SUB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N1 | sing | 1.35Å | 1.46Å | |
| C1 | O3 | doub | 1.21Å | 1.51Å | |
| C1 | C16 | sing | 1.51Å | 1.44Å | |
| N1 | C2 | sing | 1.46Å | 1.48Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| C2 | C4 | sing | 1.53Å | 1.68Å | |
| C2 | C11 | sing | 1.51Å | 1.49Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | O1 | sing | 1.45Å | 1.58Å | |
| C3 | C12 | sing | 1.53Å | 1.62Å | |
| C3 | H31 | sing | 1.09Å | 1.10Å | |
| C3 | H32 | sing | 1.09Å | 1.10Å | |
| C4 | C5 | sing | 1.51Å | 1.56Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C4 | H42 | sing | 1.09Å | 1.10Å | |
| C5 | C6 | doub | 1.38Å | 1.48Å | Aromatic |
| C5 | C10 | sing | 1.38Å | 1.44Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.47Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | C8 | doub | 1.38Å | 1.46Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | C9 | sing | 1.38Å | 1.46Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | C10 | doub | 1.38Å | 1.44Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| O1 | C11 | sing | 1.34Å | 1.53Å | |
| O2 | C11 | doub | 1.21Å | 1.65Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H123 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.50Å | |
| C13 | N2 | sing | 1.46Å | 1.46Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | S1 | sing | 1.81Å | 1.55Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| S1 | C15 | sing | 1.82Å | 1.70Å | |
| C15 | C16 | sing | 1.53Å | 1.71Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C16 | N2 | sing | 1.46Å | 1.58Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| N2 | S2 | sing | 1.66Å | 1.72Å | |
| S2 | C17 | sing | 1.76Å | 1.75Å | |
| S2 | O4 | doub | 1.42Å | 1.44Å | |
| S2 | O5 | doub | 1.42Å | 1.50Å | |
| C17 | C18 | doub | 1.38Å | 1.44Å | Aromatic |
| C17 | C22 | sing | 1.38Å | 1.41Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.43Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | C20 | doub | 1.38Å | 1.48Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | C21 | sing | 1.38Å | 1.42Å | Aromatic |
| C20 | C23 | sing | 1.51Å | 1.52Å | |
| C21 | C22 | doub | 1.38Å | 1.46Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H233 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C1 | O3 | 122.5° | 120.0° |
| N1 | C1 | C16 | 125.5° | 120.0° |
| C1 | N1 | C2 | 116.6° | 120.0° |
| C1 | N1 | HN1 | 121.7° | 120.0° |
| O3 | C1 | C16 | 111.8° | 120.0° |
| C1 | C16 | C15 | 113.5° | 109.4° |
| C1 | C16 | N2 | 112.0° | 109.5° |
