8J6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C18 | sing | 1.53Å | 1.53Å | |
| C23 | C17 | sing | 1.53Å | 1.53Å | |
| C18 | N2 | sing | 1.45Å | 1.50Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C18 | C21 | sing | 1.55Å | 1.54Å | |
| C15 | C19 | sing | 1.53Å | 1.50Å | |
| C15 | N1 | sing | 1.47Å | 1.51Å | |
| C15 | C16 | sing | 1.53Å | 1.49Å | |
| N2 | C17 | sing | 1.45Å | 1.50Å | |
| N1 | C13 | sing | 1.39Å | 1.48Å | |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C17 | C22 | sing | 1.55Å | 1.53Å | |
| C1 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C1 | C | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| C | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| N | C13 | doub | 1.30Å | 1.35Å | Aromatic |
| N | C12 | sing | 1.33Å | 1.37Å | Aromatic |
| C13 | S | sing | 1.76Å | 1.70Å | Aromatic |
| C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C6 | sing | 1.48Å | 1.55Å | |
| C5 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | C10 | sing | 1.48Å | 1.56Å | |
| C12 | C14 | doub | 1.34Å | 1.41Å | Aromatic |
| C10 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 1.40Å | Aromatic |
| S | C14 | sing | 1.76Å | 1.71Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | H1 | sing | 1.09Å | 1.10Å | |
| C23 | H2 | sing | 1.09Å | 1.10Å | |
| C23 | H3 | sing | 1.09Å | 1.10Å | |
| C16 | H4 | sing | 1.09Å | 1.10Å | |
| C16 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| N2 | H9 | sing | 1.01Å | 1.00Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| N1 | H20 | sing | 0.97Å | 1.00Å | |
| C14 | H21 | sing | 1.08Å | 1.08Å | |
| C9 | H22 | sing | 1.08Å | 1.08Å | |
| C8 | H23 | sing | 1.08Å | 1.08Å | |
| C7 | H24 | sing | 1.08Å | 1.08Å | |
| C11 | H25 | sing | 1.08Å | 1.08Å | |
| C2 | H26 | sing | 1.08Å | 1.08Å | |
| C1 | H27 | sing | 1.08Å | 1.08Å | |
| C4 | H28 | sing | 1.08Å | 1.08Å | |
| C5 | H29 | sing | 1.08Å | 1.08Å | |
| C | H30 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C18 | N2 | 108.1° | 111.6° |
| C20 | C18 | C19 | 108.4° | 109.8° |
| C20 | C18 | C21 | 107.1° | 107.2° |
| C18 | C20 | H11 | 109.5° | 109.4° |
| C18 | C20 | H12 | 109.5° | 109.5° |
| C18 | C20 | H13 | 109.5° | 109.4° |
| C23 | C17 | N2 | 109.6° | 111.8° |
| C23 | C17 | C16 | 108.4° | 110.0° |
| C23 | C17 | C22 | 108.1° | 107.3° |
| C17 | C23 | H1 | 109.5° | 109.4° |
| C17 | C23 | H2 | 109.5° | 109.5° |
| C17 | C23 | H3 | 109.5° | 109.4° |
| N2 | C18 | C19 | 118.1° | 112.7° |
