8TL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C17 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C7 | C9 | sing | 1.53Å | 1.53Å | |
| C7 | O4 | sing | 1.45Å | 1.44Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | N3 | sing | 1.47Å | 1.48Å | |
| O4 | C6 | sing | 1.35Å | 1.36Å | |
| O3 | C6 | doub | 1.22Å | 1.23Å | |
| C6 | N1 | sing | 1.35Å | 1.33Å | |
| N3 | C11 | sing | 1.46Å | 1.48Å | |
| N3 | C12 | sing | 1.33Å | 1.40Å | |
| C11 | C3 | sing | 1.53Å | 1.53Å | |
| O5 | C12 | doub | 1.21Å | 1.23Å | |
| N1 | O1 | sing | 1.42Å | 1.38Å | |
| N1 | C3 | sing | 1.46Å | 1.47Å | |
| C12 | C10 | sing | 1.51Å | 1.53Å | |
| O1 | C1 | sing | 1.43Å | 1.43Å | |
| C3 | N2 | sing | 1.47Å | 1.47Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| N2 | C10 | sing | 1.47Å | 1.47Å | |
| N2 | C2 | sing | 1.34Å | 1.40Å | |
| C10 | C18 | sing | 1.53Å | 1.53Å | |
| C1 | C2 | sing | 1.50Å | 1.53Å | |
| C1 | C4 | sing | 1.53Å | 1.53Å | |
| C2 | O2 | doub | 1.21Å | 1.23Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | S1 | sing | 1.81Å | 1.83Å | |
| S1 | C20 | sing | 1.81Å | 1.78Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C9 | H20 | sing | 1.09Å | 1.10Å | |
| C9 | H21 | sing | 1.09Å | 1.10Å | |
| C9 | H22 | sing | 1.09Å | 1.10Å | |
| C1 | H23 | sing | 1.09Å | 1.10Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C11 | H25 | sing | 1.09Å | 1.10Å | |
| C11 | H26 | sing | 1.09Å | 1.10Å | |
| C14 | H27 | sing | 1.09Å | 1.10Å | |
| C14 | H28 | sing | 1.09Å | 1.10Å | |
| C16 | H29 | sing | 1.09Å | 1.10Å | |
| C16 | H30 | sing | 1.09Å | 1.10Å | |
| C16 | H31 | sing | 1.09Å | 1.10Å | |
| C18 | H32 | sing | 1.09Å | 1.10Å | |
| C18 | H33 | sing | 1.09Å | 1.10Å | |
| C19 | H34 | sing | 1.09Å | 1.10Å | |
| C19 | H35 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | C15 | C17 | 110.5° | 109.5° |
| C16 | C15 | C14 | 110.4° | 109.5° |
| C16 | C15 | H13 | 108.4° | 109.4° |
| C15 | C16 | H29 | 109.5° | 109.4° |
| C15 | C16 | H30 | 109.5° | 109.5° |
| C15 | C16 | H31 | 109.5° | 109.4° |
| C8 | C7 | C9 | 109.0° | 109.5° |
| C8 | C7 | O4 | 109.0° | 109.5° |
| C8 | C7 | H6 | 109.4° | 109.5° |
| C7 | C8 | H7 | 109.5° | 109.5° |
| C7 | C8 | H8 | 109.4° | 109.5° |
| C7 | C8 | H9 | 109.5° | 109.5° |
| C17 | C15 | C14 | 110.7° | 109.5° |
| C17 | C15 | H13 | 108.4° | 109.5° |
| C15 | C17 | H14 | 109.5° | 109.5° |