| C1 | C16 | H16 | 103.4° | 109.5° |
| C2 | N1 | HN1 | 121.7° | 120.0° |
| N1 | C2 | C4 | 122.9° | 109.5° |
| N1 | C2 | C11 | 128.4° | 109.5° |
| N1 | C2 | H2 | 43.4° | 109.5° |
| C4 | C2 | C11 | 108.1° | 109.5° |
| C4 | C2 | H2 | 130.6° | 109.5° |
| C2 | C4 | C5 | 95.1° | 109.5° |
| C2 | C4 | H41 | 117.4° | 109.5° |
| C2 | C4 | H42 | 114.6° | 109.5° |
| C11 | C2 | H2 | 107.5° | 109.4° |
| C2 | C11 | O1 | 145.7° | 120.0° |
| C2 | C11 | O2 | 102.7° | 120.0° |
| O1 | C3 | C12 | 140.2° | 109.4° |
| O1 | C3 | H31 | 93.5° | 109.5° |
| O1 | C3 | H32 | 100.3° | 109.5° |
| C3 | O1 | C11 | 129.5° | 120.0° |
| C12 | C3 | H31 | 93.6° | 109.4° |
| C12 | C3 | H32 | 100.2° | 109.5° |
| C3 | C12 | H121 | 109.5° | 109.5° |
| C3 | C12 | H122 | 109.5° | 109.5° |
| C3 | C12 | H123 | 109.5° | 109.5° |
| H31 | C3 | H32 | 138.0° | 109.5° |
| C5 | C4 | H41 | 117.4° | 109.5° |
| C5 | C4 | H42 | 114.6° | 109.5° |
| C4 | C5 | C6 | 122.5° | 120.0° |
| C4 | C5 | C10 | 120.0° | 120.0° |
| H41 | C4 | H42 | 99.0° | 109.5° |
| C6 | C5 | C10 | 117.5° | 120.0° |
| C5 | C6 | C7 | 120.1° | 120.0° |
| C5 | C6 | H6 | 119.9° | 120.1° |
| C5 | C10 | C9 | 123.4° | 120.0° |
| C5 | C10 | H10 | 118.3° | 120.0° |
| C7 | C6 | H6 | 119.9° | 119.9° |
| C6 | C7 | C8 | 120.3° | 120.0° |
| C6 | C7 | H7 | 119.8° | 120.0° |
| C8 | C7 | H7 | 119.8° | 120.0° |
| C7 | C8 | C9 | 119.1° | 120.0° |
| C7 | C8 | H8 | 120.4° | 120.0° |
| C9 | C8 | H8 | 120.4° | 120.0° |
| C8 | C9 | C10 | 119.5° | 120.0° |
| C8 | C9 | H9 | 120.2° | 120.0° |
| C10 | C9 | H9 | 120.3° | 120.0° |
| C9 | C10 | H10 | 118.3° | 120.0° |
| O1 | C11 | O2 | 111.6° | 120.0° |
| H121 | C12 | H122 | 109.5° | 109.4° |
| H121 | C12 | H123 | 109.5° | 109.5° |
| H122 | C12 | H123 | 109.5° | 109.5° |
| C14 | C13 | N2 | 114.2° | 109.5° |
| C14 | C13 | H131 | 106.9° | 109.5° |
| C14 | C13 | H132 | 107.9° | 109.5° |
| C13 | C14 | S1 | 106.3° | 109.2° |
| C13 | C14 | H141 | 111.2° | 109.5° |
| C13 | C14 | H142 | 110.6° | 109.4° |
| N2 | C13 | H131 | 106.8° | 109.4° |
| N2 | C13 | H132 | 107.9° | 109.4° |
| C13 | N2 | C16 | 106.0° | 120.4° |
| C13 | N2 | S2 | 145.2° | 119.8° |
| H131 | C13 | H132 | 113.3° | 109.5° |
| S1 | C14 | H141 | 111.2° | 109.5° |
| S1 | C14 | H142 | 110.5° | 109.5° |
| C14 | S1 | C15 | 96.8° | 99.7° |
| H141 | C14 | H142 | 107.1° | 109.6° |
| S1 | C15 | C16 | 110.1° | 109.2° |
| S1 | C15 | H151 | 109.1° | 109.5° |
| S1 | C15 | H152 | 109.3° | 109.5° |
| C16 | C15 | H151 | 109.1° | 109.5° |
| C16 | C15 | H152 | 109.3° | 109.6° |