| N2 | C18 | C21 | 107.5° | 107.9° |
| C18 | N2 | C17 | 119.7° | 119.3° |
| C18 | N2 | H9 | 106.9° | 112.4° |
| C19 | C18 | C21 | 107.2° | 107.4° |
| C18 | C19 | C15 | 114.3° | 110.6° |
| C18 | C19 | H17 | 108.2° | 109.4° |
| C18 | C19 | H18 | 108.2° | 109.4° |
| C18 | C21 | H14 | 109.5° | 109.5° |
| C18 | C21 | H15 | 109.4° | 109.4° |
| C18 | C21 | H16 | 109.5° | 109.4° |
| C19 | C15 | N1 | 112.5° | 109.2° |
| C19 | C15 | C16 | 110.3° | 108.7° |
| C15 | C19 | H17 | 108.2° | 109.3° |
| C15 | C19 | H18 | 108.3° | 109.4° |
| C19 | C15 | H19 | 108.0° | 110.4° |
| N1 | C15 | C16 | 110.1° | 109.2° |
| C15 | N1 | C13 | 126.4° | 120.0° |
| N1 | C15 | H19 | 107.7° | 108.9° |
| C15 | N1 | H20 | 105.1° | 120.0° |
| C15 | C16 | C17 | 108.8° | 110.1° |
| C15 | C16 | H4 | 109.6° | 109.5° |
| C15 | C16 | H5 | 109.6° | 109.5° |
| C16 | C15 | H19 | 108.1° | 110.4° |
| N2 | C17 | C16 | 113.6° | 112.0° |
| N2 | C17 | C22 | 108.2° | 108.0° |
| C17 | N2 | H9 | 106.9° | 112.3° |
| N1 | C13 | N | 124.8° | 125.3° |
| N1 | C13 | S | 129.3° | 125.3° |
| C13 | N1 | H20 | 105.1° | 120.0° |
| C16 | C17 | C22 | 108.8° | 107.4° |
| C17 | C16 | H4 | 109.7° | 109.3° |
| C17 | C16 | H5 | 109.7° | 109.4° |
| C17 | C22 | H6 | 109.5° | 109.5° |
| C17 | C22 | H7 | 109.5° | 109.5° |
| C17 | C22 | H8 | 109.5° | 109.4° |
| C2 | C1 | C | 120.0° | 120.1° |
| C1 | C2 | C3 | 120.1° | 119.9° |
| C1 | C2 | H26 | 120.0° | 120.1° |
| C2 | C1 | H27 | 120.0° | 120.0° |
| C1 | C | C5 | 119.8° | 120.2° |
| C | C1 | H27 | 120.0° | 119.9° |
| C1 | C | H30 | 120.1° | 119.9° |
| C2 | C3 | C4 | 119.9° | 119.7° |
| C2 | C3 | C6 | 120.1° | 120.1° |
| C3 | C2 | H26 | 119.9° | 120.0° |
| C | C5 | C4 | 120.3° | 120.1° |
| C | C5 | H29 | 119.9° | 119.9° |
| C5 | C | H30 | 120.1° | 119.9° |
| C13 | N | C12 | 116.5° | 116.9° |
| N | C13 | S | 105.9° | 109.5° |
| N | C12 | C10 | 121.8° | 122.3° |
| N | C12 | C14 | 115.4° | 115.3° |
| C13 | S | C14 | 98.4° | 90.1° |
| C4 | C3 | C6 | 120.0° | 120.2° |
| C3 | C4 | C5 | 119.9° | 119.9° |
| C3 | C4 | H28 | 120.0° | 120.1° |
| C3 | C6 | C11 | 120.2° | 120.1° |
| C3 | C6 | C7 | 119.6° | 120.1° |
| C5 | C4 | H28 | 120.0° | 120.0° |
| C4 | C5 | H29 | 119.9° | 119.9° |
| C6 | C11 | C10 | 120.0° | 119.8° |
| C11 | C6 | C7 | 120.2° | 119.8° |
| C6 | C11 | H25 | 120.1° | 120.2° |
| C11 | C10 | C12 | 119.8° | 120.1° |
| C11 | C10 | C9 | 119.8° | 119.9° |
| C10 | C11 | H25 | 120.0° | 120.0° |
| C6 | C7 | C8 | 119.9° | 120.2° |
| C6 | C7 | H24 | 120.1° | 119.9° |