| C15 | C17 | H15 | 109.5° | 109.4° |
| C15 | C17 | H16 | 109.5° | 109.4° |
| C15 | C14 | C13 | 110.6° | 109.4° |
| C14 | C15 | H13 | 108.4° | 109.5° |
| C15 | C14 | H27 | 109.2° | 109.5° |
| C15 | C14 | H28 | 109.2° | 109.4° |
| C9 | C7 | O4 | 109.3° | 109.4° |
| C9 | C7 | H6 | 109.4° | 109.5° |
| C7 | C9 | H20 | 109.5° | 109.5° |
| C7 | C9 | H21 | 109.5° | 109.4° |
| C7 | C9 | H22 | 109.5° | 109.5° |
| C7 | O4 | C6 | 109.9° | 117.0° |
| O4 | C7 | H6 | 110.7° | 109.5° |
| C14 | C13 | N3 | 109.6° | 109.4° |
| C14 | C13 | H11 | 109.4° | 109.5° |
| C14 | C13 | H12 | 109.4° | 109.5° |
| C13 | C14 | H27 | 109.2° | 109.5° |
| C13 | C14 | H28 | 109.2° | 109.5° |
| C13 | N3 | C11 | 121.0° | 117.8° |
| C13 | N3 | C12 | 121.2° | 117.7° |
| N3 | C13 | H11 | 109.4° | 109.5° |
| N3 | C13 | H12 | 109.4° | 109.4° |
| O4 | C6 | O3 | 119.9° | 120.0° |
| O4 | C6 | N1 | 119.1° | 120.0° |
| O3 | C6 | N1 | 120.9° | 120.0° |
| C6 | N1 | O1 | 117.2° | 120.3° |
| C6 | N1 | C3 | 119.4° | 120.2° |
| C11 | N3 | C12 | 117.8° | 124.6° |
| N3 | C11 | C3 | 113.1° | 110.7° |
| N3 | C11 | H25 | 108.6° | 109.3° |
| N3 | C11 | H26 | 108.5° | 109.2° |
| N3 | C12 | O5 | 122.0° | 118.5° |
| N3 | C12 | C10 | 115.9° | 123.0° |
| C11 | C3 | N1 | 110.1° | 109.5° |
| C11 | C3 | N2 | 108.8° | 108.3° |
| C11 | C3 | H24 | 109.1° | 109.4° |
| C3 | C11 | H25 | 108.6° | 109.2° |
| C3 | C11 | H26 | 108.5° | 109.3° |
| O5 | C12 | C10 | 122.1° | 118.5° |
| O1 | N1 | C3 | 123.4° | 119.5° |
| N1 | O1 | C1 | 115.1° | 112.1° |
| N1 | C3 | N2 | 108.9° | 110.7° |
| N1 | C3 | H24 | 109.9° | 109.4° |
| C12 | C10 | N2 | 103.3° | 108.7° |
| C12 | C10 | C18 | 108.4° | 109.6° |
| C12 | C10 | H10 | 111.5° | 109.7° |
| O1 | C1 | C2 | 109.6° | 108.9° |
| O1 | C1 | C4 | 109.1° | 109.5° |
| O1 | C1 | H23 | 110.5° | 109.5° |
| C3 | N2 | C10 | 120.8° | 117.2° |
| C3 | N2 | C2 | 118.0° | 123.0° |
| N2 | C3 | H24 | 110.0° | 109.4° |
| C5 | C4 | C1 | 110.8° | 109.5° |
| C5 | C4 | H1 | 109.1° | 109.5° |
| C5 | C4 | H2 | 109.2° | 109.5° |
| C4 | C5 | H3 | 109.5° | 109.5° |
| C4 | C5 | H4 | 109.5° | 109.4° |
| C4 | C5 | H5 | 109.4° | 109.5° |
| C10 | N2 | C2 | 120.9° | 119.8° |
| N2 | C10 | C18 | 109.5° | 109.6° |
| N2 | C10 | H10 | 112.4° | 109.6° |
| N2 | C2 | C1 | 117.5° | 122.3° |
| N2 | C2 | O2 | 121.2° | 118.9° |
| C10 | C18 | C19 | 111.1° | 109.5° |