| C15 | C16 | N2 | 104.1° | 109.5° |
| C15 | C16 | H16 | 111.3° | 109.4° |
| H151 | C15 | H152 | 110.0° | 109.6° |
| N2 | C16 | H16 | 112.8° | 109.5° |
| C16 | N2 | S2 | 102.2° | 119.8° |
| N2 | S2 | C17 | 95.1° | 107.4° |
| N2 | S2 | O4 | 119.7° | 105.7° |
| N2 | S2 | O5 | 93.2° | 105.8° |
| C17 | S2 | O4 | 113.8° | 105.7° |
| C17 | S2 | O5 | 99.4° | 105.8° |
| S2 | C17 | C18 | 117.5° | 120.0° |
| S2 | C17 | C22 | 122.2° | 120.0° |
| O4 | S2 | O5 | 129.0° | 125.4° |
| C18 | C17 | C22 | 120.3° | 120.0° |
| C17 | C18 | C19 | 120.1° | 120.0° |
| C17 | C18 | H18 | 119.9° | 120.0° |
| C17 | C22 | C21 | 120.3° | 120.0° |
| C17 | C22 | H22 | 119.9° | 120.0° |
| C19 | C18 | H18 | 119.9° | 120.0° |
| C18 | C19 | C20 | 119.7° | 120.0° |
| C18 | C19 | H19 | 120.1° | 120.0° |
| C20 | C19 | H19 | 120.1° | 120.0° |
| C19 | C20 | C21 | 119.1° | 120.0° |
| C19 | C20 | C23 | 122.1° | 120.0° |
| C21 | C20 | C23 | 118.8° | 120.0° |
| C20 | C21 | C22 | 120.4° | 120.0° |
| C20 | C21 | H21 | 119.8° | 120.0° |
| C20 | C23 | H231 | 109.5° | 109.5° |
| C20 | C23 | H232 | 109.5° | 109.5° |
| C20 | C23 | H233 | 109.5° | 109.5° |
| C22 | C21 | H21 | 119.8° | 120.0° |
| C21 | C22 | H22 | 119.8° | 120.0° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| H231 | C23 | H233 | 109.4° | 109.5° |
| H232 | C23 | H233 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | O3 | C16 | 174.3° | 180.0° |
| C1 | N1 | C2 | HN1 | 180.0° | 180.0° |
| C1 | N1 | C2 | C4 | 149.9° | 155.0° |
| C1 | N1 | C2 | C11 | 40.3° | 85.0° |
| C1 | N1 | C2 | H2 | 33.5° | 35.0° |
| N1 | C1 | C16 | C15 | 141.8° | 130.0° |
| N1 | C1 | C16 | N2 | 24.2° | 110.0° |
| N1 | C1 | C16 | H16 | 97.5° | 10.0° |
| O3 | C1 | N1 | C2 | 9.1° | 0.0° |
| O3 | C1 | N1 | HN1 | 170.9° | 180.0° |
| O3 | C1 | C16 | C15 | 32.3° | 50.1° |
| O3 | C1 | C16 | N2 | 149.8° | 70.0° |
| O3 | C1 | C16 | H16 | 88.4° | 170.0° |
| C16 | C1 | N1 | C2 | 177.5° | 180.0° |
| C16 | C1 | N1 | HN1 | 2.5° | 0.0° |
| C1 | C16 | N2 | C13 | 66.5° | 177.1° |
| C1 | C16 | C15 | S1 | 61.0° | 179.4° |
| C1 | C16 | C15 | N2 | 122.1° | 120.0° |
| C1 | C16 | C15 | H16 | 116.1° | 120.0° |
| C1 | C16 | C15 | H151 | 58.7° | 59.5° |
| C1 | C16 | C15 | H152 | 179.0° | 60.7° |
| C1 | C16 | N2 | H16 | 116.1° | 120.0° |
| C1 | C16 | N2 | S2 | 134.1° | 2.9° |
| N1 | C2 | C4 | C11 | 171.6° | 120.0° |
| N1 | C2 | C4 | H2 | 54.2° | 120.1° |
| N1 | C2 | C11 | H2 | 43.8° | 120.0° |
| N1 | C2 | C4 | C5 | 9.3° | 65.0° |
| N1 | C2 | C4 | H41 | 133.8° | 55.0° |
| N1 | C2 | C4 | H42 | 110.7° | 175.0° |