| C10 | C12 | C14 | 122.8° | 122.4° |
| C12 | C10 | C9 | 120.4° | 120.0° |
| C12 | C14 | S | 103.8° | 108.3° |
| C12 | C14 | H21 | 128.1° | 125.9° |
| C10 | C9 | C8 | 120.1° | 120.1° |
| C10 | C9 | H22 | 119.9° | 120.0° |
| C7 | C8 | C9 | 120.1° | 120.2° |
| C7 | C8 | H23 | 120.0° | 119.8° |
| C8 | C7 | H24 | 120.1° | 119.9° |
| S | C14 | H21 | 128.1° | 125.9° |
| C8 | C9 | H22 | 120.0° | 119.9° |
| C9 | C8 | H23 | 120.0° | 119.9° |
| H1 | C23 | H2 | 109.5° | 109.6° |
| H1 | C23 | H3 | 109.5° | 109.5° |
| H2 | C23 | H3 | 109.4° | 109.4° |
| H4 | C16 | H5 | 109.5° | 109.0° |
| H6 | C22 | H7 | 109.5° | 109.4° |
| H6 | C22 | H8 | 109.5° | 109.5° |
| H7 | C22 | H8 | 109.4° | 109.5° |
| H11 | C20 | H12 | 109.5° | 109.5° |
| H11 | C20 | H13 | 109.5° | 109.5° |
| H12 | C20 | H13 | 109.4° | 109.5° |
| H14 | C21 | H15 | 109.5° | 109.5° |
| H14 | C21 | H16 | 109.5° | 109.5° |
| H15 | C21 | H16 | 109.5° | 109.5° |
| H17 | C19 | H18 | 109.5° | 108.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C18 | N2 | C19 | 123.5° | 124.1° |
| C20 | C18 | N2 | C21 | 115.2° | 117.5° |
| C20 | C18 | C19 | C21 | 115.3° | 116.2° |
| C20 | C18 | C19 | C15 | 114.8° | 75.5° |
| C20 | C18 | N2 | C17 | 132.5° | 80.5° |
| C20 | C18 | N2 | H9 | 11.0° | 54.0° |
| C18 | C20 | H11 | H12 | 120.0° | 120.0° |
| C18 | C20 | H11 | H13 | 120.0° | 120.0° |
| C18 | C20 | H12 | H13 | 120.0° | 120.0° |
| C20 | C18 | C21 | H14 | 180.0° | 60.4° |
| C20 | C18 | C21 | H15 | 60.0° | 59.7° |
| C20 | C18 | C21 | H16 | 60.0° | 179.6° |
| C20 | C18 | C19 | H17 | 124.5° | 164.0° |
| C20 | C18 | C19 | H18 | 5.9° | 45.0° |
| C23 | C17 | N2 | C18 | 109.0° | 79.2° |
| C23 | C17 | C16 | C15 | 71.3° | 73.0° |
| C23 | C17 | N2 | C16 | 121.5° | 124.0° |
| C23 | C17 | N2 | C22 | 117.6° | 117.9° |
| C23 | C17 | C16 | C22 | 117.3° | 116.5° |
| C17 | C23 | H1 | H2 | 120.0° | 120.0° |
| C17 | C23 | H1 | H3 | 120.0° | 120.0° |
| C17 | C23 | H2 | H3 | 120.0° | 119.9° |
| C23 | C17 | C16 | H4 | 168.8° | 47.3° |
| C23 | C17 | C16 | H5 | 48.6° | 166.6° |
| C23 | C17 | C22 | H6 | 180.0° | 60.0° |
| C23 | C17 | C22 | H7 | 60.0° | 179.9° |
| C23 | C17 | C22 | H8 | 60.0° | 60.0° |
| C23 | C17 | N2 | H9 | 12.4° | 55.4° |
| N2 | C18 | C19 | C21 | 121.4° | 118.7° |
| N2 | C18 | C19 | C15 | 8.5° | 49.6° |
| C18 | N2 | C17 | H9 | 121.4° | 134.6° |
| C18 | N2 | C17 | C16 | 12.5° | 44.8° |
| C18 | N2 | C17 | C22 | 133.4° | 162.9° |
| N2 | C18 | C20 | H11 | 180.0° | 60.0° |
| N2 | C18 | C20 | H12 | 60.0° | 180.0° |