| C18 | C10 | H10 | 111.4° | 109.6° |
| C10 | C18 | H32 | 109.1° | 109.4° |
| C10 | C18 | H33 | 109.1° | 109.5° |
| C2 | C1 | C4 | 109.3° | 109.6° |
| C1 | C2 | O2 | 121.3° | 118.8° |
| C2 | C1 | H23 | 109.2° | 109.6° |
| C1 | C4 | H1 | 109.1° | 109.4° |
| C1 | C4 | H2 | 109.1° | 109.4° |
| C4 | C1 | H23 | 109.1° | 109.6° |
| C18 | C19 | S1 | 113.0° | 109.5° |
| C19 | C18 | H32 | 109.1° | 109.5° |
| C19 | C18 | H33 | 109.1° | 109.5° |
| C18 | C19 | H34 | 108.6° | 109.4° |
| C18 | C19 | H35 | 108.6° | 109.5° |
| C19 | S1 | C20 | 99.9° | 103.0° |
| S1 | C19 | H34 | 108.6° | 109.5° |
| S1 | C19 | H35 | 108.6° | 109.5° |
| S1 | C20 | H17 | 109.5° | 109.5° |
| S1 | C20 | H18 | 109.4° | 109.4° |
| S1 | C20 | H19 | 109.5° | 109.4° |
| H1 | C4 | H2 | 109.4° | 109.4° |
| H3 | C5 | H4 | 109.5° | 109.5° |
| H3 | C5 | H5 | 109.5° | 109.5° |
| H4 | C5 | H5 | 109.4° | 109.5° |
| H7 | C8 | H8 | 109.5° | 109.5° |
| H7 | C8 | H9 | 109.5° | 109.5° |
| H8 | C8 | H9 | 109.5° | 109.4° |
| H11 | C13 | H12 | 109.5° | 109.5° |
| H14 | C17 | H15 | 109.5° | 109.5° |
| H14 | C17 | H16 | 109.4° | 109.5° |
| H15 | C17 | H16 | 109.5° | 109.5° |
| H17 | C20 | H18 | 109.5° | 109.5° |
| H17 | C20 | H19 | 109.5° | 109.5° |
| H18 | C20 | H19 | 109.5° | 109.4° |
| H20 | C9 | H21 | 109.5° | 109.4° |
| H20 | C9 | H22 | 109.5° | 109.5° |
| H21 | C9 | H22 | 109.4° | 109.5° |
| H25 | C11 | H26 | 109.4° | 109.2° |
| H27 | C14 | H28 | 109.5° | 109.5° |
| H29 | C16 | H30 | 109.4° | 109.5° |
| H29 | C16 | H31 | 109.5° | 109.5° |
| H30 | C16 | H31 | 109.5° | 109.5° |
| H32 | C18 | H33 | 109.5° | 109.5° |
| H34 | C19 | H35 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | C15 | C17 | C14 | 122.6° | 120.0° |
| C16 | C15 | C17 | H13 | 118.6° | 120.0° |
| C16 | C15 | C14 | H13 | 118.6° | 120.0° |
| C16 | C15 | C14 | C13 | 60.4° | 175.0° |
| C16 | C15 | C17 | H14 | 180.0° | 60.0° |
| C16 | C15 | C17 | H15 | 60.0° | 180.0° |
| C16 | C15 | C17 | H16 | 60.0° | 60.0° |
| C16 | C15 | C14 | H27 | 179.4° | 54.9° |
| C16 | C15 | C14 | H28 | 59.8° | 65.0° |
| C15 | C16 | H29 | H30 | 120.0° | 120.0° |
| C15 | C16 | H29 | H31 | 120.0° | 119.9° |
| C15 | C16 | H30 | H31 | 120.0° | 120.0° |
| C8 | C7 | C9 | O4 | 119.0° | 120.0° |
| C8 | C7 | C9 | H6 | 119.6° | 120.1° |
| C8 | C7 | O4 | H6 | 120.4° | 120.1° |
| C8 | C7 | O4 | C6 | 177.9° | 90.0° |