| N1 | C2 | C11 | O1 | 130.4° | 180.0° |
| N1 | C2 | C11 | O2 | 52.4° | 0.1° |
| HN1 | N1 | C2 | C4 | 30.1° | 25.0° |
| HN1 | N1 | C2 | C11 | 139.7° | 95.0° |
| HN1 | N1 | C2 | H2 | 146.5° | 145.0° |
| C4 | C2 | C11 | H2 | 145.2° | 120.0° |
| C2 | C4 | C5 | H41 | 124.5° | 120.0° |
| C2 | C4 | C5 | H42 | 120.0° | 120.0° |
| C2 | C4 | H41 | H42 | 123.8° | 120.0° |
| C2 | C4 | C5 | C6 | 71.9° | 89.9° |
| C2 | C4 | C5 | C10 | 109.4° | 90.2° |
| C4 | C2 | C11 | O1 | 58.6° | 60.0° |
| C4 | C2 | C11 | O2 | 118.5° | 120.0° |
| C2 | C11 | O1 | C3 | 175.7° | 179.9° |
| C11 | C2 | C4 | C5 | 179.1° | 175.0° |
| C11 | C2 | C4 | H41 | 54.6° | 65.0° |
| C11 | C2 | C4 | H42 | 60.9° | 55.0° |
| C2 | C11 | O1 | O2 | 177.0° | 179.9° |
| H2 | C2 | C4 | C5 | 44.9° | 55.1° |
| H2 | C2 | C4 | H41 | 79.6° | 175.1° |
| H2 | C2 | C4 | H42 | 164.9° | 64.9° |
| H2 | C2 | C11 | O1 | 86.6° | 60.0° |
| H2 | C2 | C11 | O2 | 96.2° | 120.1° |
| O1 | C3 | C12 | H31 | 99.9° | 120.0° |
| O1 | C3 | C12 | H32 | 120.0° | 120.0° |
| O1 | C3 | H31 | H32 | 109.6° | 120.1° |
| C3 | O1 | C11 | O2 | 1.3° | 0.0° |
| O1 | C3 | C12 | H121 | 72.3° | 59.9° |
| O1 | C3 | C12 | H122 | 167.7° | 60.0° |
| O1 | C3 | C12 | H123 | 47.7° | 180.0° |
| C12 | C3 | H31 | H32 | 109.6° | 120.0° |
| C12 | C3 | O1 | C11 | 158.6° | 180.0° |
| C3 | C12 | H121 | H122 | 120.0° | 120.0° |
| C3 | C12 | H121 | H123 | 120.0° | 120.0° |
| C3 | C12 | H122 | H123 | 120.0° | 120.1° |
| H31 | C3 | O1 | C11 | 58.7° | 60.0° |
| H31 | C3 | C12 | H121 | 27.5° | 60.0° |
| H31 | C3 | C12 | H122 | 92.5° | 180.0° |
| H31 | C3 | C12 | H123 | 147.5° | 60.0° |
| H32 | C3 | O1 | C11 | 81.4° | 60.0° |
| H32 | C3 | C12 | H121 | 167.7° | 180.0° |
| H32 | C3 | C12 | H122 | 47.7° | 60.1° |
| H32 | C3 | C12 | H123 | 72.3° | 60.0° |
| C5 | C4 | H41 | H42 | 123.8° | 120.0° |
| C4 | C5 | C6 | C10 | 178.7° | 179.8° |
| C4 | C5 | C6 | C7 | 178.7° | 179.9° |
| C4 | C5 | C6 | H6 | 1.3° | 0.0° |
| C4 | C5 | C10 | C9 | 178.8° | 179.8° |
| C4 | C5 | C10 | H10 | 1.2° | 0.2° |
| H41 | C4 | C5 | C6 | 163.6° | 30.1° |
| H41 | C4 | C5 | C10 | 15.0° | 149.8° |
| H42 | C4 | C5 | C6 | 48.1° | 150.0° |
| H42 | C4 | C5 | C10 | 130.5° | 29.8° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 0.2° | 0.0° |
| C5 | C6 | C7 | H7 | 179.9° | 180.0° |
| C6 | C5 | C10 | C9 | 0.1° | 0.4° |
| C6 | C5 | C10 | H10 | 179.9° | 180.0° |
| C10 | C5 | C6 | C7 | 0.0° | 0.2° |
| C10 | C5 | C6 | H6 | 180.0° | 179.8° |
| C5 | C10 | C9 | C8 | 0.3° | 0.3° |