| N2 | C18 | C20 | H13 | 60.0° | 60.0° |
| N2 | C18 | C21 | H14 | 64.1° | 60.0° |
| N2 | C18 | C21 | H15 | 55.9° | 180.0° |
| N2 | C18 | C21 | H16 | 175.9° | 60.0° |
| N2 | C18 | C19 | H17 | 112.2° | 70.9° |
| N2 | C18 | C19 | H18 | 129.2° | 170.1° |
| C18 | C19 | C15 | H17 | 120.7° | 120.5° |
| C18 | C19 | C15 | H18 | 120.7° | 120.6° |
| C18 | C19 | C15 | N1 | 170.8° | 178.1° |
| C18 | C19 | C15 | C16 | 47.5° | 59.0° |
| C19 | C18 | N2 | C17 | 9.0° | 43.6° |
| C19 | C18 | N2 | H9 | 112.5° | 178.1° |
| C19 | C18 | C20 | H11 | 50.8° | 65.7° |
| C19 | C18 | C20 | H12 | 170.9° | 54.3° |
| C19 | C18 | C20 | H13 | 69.2° | 174.3° |
| C19 | C18 | C21 | H14 | 63.8° | 178.3° |
| C19 | C18 | C21 | H15 | 176.2° | 58.2° |
| C19 | C18 | C21 | H16 | 56.2° | 61.7° |
| C18 | C19 | H17 | H18 | 117.8° | 119.4° |
| C18 | C19 | C15 | H19 | 70.4° | 62.2° |
| C21 | C18 | C19 | C15 | 129.9° | 168.3° |
| C21 | C18 | N2 | C17 | 112.3° | 162.0° |
| C21 | C18 | N2 | H9 | 126.3° | 63.5° |
| C21 | C18 | C20 | H11 | 64.5° | 178.0° |
| C21 | C18 | C20 | H12 | 55.5° | 62.0° |
| C21 | C18 | C20 | H13 | 175.5° | 58.0° |
| C18 | C21 | H14 | H15 | 120.0° | 120.0° |
| C18 | C21 | H14 | H16 | 120.0° | 120.0° |
| C18 | C21 | H15 | H16 | 120.0° | 119.9° |
| C21 | C18 | C19 | H17 | 9.2° | 47.8° |
| C21 | C18 | C19 | H18 | 109.4° | 71.2° |
| C19 | C15 | N1 | C16 | 123.5° | 118.8° |
| C19 | C15 | N1 | H19 | 118.9° | 120.6° |
| C19 | C15 | C16 | H19 | 117.8° | 121.2° |
| C19 | C15 | N1 | C13 | 37.0° | 155.0° |
| C19 | C15 | C16 | C17 | 69.4° | 60.3° |
| C19 | C15 | C16 | H4 | 50.4° | 179.5° |
| C19 | C15 | C16 | H5 | 170.6° | 60.1° |
| C15 | C19 | H17 | H18 | 117.8° | 119.3° |
| C19 | C15 | N1 | H20 | 85.2° | 25.0° |
| N1 | C15 | C16 | H19 | 117.4° | 119.7° |
| C15 | N1 | C13 | H20 | 122.2° | 180.0° |
| N1 | C15 | C16 | C17 | 165.8° | 179.4° |
| C15 | N1 | C13 | N | 157.9° | 179.8° |
| C15 | N1 | C13 | S | 22.8° | 0.0° |
| N1 | C15 | C16 | H4 | 74.3° | 60.4° |
| N1 | C15 | C16 | H5 | 45.9° | 59.0° |
| N1 | C15 | C19 | H17 | 50.1° | 57.6° |
| N1 | C15 | C19 | H18 | 68.5° | 61.3° |
| C15 | C16 | C17 | N2 | 50.8° | 52.0° |
| C16 | C15 | N1 | C13 | 86.4° | 86.2° |
| C15 | C16 | C17 | H4 | 119.9° | 120.3° |
| C15 | C16 | C17 | H5 | 119.9° | 120.4° |
| C15 | C16 | C17 | C22 | 171.4° | 170.5° |
| C15 | C16 | H4 | H5 | 120.3° | 119.7° |
| C16 | C15 | C19 | H17 | 73.2° | 61.5° |
| C16 | C15 | C19 | H18 | 168.2° | 179.6° |
| C16 | C15 | N1 | H20 | 151.3° | 93.8° |
