60.0° |
| C21 | C22 | C23 | H3 | 60.0° | 180.0° |
| C21 | C22 | H4 | H5 | 116.3° | 120.1° |
| O2 | C21 | N7 | C19 | 177.7° | 0.1° |
| O2 | C21 | N7 | C20 | 0.9° | 179.6° |
| O2 | C21 | C22 | H4 | 134.2° | 120.0° |
| O2 | C21 | C22 | H5 | 108.2° | 119.9° |
| C21 | N7 | C19 | C20 | 177.7° | 179.8° |
| C21 | N7 | C19 | C18 | 179.2° | 152.9° |
| C21 | N7 | C20 | C18 | 179.1° | 152.9° |
| N7 | C21 | C22 | H4 | 43.8° | 60.1° |
| N7 | C21 | C22 | H5 | 73.8° | 60.0° |
| C21 | N7 | C20 | H6 | 64.6° | 92.4° |
| C21 | N7 | C20 | H7 | 62.7° | 38.2° |
| C21 | N7 | C19 | H8 | 62.6° | 38.1° |
| C21 | N7 | C19 | H9 | 64.3° | 92.3° |
| N7 | C19 | C18 | H8 | 116.6° | 114.8° |
| N7 | C19 | C18 | H9 | 116.6° | 114.9° |
| C19 | N7 | C20 | C18 | 1.4° | 26.9° |
| N7 | C19 | C18 | N6 | 108.6° | 139.6° |
| C19 | N7 | C20 | H6 | 117.8° | 87.8° |
| C19 | N7 | C20 | H7 | 115.0° | 141.6° |
| N7 | C19 | H8 | H9 | 129.3° | 130.8° |
| N7 | C19 | C18 | H10 | 118.2° | 87.7° |
| N7 | C20 | C18 | H6 | 116.4° | 114.8° |
| N7 | C20 | C18 | H7 | 116.4° | 114.8° |
| N7 | C20 | C18 | N6 | 109.3° | 139.7° |
| N7 | C20 | H6 | H7 | 129.7° | 130.9° |
| C20 | N7 | C19 | H8 | 115.1° | 141.7° |
| C20 | N7 | C19 | H9 | 118.0° | 87.9° |
| N7 | C20 | C18 | H10 | 118.7° | 87.5° |
| C19 | C18 | C20 | N6 | 110.7° | 113.8° |
| C19 | C18 | C20 | H10 | 117.4° | 113.4° |
| C19 | C18 | N6 | H10 | 133.0° | 133.0° |
| C19 | C18 | N6 | C17 | 155.6° | 111.2° |
| C19 | C18 | C20 | H6 | 117.7° | 88.9° |
| C19 | C18 | C20 | H7 | 115.0° | 140.7° |
| C18 | C19 | H8 | H9 | 129.3° | 130.7° |
| C19 | C18 | N6 | H11 | 24.4° | 68.8° |
| C20 | C18 | N6 | H10 | 131.4° | 133.2° |
| C20 | C18 | N6 | C17 | 108.8° | 155.0° |
| C18 | C20 | H6 | H7 | 129.7° | 130.8° |
| C20 | C18 | C19 | H8 | 115.2° | 140.7° |
| C20 | C18 | C19 | H9 | 117.9° | 89.0° |
| C20 | C18 | N6 | H11 | 71.1° | 25.0° |
| C18 | N6 | C17 | H11 | 180.0° | 179.9° |
| C18 | N6 | C17 | C14 | 179.8° | 174.9° |
| C18 | N6 | C17 | O1 | 0.6° | 5.2° |
| N6 | C18 | C20 | H6 | 7.1° | 24.9° |
| N6 | C18 | C20 | H7 | 134.3° | 105.5° |
| N6 | C18 | C19 | H8 | 134.8° | 105.6° |
| N6 | C18 | C19 | H9 | 7.9° | 24.7° |
| CL2 | C15 | N5 | C14 | 178.9° | 180.0° |
| CL2 | C15 | C14 | C17 | 2.5° | 0.0° |