| C7 | C8 | H7 | H8 | 120.0° | 120.0° |
| C7 | C8 | H7 | H9 | 120.0° | 120.0° |
| C7 | C8 | H8 | H9 | 120.0° | 119.9° |
| C8 | C7 | C9 | H20 | 180.0° | 180.0° |
| C8 | C7 | C9 | H21 | 60.0° | 60.0° |
| C8 | C7 | C9 | H22 | 60.0° | 59.9° |
| C17 | C15 | C14 | H13 | 118.8° | 120.0° |
| C17 | C15 | C14 | C13 | 176.9° | 65.0° |
| C15 | C17 | H14 | H15 | 120.0° | 120.0° |
| C15 | C17 | H14 | H16 | 120.0° | 120.0° |
| C15 | C17 | H15 | H16 | 120.0° | 120.0° |
| C17 | C15 | C14 | H27 | 56.8° | 174.9° |
| C17 | C15 | C14 | H28 | 62.9° | 55.0° |
| C17 | C15 | C16 | H29 | 180.0° | 60.0° |
| C17 | C15 | C16 | H30 | 60.0° | 60.0° |
| C17 | C15 | C16 | H31 | 60.0° | 180.0° |
| C15 | C14 | C13 | H27 | 120.2° | 120.0° |
| C15 | C14 | C13 | H28 | 120.2° | 119.9° |
| C15 | C14 | C13 | N3 | 179.4° | 180.0° |
| C15 | C14 | C13 | H11 | 60.5° | 60.0° |
| C15 | C14 | C13 | H12 | 59.4° | 60.1° |
| C14 | C15 | C17 | H14 | 57.4° | 60.0° |
| C14 | C15 | C17 | H15 | 177.4° | 60.0° |
| C14 | C15 | C17 | H16 | 62.6° | 180.0° |
| C15 | C14 | H27 | H28 | 119.5° | 119.9° |
| C14 | C15 | C16 | H29 | 57.2° | 60.0° |
| C14 | C15 | C16 | H30 | 62.8° | 180.0° |
| C14 | C15 | C16 | H31 | 177.2° | 59.9° |
| C9 | C7 | O4 | H6 | 120.6° | 120.0° |
| C9 | C7 | O4 | C6 | 63.1° | 150.0° |
| C9 | C7 | C8 | H7 | 180.0° | 60.0° |
| C9 | C7 | C8 | H8 | 60.0° | 60.1° |
| C9 | C7 | C8 | H9 | 60.0° | 180.0° |
| C7 | C9 | H20 | H21 | 120.0° | 119.9° |
| C7 | C9 | H20 | H22 | 120.0° | 120.1° |
| C7 | C9 | H21 | H22 | 120.0° | 120.0° |
| C7 | O4 | C6 | O3 | 0.1° | 0.0° |
| C7 | O4 | C6 | N1 | 179.8° | 180.0° |
| O4 | C7 | C8 | H7 | 60.8° | 59.9° |
| O4 | C7 | C8 | H8 | 179.2° | 180.0° |
| O4 | C7 | C8 | H9 | 59.2° | 60.0° |
| O4 | C7 | C9 | H20 | 61.0° | 60.1° |
| O4 | C7 | C9 | H21 | 59.1° | 180.0° |
| O4 | C7 | C9 | H22 | 179.0° | 60.0° |
| C14 | C13 | N3 | H11 | 120.0° | 120.0° |
| C14 | C13 | N3 | H12 | 120.0° | 120.0° |
| C14 | C13 | N3 | C11 | 119.3° | 90.0° |
| C14 | C13 | N3 | C12 | 61.2° | 90.0° |
| C14 | C13 | H11 | H12 | 119.9° | 120.1° |
| C13 | C14 | C15 | H13 | 58.2° | 55.1° |
| C13 | C14 | H27 | H28 | 119.4° | 120.0° |
| C13 | N3 | C11 | C12 | 179.5° | 180.0° |
| C13 | N3 | C11 | C3 | 134.0° | 158.3° |
| C13 | N3 | C12 | O5 | 2.1° | 4.3° |
| C13 | N3 | C12 | C10 | 178.6° | 175.7° |
| N3 | C13 | H11 | H12 | 119.9° | 119.9° |