| N2 | C17 | C16 | C22 | 120.5° | 118.4° |
| N2 | C17 | C23 | H1 | 180.0° | 65.2° |
| N2 | C17 | C23 | H2 | 60.0° | 54.9° |
| N2 | C17 | C23 | H3 | 60.0° | 174.8° |
| N2 | C17 | C16 | H4 | 69.0° | 172.3° |
| N2 | C17 | C16 | H5 | 170.7° | 68.3° |
| N2 | C17 | C22 | H6 | 61.4° | 60.7° |
| N2 | C17 | C22 | H7 | 178.6° | 59.2° |
| N2 | C17 | C22 | H8 | 58.6° | 179.2° |
| N1 | C13 | N | S | 179.5° | 179.7° |
| N1 | C13 | N | C12 | 179.5° | 179.9° |
| N1 | C13 | S | C14 | 179.7° | 180.0° |
| C13 | N1 | C15 | H19 | 155.9° | 34.4° |
| C16 | C17 | C23 | H1 | 55.5° | 59.9° |
| C16 | C17 | C23 | H2 | 64.5° | 180.0° |
| C16 | C17 | C23 | H3 | 175.5° | 60.1° |
| C17 | C16 | H4 | H5 | 120.4° | 119.6° |
| C16 | C17 | C22 | H6 | 62.4° | 178.3° |
| C16 | C17 | C22 | H7 | 57.6° | 61.8° |
| C16 | C17 | C22 | H8 | 177.5° | 58.2° |
| C16 | C17 | N2 | H9 | 133.9° | 179.4° |
| C17 | C16 | C15 | H19 | 48.4° | 61.0° |
| C22 | C17 | C23 | H1 | 62.3° | 176.5° |
| C22 | C17 | C23 | H2 | 177.7° | 63.4° |
| C22 | C17 | C23 | H3 | 57.7° | 56.5° |
| C22 | C17 | C16 | H4 | 51.5° | 69.2° |
| C22 | C17 | C16 | H5 | 68.7° | 50.1° |
| C17 | C22 | H6 | H7 | 120.0° | 120.0° |
| C17 | C22 | H6 | H8 | 120.0° | 120.0° |
| C17 | C22 | H7 | H8 | 120.0° | 120.0° |
| C22 | C17 | N2 | H9 | 105.2° | 62.5° |
| C2 | C1 | C | H27 | 180.0° | 180.0° |
| C1 | C2 | C3 | H26 | 180.0° | 179.9° |
| C2 | C1 | C | C5 | 0.1° | 0.3° |
| C1 | C2 | C3 | C4 | 0.2° | 0.0° |
| C1 | C2 | C3 | C6 | 179.9° | 179.7° |
| C2 | C1 | C | H30 | 179.9° | 180.0° |
| C | C1 | C2 | C3 | 0.2° | 0.0° |
| C1 | C | C5 | H30 | 180.0° | 179.7° |
| C1 | C | C5 | C4 | 0.0° | 0.5° |
| C | C1 | C2 | H26 | 179.9° | 179.9° |
| C1 | C | C5 | H29 | 179.9° | 180.0° |
| C2 | C3 | C4 | C6 | 179.7° | 179.7° |
| C2 | C3 | C4 | C5 | 0.2° | 0.3° |
| C2 | C3 | C6 | C11 | 142.0° | 0.3° |
| C2 | C3 | C6 | C7 | 38.1° | 179.8° |
| C3 | C2 | C1 | H27 | 179.8° | 180.0° |
| C2 | C3 | C4 | H28 | 179.8° | 179.6° |
| C | C5 | C4 | C3 | 0.1° | 0.5° |
| C | C5 | C4 | H29 | 180.0° | 179.5° |
| C5 | C | C1 | H27 | 179.9° | 179.7° |
| C | C5 | C4 | H28 | 179.9° | 179.4° |
| C13 | N | C12 | C10 | 179.8° | 180.0° |
| C13 | N | C12 | C14 | 0.2° | 0.0° |
| N | C13 | S | C14 | 0.2° | 0.2° |
| N | C13 | N1 | H20 | 35.6° | 0.2° |
| C12 | N | C13 | S | 0.0° | 0.2° |
| N | C12 | C10 | C11 | 38.0° | 4.8° |
| N | C12 | C10 | C14 | 179.6° | 180.0° |
| N | C12 | C10 | C9 | 141.6° | 174.9° |
| N | C12 | C14 | S | 0.3° | 0.1° |