| CL2 | C15 | N5 | C13 | 178.8° | 179.9° |
| CL2 | C15 | C14 | N4 | 178.8° | 179.9° |
| N6 | C17 | C14 | C15 | 43.3° | 99.2° |
| N6 | C17 | C14 | O1 | 179.5° | 179.9° |
| N6 | C17 | C14 | N4 | 138.3° | 80.6° |
| C17 | N6 | C18 | H10 | 22.6° | 21.8° |
| N5 | C15 | C14 | C17 | 178.6° | 180.0° |
| N5 | C15 | C14 | N4 | 0.1° | 0.2° |
| C15 | N5 | C13 | N4 | 0.2° | 0.0° |
| C15 | N5 | C13 | C12 | 179.5° | 179.9° |
| C15 | C14 | C17 | N4 | 178.5° | 179.8° |
| C15 | C14 | C17 | O1 | 137.2° | 80.7° |
| C14 | C15 | N5 | C13 | 0.2° | 0.1° |
| C15 | C14 | N4 | C13 | 0.0° | 0.2° |
| C15 | C14 | N4 | C16 | 178.8° | 179.8° |
| C17 | C14 | N4 | C13 | 178.8° | 180.0° |
| C17 | C14 | N4 | C16 | 0.0° | 0.0° |
| C14 | C17 | N6 | H11 | 0.2° | 5.0° |
| O1 | C17 | C14 | N4 | 41.3° | 99.4° |
| O1 | C17 | N6 | H11 | 179.4° | 174.9° |
| N5 | C13 | N4 | C14 | 0.1° | 0.1° |
| N5 | C13 | N4 | C12 | 179.7° | 179.9° |
| N5 | C13 | N4 | C16 | 178.6° | 179.8° |
| N5 | C13 | C12 | N3 | 12.5° | 89.8° |
| N5 | C13 | C12 | H15 | 132.9° | 30.2° |
| N5 | C13 | C12 | H16 | 107.9° | 150.2° |
| C14 | N4 | C13 | C16 | 178.7° | 180.0° |
| C14 | N4 | C13 | C12 | 179.6° | 180.0° |
| C14 | N4 | C16 | H12 | 180.0° | 95.1° |
| C14 | N4 | C16 | H13 | 60.0° | 145.0° |
| C14 | N4 | C16 | H14 | 60.0° | 25.0° |
| N4 | C13 | C12 | N3 | 167.8° | 90.0° |
| C13 | N4 | C16 | H12 | 1.4° | 84.9° |
| C13 | N4 | C16 | H13 | 118.6° | 35.1° |
| C13 | N4 | C16 | H14 | 121.4° | 155.1° |
| N4 | C13 | C12 | H15 | 47.4° | 150.0° |
| N4 | C13 | C12 | H16 | 71.7° | 30.0° |
| C16 | N4 | C13 | C12 | 1.7° | 0.0° |
| N4 | C16 | H12 | H13 | 120.0° | 119.9° |
| N4 | C16 | H12 | H14 | 120.0° | 120.0° |
| N4 | C16 | H13 | H14 | 120.0° | 120.0° |
| C13 | C12 | N3 | H15 | 120.4° | 120.1° |
| C13 | C12 | N3 | H16 | 120.4° | 119.9° |
| C13 | C12 | N3 | C7 | 115.1° | 180.0° |
| C13 | C12 | H15 | H16 | 118.7° | 120.0° |
| C13 | C12 | N3 | H17 | 124.2° | 0.0° |
| C12 | N3 | C7 | H17 | 120.7° | 180.0° |
| C12 | N3 | C7 | N1 | 119.7° | 0.0° |
| C12 | N3 | C7 | C6 | 53.9° | 179.7° |
| N3 | C12 | H15 | H16 | 118.6° | 120.0° |
| N3 | C7 | N1 | C6 | 174.7° | 179.8° |
| N3 | C7 | C6 | C5 | 5.5° | 0.1° |
| N3 | C7 | N1 | N2 | 175.7° | 179.9° |