| C13 | N3 | C11 | H25 | 13.4° | 81.3° |
| C13 | N3 | C11 | H26 | 105.5° | 38.0° |
| N3 | C13 | C14 | H27 | 59.3° | 60.0° |
| N3 | C13 | C14 | H28 | 60.4° | 60.1° |
| O4 | C6 | O3 | N1 | 180.0° | 180.0° |
| O4 | C6 | N1 | O1 | 1.6° | 0.0° |
| O4 | C6 | N1 | C3 | 179.8° | 179.8° |
| C6 | O4 | C7 | H6 | 57.5° | 30.1° |
| O3 | C6 | N1 | O1 | 178.4° | 180.0° |
| O3 | C6 | N1 | C3 | 0.2° | 0.2° |
| C6 | N1 | C3 | C11 | 24.1° | 89.4° |
| C6 | N1 | O1 | C3 | 178.2° | 179.8° |
| C6 | N1 | O1 | C1 | 177.5° | 124.0° |
| C6 | N1 | C3 | N2 | 143.2° | 151.2° |
| C6 | N1 | C3 | H24 | 96.2° | 30.5° |
| N3 | C11 | C3 | H25 | 120.6° | 120.3° |
| N3 | C11 | C3 | H26 | 120.5° | 120.3° |
| C11 | N3 | C12 | O5 | 178.5° | 175.7° |
| N3 | C11 | C3 | N1 | 85.1° | 167.6° |
| C11 | N3 | C12 | C10 | 0.9° | 4.3° |
| N3 | C11 | C3 | N2 | 34.1° | 46.8° |
| C11 | N3 | C13 | H11 | 120.7° | 150.0° |
| C11 | N3 | C13 | H12 | 0.7° | 30.0° |
| N3 | C11 | C3 | H24 | 154.1° | 72.5° |
| N3 | C11 | H25 | H26 | 118.3° | 119.4° |
| C12 | N3 | C11 | C3 | 45.5° | 21.7° |
| N3 | C12 | O5 | C10 | 179.3° | 180.0° |
| N3 | C12 | C10 | N2 | 47.8° | 12.8° |
| N3 | C12 | C10 | C18 | 68.3° | 107.0° |
| N3 | C12 | C10 | H10 | 168.7° | 132.7° |
| C12 | N3 | C13 | H11 | 58.8° | 30.0° |
| C12 | N3 | C13 | H12 | 178.8° | 150.0° |
| C12 | N3 | C11 | H25 | 166.1° | 98.6° |
| C12 | N3 | C11 | H26 | 75.0° | 142.0° |
| C11 | C3 | N1 | O1 | 157.8° | 90.8° |
| C11 | C3 | N1 | N2 | 119.2° | 119.4° |
| C11 | C3 | N1 | H24 | 120.3° | 119.9° |
| C11 | C3 | N2 | H24 | 119.5° | 119.3° |
| C11 | C3 | N2 | C10 | 19.8° | 61.8° |
| C11 | C3 | N2 | C2 | 153.4° | 117.9° |
| C3 | C11 | H25 | H26 | 118.3° | 119.4° |
| O5 | C12 | C10 | N2 | 132.8° | 167.2° |
| O5 | C12 | C10 | C18 | 111.1° | 73.0° |
| O5 | C12 | C10 | H10 | 11.9° | 47.3° |
| O1 | N1 | C3 | N2 | 38.6° | 28.6° |
| N1 | O1 | C1 | C2 | 41.8° | 50.6° |
| N1 | O1 | C1 | C4 | 161.5° | 170.5° |
| N1 | O1 | C1 | H23 | 78.5° | 69.3° |
| O1 | N1 | C3 | H24 | 81.9° | 149.2° |
| C3 | N1 | O1 | C1 | 0.7° | 55.7° |
| N1 | C3 | N2 | H24 | 120.5° | 120.7° |
| N1 | C3 | N2 | C10 | 139.8° | 178.1° |
| N1 | C3 | N2 | C2 | 33.4° | 2.1° |
| N1 | C3 | C11 | H25 | 35.5° | 47.3° |
| N1 | C3 | C11 | H26 | 154.3° | 72.1° |
| C12 | C10 | N2 | C3 | 60.4° | 43.0° |
| C12 | C10 | N2 | C18 | 115.3° | 119.8° |
| C12 | C10 | N2 | H10 | 120.3° | 119.9° |