| N | C12 | C14 | H21 | 179.7° | 179.9° |
| C13 | S | C14 | C12 | 0.3° | 0.2° |
| S | C13 | N1 | H20 | 145.0° | 179.9° |
| C13 | S | C14 | H21 | 179.7° | 180.0° |
| C3 | C4 | C5 | H28 | 180.0° | 179.9° |
| C4 | C3 | C6 | C11 | 37.6° | 180.0° |
| C4 | C3 | C6 | C7 | 142.2° | 0.5° |
| C4 | C3 | C2 | H26 | 179.8° | 179.9° |
| C3 | C4 | C5 | H29 | 179.9° | 180.0° |
| C6 | C3 | C4 | C5 | 179.8° | 180.0° |
| C3 | C6 | C11 | C7 | 179.9° | 179.5° |
| C3 | C6 | C11 | C10 | 179.9° | 180.0° |
| C3 | C6 | C7 | C8 | 179.9° | 179.7° |
| C3 | C6 | C7 | H24 | 0.1° | 0.3° |
| C3 | C6 | C11 | H25 | 0.0° | 0.5° |
| C6 | C3 | C2 | H26 | 0.2° | 0.4° |
| C6 | C3 | C4 | H28 | 0.2° | 0.0° |
| C4 | C5 | C | H30 | 180.0° | 179.8° |
| C6 | C11 | C10 | H25 | 180.0° | 179.5° |
| C6 | C11 | C10 | C12 | 179.7° | 179.7° |
| C6 | C11 | C10 | C9 | 0.1° | 0.6° |
| C11 | C6 | C7 | C8 | 0.2° | 0.2° |
| C11 | C6 | C7 | H24 | 179.8° | 179.7° |
| C10 | C11 | C6 | C7 | 0.1° | 0.5° |
| C11 | C10 | C12 | C9 | 179.6° | 179.7° |
| C11 | C10 | C12 | C14 | 142.4° | 175.2° |
| C11 | C10 | C9 | C8 | 0.2° | 0.4° |
| C11 | C10 | C9 | H22 | 179.7° | 179.8° |
| C6 | C7 | C8 | H24 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 0.1° | 0.0° |
| C6 | C7 | C8 | H23 | 179.9° | 179.9° |
| C7 | C6 | C11 | H25 | 179.9° | 180.0° |
| C10 | C12 | C14 | S | 180.0° | 179.8° |
| C12 | C10 | C9 | C8 | 179.8° | 180.0° |
| C10 | C12 | C14 | H21 | 0.1° | 0.1° |
| C12 | C10 | C9 | H22 | 0.2° | 0.1° |
| C12 | C10 | C11 | H25 | 0.3° | 0.3° |
| C14 | C12 | C10 | C9 | 38.0° | 5.1° |
| C12 | C14 | S | H21 | 180.0° | 179.8° |
| C10 | C9 | C8 | C7 | 0.1° | 0.1° |
| C10 | C9 | C8 | H22 | 180.0° | 179.9° |
| C10 | C9 | C8 | H23 | 179.9° | 179.9° |
| C9 | C10 | C11 | H25 | 179.9° | 180.0° |
| C7 | C8 | C9 | H23 | 180.0° | 179.9° |
| C7 | C8 | C9 | H22 | 179.8° | 179.9° |
| C9 | C8 | C7 | H24 | 179.9° | 180.0° |
| H1 | C23 | H2 | H3 | 120.0° | 120.1° |
| H4 | C16 | C15 | H19 | 168.3° | 59.3° |
| H5 | C16 | C15 | H19 | 71.5° | 178.7° |
| H6 | C22 | H7 | H8 | 119.9° | 120.0° |
| H11 | C20 | H12 | H13 | 120.0° | 120.1° |
| H14 | C21 | H15 | H16 | 120.0° | 120.1° |
| H17 | C19 | C15 | H19 | 168.9° | 177.3° |
| H18 | C19 | C15 | H19 | 50.3° | 58.3° |
| H19 | C15 | N1 | H20 | 33.7° | 145.6° |
| H22 | C9 | C8 | H23 | 0.2° | 0.0° |
| H23 | C8 | C7 | H24 | 0.1° | 0.1° |
| H26 | C2 | C1 | H27 | 0.1° | 0.1° |
| H27 | C1 | C | H30 | 0.0° | 0.0° |
| H28 | C4 | C5 | H29 | 0.1° | 0.1° |
| H29 | C5 | C | H30 | 0.0° | 0.3° |