| N3 | C7 | C6 | C1 | 175.8° | 179.9° |
| C7 | N3 | C12 | H15 | 5.3° | 60.0° |
| C7 | N3 | C12 | H16 | 124.5° | 60.0° |
| N1 | C7 | C6 | C5 | 180.0° | 179.8° |
| N1 | C7 | C6 | C1 | 1.4° | 0.2° |
| C7 | N1 | N2 | C1 | 0.3° | 0.3° |
| N1 | C7 | N3 | H17 | 1.0° | 180.0° |
| C7 | N1 | N2 | H29 | 179.7° | 179.8° |
| C7 | C6 | C5 | C1 | 178.5° | 180.0° |
| C7 | C6 | C5 | C4 | 179.7° | 180.0° |
| C6 | C7 | N1 | N2 | 1.1° | 0.3° |
| C7 | C6 | C1 | N2 | 1.2° | 0.0° |
| C7 | C6 | C1 | C2 | 178.9° | 180.0° |
| C6 | C7 | N3 | H17 | 174.6° | 0.3° |
| C7 | C6 | C5 | H18 | 0.3° | 0.0° |
| C9 | C8 | C4 | C5 | 0.2° | 120.0° |
| C9 | C8 | C10 | C4 | 121.9° | 120.0° |
| C9 | C8 | C10 | C11 | 118.7° | 120.0° |
| C9 | C8 | C4 | C11 | 122.1° | 120.0° |
| C9 | C8 | C4 | C3 | 178.4° | 60.0° |
| C9 | C8 | C10 | H19 | 180.0° | 180.0° |
| C9 | C8 | C10 | H20 | 60.0° | 60.0° |
| C9 | C8 | C10 | H21 | 60.0° | 60.0° |
| C9 | C8 | C11 | H22 | 180.0° | 180.0° |
| C9 | C8 | C11 | H23 | 60.0° | 60.0° |
| C9 | C8 | C11 | H24 | 60.0° | 60.0° |
| C8 | C9 | H25 | H26 | 120.0° | 120.0° |
| C8 | C9 | H25 | H27 | 120.0° | 120.0° |
| C8 | C9 | H26 | H27 | 120.0° | 119.9° |
| C6 | C5 | C4 | H18 | 180.0° | 179.9° |
| C6 | C5 | C4 | C8 | 179.8° | 180.0° |
| C6 | C5 | C4 | C3 | 1.9° | 0.0° |
| C5 | C6 | C1 | N2 | 179.9° | 180.0° |
| C5 | C6 | C1 | C2 | 0.0° | 0.0° |
| C4 | C5 | C6 | C1 | 1.9° | 0.0° |
| C5 | C4 | C8 | C10 | 118.5° | 0.0° |
| C5 | C4 | C8 | C3 | 178.2° | 180.0° |
| C5 | C4 | C8 | C11 | 122.3° | 120.0° |
| C5 | C4 | C3 | C2 | 0.1° | 0.0° |
| C5 | C4 | C3 | CL1 | 179.8° | 180.0° |
| N1 | N2 | C1 | C6 | 0.6° | 0.2° |
| N1 | N2 | C1 | H29 | 180.0° | 179.8° |
| N1 | N2 | C1 | C2 | 179.5° | 179.8° |
| C6 | C1 | N2 | C2 | 179.9° | 180.0° |
| C6 | C1 | C2 | C3 | 1.7° | 0.0° |
| C1 | C6 | C5 | H18 | 178.1° | 180.0° |
| C6 | C1 | C2 | H28 | 178.3° | 180.0° |
| C6 | C1 | N2 | H29 | 179.4° | 180.0° |
| C10 | C8 | C4 | C11 | 119.2° | 120.0° |
| C10 | C8 | C4 | C3 | 59.7° | 180.0° |
| C8 | C10 | H19 | H20 | 120.0° | 120.0° |
| C8 | C10 | H19 | H21 | 120.0° | 120.0° |
| C8 | C10 | H20 | H21 | 120.0° | 120.0° |
| C10 | C8 | C11 | H22 | 63.4° | 60.0° |
| C10 | C8 | C11 | H23 | 56.7° | 180.0° |