| C12 | C10 | N2 | C2 | 112.6° | 136.7° |
| C12 | C10 | C18 | H10 | 123.0° | 120.4° |
| C12 | C10 | C18 | C19 | 67.4° | 175.4° |
| C12 | C10 | C18 | H32 | 172.3° | 64.6° |
| C12 | C10 | C18 | H33 | 52.8° | 55.4° |
| O1 | C1 | C4 | C5 | 60.8° | 65.0° |
| O1 | C1 | C2 | N2 | 45.8° | 27.3° |
| O1 | C1 | C2 | C4 | 119.5° | 119.8° |
| O1 | C1 | C2 | H23 | 121.2° | 119.8° |
| O1 | C1 | C4 | H23 | 120.8° | 120.2° |
| O1 | C1 | C2 | O2 | 135.3° | 152.7° |
| O1 | C1 | C4 | H1 | 179.0° | 55.0° |
| O1 | C1 | C4 | H2 | 59.4° | 174.9° |
| C3 | N2 | C10 | C2 | 173.0° | 179.7° |
| C3 | N2 | C10 | C18 | 54.9° | 76.8° |
| C3 | N2 | C2 | C1 | 6.2° | 3.0° |
| C3 | N2 | C2 | O2 | 174.9° | 177.0° |
| C3 | N2 | C10 | H10 | 179.3° | 162.9° |
| N2 | C3 | C11 | H25 | 154.7° | 73.5° |
| N2 | C3 | C11 | H26 | 86.4° | 167.1° |
| C5 | C4 | C1 | C2 | 59.0° | 175.5° |
| C5 | C4 | C1 | H1 | 120.2° | 120.0° |
| C5 | C4 | C1 | H2 | 120.2° | 120.1° |
| C5 | C4 | H1 | H2 | 119.4° | 120.1° |
| C4 | C5 | H3 | H4 | 120.0° | 120.0° |
| C4 | C5 | H3 | H5 | 120.0° | 120.0° |
| C4 | C5 | H4 | H5 | 119.9° | 119.9° |
| C5 | C4 | C1 | H23 | 178.4° | 55.2° |
| N2 | C10 | C18 | H10 | 125.0° | 120.3° |
| C10 | N2 | C2 | C1 | 179.4° | 177.3° |
| C10 | N2 | C2 | O2 | 1.7° | 2.7° |
| N2 | C10 | C18 | C19 | 179.4° | 65.3° |
| C10 | N2 | C3 | H24 | 99.7° | 57.4° |
| N2 | C10 | C18 | H32 | 60.3° | 54.7° |
| N2 | C10 | C18 | H33 | 59.1° | 174.7° |
| C2 | N2 | C10 | C18 | 132.1° | 103.5° |
| N2 | C2 | C1 | O2 | 178.9° | 180.0° |
| N2 | C2 | C1 | C4 | 165.4° | 147.1° |
| C2 | N2 | C10 | H10 | 7.7° | 16.8° |
| N2 | C2 | C1 | H23 | 75.3° | 92.6° |
| C2 | N2 | C3 | H24 | 87.1° | 122.8° |
| C10 | C18 | C19 | H32 | 120.3° | 120.0° |
| C10 | C18 | C19 | H33 | 120.2° | 120.0° |
| C10 | C18 | C19 | S1 | 60.7° | 180.0° |
| C10 | C18 | H32 | H33 | 119.2° | 120.0° |
| C10 | C18 | C19 | H34 | 178.7° | 60.0° |
| C10 | C18 | C19 | H35 | 59.8° | 59.9° |
| C2 | C1 | C4 | H23 | 119.3° | 120.3° |
| C2 | C1 | C4 | H1 | 61.2° | 64.4° |
| C2 | C1 | C4 | H2 | 179.3° | 55.5° |
| C4 | C1 | C2 | O2 | 15.7° | 32.9° |
| C1 | C4 | H1 | H2 | 119.4° | 119.9° |
| C1 | C4 | C5 | H3 | 180.0° | 60.0° |
| C1 | C4 | C5 | H4 | 60.0° | 60.0° |
| C1 | C4 | C5 | H5 | 60.0° | 180.0° |
| O2 | C2 | C1 | H23 | 103.6° | 87.5° |
| C18 | C19 | S1 | H34 | 120.5° | 120.0° |