| C5 | C10 | C9 | H10 | 180.0° | 179.6° |
| C5 | C10 | C9 | H9 | 179.7° | 179.7° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 0.4° | 0.0° |
| C6 | C7 | C8 | H8 | 179.6° | 180.0° |
| H6 | C6 | C7 | C8 | 179.8° | 180.0° |
| H6 | C6 | C7 | H7 | 0.1° | 0.0° |
| C7 | C8 | C9 | H8 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 0.5° | 0.1° |
| C7 | C8 | C9 | H9 | 179.5° | 179.9° |
| H7 | C7 | C8 | C9 | 179.6° | 180.0° |
| H7 | C7 | C8 | H8 | 0.3° | 0.0° |
| C8 | C9 | C10 | H9 | 180.0° | 179.9° |
| C8 | C9 | C10 | H10 | 179.7° | 180.0° |
| H8 | C8 | C9 | C10 | 179.5° | 179.9° |
| H8 | C8 | C9 | H9 | 0.5° | 0.1° |
| H9 | C9 | C10 | H10 | 0.3° | 0.1° |
| H121 | C12 | H122 | H123 | 120.0° | 120.0° |
| C14 | C13 | N2 | H131 | 117.9° | 120.0° |
| C14 | C13 | N2 | H132 | 120.0° | 120.0° |
| C14 | C13 | H131 | H132 | 118.7° | 120.0° |
| C13 | C14 | S1 | H141 | 121.2° | 119.9° |
| C13 | C14 | S1 | H142 | 120.0° | 119.9° |
| C13 | C14 | H141 | H142 | 120.9° | 120.1° |
| C13 | C14 | S1 | C15 | 68.9° | 57.4° |
| C14 | C13 | N2 | C16 | 69.8° | 62.9° |
| C14 | C13 | N2 | S2 | 73.0° | 117.2° |
| N2 | C13 | H131 | H132 | 118.6° | 119.9° |
| N2 | C13 | C14 | S1 | 80.2° | 59.4° |
| N2 | C13 | C14 | H141 | 158.6° | 60.6° |
| N2 | C13 | C14 | H142 | 39.8° | 179.3° |
| C13 | N2 | C16 | C15 | 56.5° | 62.9° |
| C13 | N2 | C16 | S2 | 159.3° | 179.9° |
| C13 | N2 | C16 | H16 | 177.4° | 57.1° |
| C13 | N2 | S2 | C17 | 91.8° | 97.2° |
| C13 | N2 | S2 | O4 | 147.1° | 15.4° |
| C13 | N2 | S2 | O5 | 7.9° | 150.2° |
| H131 | C13 | C14 | S1 | 161.9° | 179.3° |
| H131 | C13 | C14 | H141 | 40.7° | 59.4° |
| H131 | C13 | C14 | H142 | 78.1° | 60.7° |
| H131 | C13 | N2 | C16 | 172.2° | 177.1° |
| H131 | C13 | N2 | S2 | 44.9° | 2.9° |
| H132 | C13 | C14 | S1 | 39.8° | 60.6° |
| H132 | C13 | C14 | H141 | 81.4° | 179.4° |
| H132 | C13 | C14 | H142 | 159.8° | 59.3° |
| H132 | C13 | N2 | C16 | 50.2° | 57.1° |
| H132 | C13 | N2 | S2 | 167.0° | 122.8° |
| S1 | C14 | H141 | H142 | 120.8° | 120.2° |
| C14 | S1 | C15 | C16 | 65.3° | 57.4° |
| C14 | S1 | C15 | H151 | 175.0° | 62.5° |
| C14 | S1 | C15 | H152 | 54.7° | 177.4° |
| H141 | C14 | S1 | C15 | 169.9° | 62.5° |
| H142 | C14 | S1 | C15 | 51.1° | 177.3° |
| S1 | C15 | C16 | H151 | 119.7° | 119.9° |
| S1 | C15 | C16 | H152 | 120.0° | 119.9° |
| S1 | C15 | H151 | H152 | 119.8° | 120.1° |
| S1 | C15 | C16 | N2 | 61.0° | 59.3° |
| S1 | C15 | C16 | H16 | 177.1° | 60.7° |
| C16 | C15 | H151 | H152 | 119.8° | 120.2° |
| C15 | C16 | N2 | H16 | 120.8° | 120.0° |