| C10 | C8 | C11 | H24 | 176.6° | 60.0° |
| C10 | C8 | C9 | H25 | 180.0° | 59.9° |
| C10 | C8 | C9 | H26 | 60.0° | 180.0° |
| C10 | C8 | C9 | H27 | 60.0° | 60.0° |
| C8 | C4 | C3 | C2 | 178.4° | 180.0° |
| C8 | C4 | C3 | CL1 | 1.9° | 0.0° |
| C8 | C4 | C5 | H18 | 0.2° | 0.0° |
| C4 | C8 | C10 | H19 | 58.1° | 60.0° |
| C4 | C8 | C10 | H20 | 62.0° | 180.0° |
| C4 | C8 | C10 | H21 | 178.1° | 59.9° |
| C4 | C8 | C11 | H22 | 56.6° | 60.0° |
| C4 | C8 | C11 | H23 | 176.7° | 60.0° |
| C4 | C8 | C11 | H24 | 63.4° | 180.0° |
| C4 | C8 | C9 | H25 | 59.4° | 180.0° |
| C4 | C8 | C9 | H26 | 179.4° | 59.9° |
| C4 | C8 | C9 | H27 | 60.6° | 60.0° |
| C11 | C8 | C4 | C3 | 59.5° | 60.0° |
| C11 | C8 | C10 | H19 | 61.3° | 60.1° |
| C11 | C8 | C10 | H20 | 178.7° | 60.0° |
| C11 | C8 | C10 | H21 | 58.8° | 180.0° |
| C8 | C11 | H22 | H23 | 120.0° | 120.0° |
| C8 | C11 | H22 | H24 | 120.0° | 120.0° |
| C8 | C11 | H23 | H24 | 120.0° | 120.0° |
| C11 | C8 | C9 | H25 | 62.1° | 60.0° |
| C11 | C8 | C9 | H26 | 58.0° | 60.0° |
| C11 | C8 | C9 | H27 | 177.9° | 180.0° |
| C4 | C3 | C2 | C1 | 1.6° | 0.0° |
| C4 | C3 | C2 | CL1 | 179.7° | 180.0° |
| C3 | C4 | C5 | H18 | 178.1° | 180.0° |
| C4 | C3 | C2 | H28 | 178.3° | 180.0° |
| N2 | C1 | C2 | C3 | 178.2° | 180.0° |
| N2 | C1 | C2 | H28 | 1.8° | 0.0° |
| C1 | C2 | C3 | H28 | 180.0° | 179.9° |
| C1 | C2 | C3 | CL1 | 178.1° | 180.0° |
| C2 | C1 | N2 | H29 | 0.5° | 0.0° |
| CL1 | C3 | C2 | H28 | 2.0° | 0.1° |
| H1 | C23 | H2 | H3 | 120.0° | 120.0° |
| H1 | C23 | C22 | H4 | 58.8° | 60.0° |
| H1 | C23 | C22 | H5 | 58.8° | 180.0° |
| H2 | C23 | C22 | H4 | 61.2° | 180.0° |
| H2 | C23 | C22 | H5 | 178.8° | 60.0° |
| H3 | C23 | C22 | H4 | 178.8° | 60.0° |
| H3 | C23 | C22 | H5 | 61.2° | 60.0° |
| H6 | C20 | C18 | H10 | 124.9° | 157.8° |
| H7 | C20 | C18 | H10 | 2.4° | 27.3° |
| H8 | C19 | C18 | H10 | 1.6° | 27.1° |
| H9 | C19 | C18 | H10 | 125.3° | 157.4° |
| H10 | C18 | N6 | H11 | 157.4° | 158.2° |
| H12 | C16 | H13 | H14 | 120.0° | 120.0° |
| H15 | C12 | N3 | H17 | 115.3° | 120.0° |
| H16 | C12 | N3 | H17 | 3.8° | 120.0° |
| H19 | C10 | H20 | H21 | 120.0° | 120.0° |
| H22 | C11 | H23 | H24 | 120.0° | 120.0° |
| H25 | C9 | H26 | H27 | 120.0° | 120.0° |