| C18 | C19 | S1 | H35 | 120.5° | 120.0° |
| C18 | C19 | S1 | C20 | 62.0° | 180.0° |
| C19 | C18 | C10 | H10 | 55.6° | 55.0° |
| C19 | C18 | H32 | H33 | 119.3° | 120.0° |
| C18 | C19 | H34 | H35 | 118.4° | 120.0° |
| C19 | S1 | C20 | H17 | 180.0° | 60.0° |
| C19 | S1 | C20 | H18 | 60.0° | 60.1° |
| C19 | S1 | C20 | H19 | 60.0° | 180.0° |
| S1 | C19 | C18 | H32 | 59.5° | 60.0° |
| S1 | C19 | C18 | H33 | 179.0° | 60.0° |
| S1 | C19 | H34 | H35 | 118.4° | 120.1° |
| S1 | C20 | H17 | H18 | 120.0° | 120.0° |
| S1 | C20 | H17 | H19 | 120.0° | 120.0° |
| S1 | C20 | H18 | H19 | 120.0° | 119.9° |
| C20 | S1 | C19 | H34 | 58.5° | 60.0° |
| C20 | S1 | C19 | H35 | 177.4° | 60.0° |
| H1 | C4 | C5 | H3 | 59.8° | 60.0° |
| H1 | C4 | C5 | H4 | 60.2° | 180.0° |
| H1 | C4 | C5 | H5 | 179.8° | 60.0° |
| H1 | C4 | C1 | H23 | 58.2° | 175.2° |
| H2 | C4 | C5 | H3 | 59.8° | 180.0° |
| H2 | C4 | C5 | H4 | 179.8° | 60.0° |
| H2 | C4 | C5 | H5 | 60.2° | 60.0° |
| H2 | C4 | C1 | H23 | 61.4° | 64.9° |
| H3 | C5 | H4 | H5 | 120.0° | 120.0° |
| H6 | C7 | C8 | H7 | 60.4° | 180.0° |
| H6 | C7 | C8 | H8 | 59.6° | 59.9° |
| H6 | C7 | C8 | H9 | 179.6° | 60.0° |
| H6 | C7 | C9 | H20 | 60.4° | 59.9° |
| H6 | C7 | C9 | H21 | 179.6° | 60.0° |
| H6 | C7 | C9 | H22 | 59.6° | 180.0° |
| H7 | C8 | H8 | H9 | 120.0° | 120.0° |
| H10 | C10 | C18 | H32 | 64.7° | 175.0° |
| H10 | C10 | C18 | H33 | 175.8° | 65.0° |
| H11 | C13 | C14 | H27 | 179.3° | 180.0° |
| H11 | C13 | C14 | H28 | 59.6° | 59.9° |
| H12 | C13 | C14 | H27 | 60.7° | 60.0° |
| H12 | C13 | C14 | H28 | 179.6° | 180.0° |
| H13 | C15 | C17 | H14 | 61.4° | 179.9° |
| H13 | C15 | C17 | H15 | 58.6° | 60.0° |
| H13 | C15 | C17 | H16 | 178.6° | 59.9° |
| H13 | C15 | C14 | H27 | 62.0° | 65.0° |
| H13 | C15 | C14 | H28 | 178.3° | 175.0° |
| H13 | C15 | C16 | H29 | 61.4° | NaN° |
| H13 | C15 | C16 | H30 | 178.6° | 60.0° |
| H13 | C15 | C16 | H31 | 58.6° | 60.0° |
| H14 | C17 | H15 | H16 | 120.0° | 120.0° |
| H17 | C20 | H18 | H19 | 120.0° | 120.0° |
| H20 | C9 | H21 | H22 | 120.0° | 120.0° |
| H24 | C3 | C11 | H25 | 85.3° | 167.2° |
| H24 | C3 | C11 | H26 | 33.6° | 47.8° |
| H29 | C16 | H30 | H31 | 120.0° | 120.1° |
| H32 | C18 | C19 | H34 | 61.0° | 180.0° |
| H32 | C18 | C19 | H35 | 180.0° | 60.0° |
| H33 | C18 | C19 | H34 | 58.5° | 60.0° |
| H33 | C18 | C19 | H35 | 60.5° | 179.9° |