| C15 | C16 | N2 | S2 | 102.8° | 117.2° |
| H151 | C15 | C16 | N2 | 179.2° | 60.5° |
| H151 | C15 | C16 | H16 | 57.4° | 179.4° |
| H152 | C15 | C16 | N2 | 59.0° | 179.2° |
| H152 | C15 | C16 | H16 | 62.9° | 59.2° |
| C16 | N2 | S2 | C17 | 124.6° | 82.9° |
| C16 | N2 | S2 | O4 | 3.6° | 164.6° |
| C16 | N2 | S2 | O5 | 135.6° | 29.8° |
| H16 | C16 | N2 | S2 | 18.0° | 122.9° |
| N2 | S2 | C17 | O4 | 125.6° | 112.5° |
| N2 | S2 | C17 | O5 | 94.1° | 112.6° |
| N2 | S2 | O4 | O5 | 122.9° | 123.1° |
| N2 | S2 | C17 | C18 | 92.1° | 73.2° |
| N2 | S2 | C17 | C22 | 87.2° | 107.1° |
| C17 | S2 | O4 | O5 | 125.9° | 123.2° |
| S2 | C17 | C18 | C22 | 179.2° | 179.7° |
| S2 | C17 | C18 | C19 | 179.1° | 180.0° |
| S2 | C17 | C18 | H18 | 0.9° | 0.0° |
| S2 | C17 | C22 | C21 | 179.0° | 179.8° |
| S2 | C17 | C22 | H22 | 1.0° | 0.2° |
| O4 | S2 | C17 | C18 | 142.3° | 39.4° |
| O4 | S2 | C17 | C22 | 38.5° | 140.4° |
| O5 | S2 | C17 | C18 | 2.0° | 174.2° |
| O5 | S2 | C17 | C22 | 178.7° | 5.5° |
| C17 | C18 | C19 | H18 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.0° | NaN° |
| C17 | C18 | C19 | H19 | 180.0° | 180.0° |
| C18 | C17 | C22 | C21 | 0.2° | 0.4° |
| C18 | C17 | C22 | H22 | 179.8° | 180.0° |
| C22 | C17 | C18 | C19 | 0.1° | 0.2° |
| C22 | C17 | C18 | H18 | 179.9° | 179.7° |
| C17 | C22 | C21 | C20 | 0.1° | 0.3° |
| C17 | C22 | C21 | H22 | 180.0° | 179.6° |
| C17 | C22 | C21 | H21 | 180.0° | 179.8° |
| C18 | C19 | C20 | H19 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.2° | 0.1° |
| C18 | C19 | C20 | C23 | 179.5° | 180.0° |
| H18 | C18 | C19 | C20 | 180.0° | 180.0° |
| H18 | C18 | C19 | H19 | 0.0° | 0.1° |
| C19 | C20 | C21 | C23 | 179.7° | 180.0° |
| C19 | C20 | C21 | C22 | 0.1° | 0.1° |
| C19 | C20 | C21 | H21 | 179.9° | 180.0° |
| C19 | C20 | C23 | H231 | 11.4° | 90.0° |
| C19 | C20 | C23 | H232 | 131.4° | 150.0° |
| C19 | C20 | C23 | H233 | 108.6° | 30.0° |
| H19 | C19 | C20 | C21 | 179.9° | 179.9° |
| H19 | C19 | C20 | C23 | 0.5° | 0.0° |
| C20 | C21 | C22 | H21 | 180.0° | 179.9° |
| C20 | C21 | C22 | H22 | 179.9° | 180.0° |
| C21 | C20 | C23 | H231 | 168.3° | 90.0° |
| C21 | C20 | C23 | H232 | 48.3° | 30.1° |
| C21 | C20 | C23 | H233 | 71.7° | 150.0° |
| C23 | C20 | C21 | C22 | 179.6° | 179.9° |
| C23 | C20 | C21 | H21 | 0.4° | 0.0° |
| C20 | C23 | H231 | H232 | 120.0° | 120.0° |
| C20 | C23 | H231 | H233 | 120.0° | 120.0° |
| C20 | C23 | H232 | H233 | 120.0° | 120.0° |
| H21 | C21 | C22 | H22 | 0.1° | 0.1° |
| H231 | C23 | H232 | H233 | 120.0° | 120.0° |
