A1BL8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F39 | C37 | sing | 1.40Å | 1.40Å | |
| C33 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| C32 | C31 | sing | 1.39Å | 1.39Å | Aromatic |
| F40 | C37 | sing | 1.40Å | 1.40Å | |
| O27 | C25 | doub | 1.21Å | 1.36Å | |
| C37 | C34 | sing | 1.51Å | 1.51Å | |
| C37 | F38 | sing | 1.40Å | 1.39Å | |
| C34 | C35 | doub | 1.38Å | 1.38Å | Aromatic |
| C31 | N30 | sing | 1.40Å | 1.40Å | |
| C31 | C36 | doub | 1.39Å | 1.39Å | Aromatic |
| O26 | C25 | sing | 1.34Å | 1.21Å | |
| C25 | C24 | sing | 1.51Å | 1.51Å | |
| N30 | C28 | sing | 1.35Å | 1.36Å | |
| C28 | O29 | doub | 1.22Å | 1.22Å | |
| C28 | C1 | sing | 1.46Å | 1.47Å | |
| C35 | C36 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | S5 | sing | 1.76Å | 1.76Å | Aromatic |
| C1 | C2 | doub | 1.37Å | 1.37Å | Aromatic |
| S5 | C4 | sing | 1.71Å | 1.72Å | Aromatic |
| C24 | C2 | sing | 1.51Å | 1.51Å | |
| C2 | N3 | sing | 1.31Å | 1.30Å | Aromatic |
| N3 | C4 | doub | 1.30Å | 1.29Å | Aromatic |
| C4 | C6 | sing | 1.48Å | 1.49Å | |
| C6 | C7 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.51Å | 1.51Å | |
| C11 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.54Å | 1.53Å | |
| C10 | C9 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C14 | sing | 1.51Å | 1.50Å | |
| C13 | C14 | sing | 1.54Å | 1.54Å | |
| C13 | C15 | sing | 1.51Å | 1.51Å | |
| N17 | C15 | sing | 1.35Å | 1.36Å | |
| N17 | C18 | sing | 1.40Å | 1.40Å | |
| C15 | O16 | doub | 1.21Å | 1.22Å | |
| C23 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.37Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | H1 | sing | 1.08Å | 1.08Å | |
| C8 | H2 | sing | 1.08Å | 1.08Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C19 | H5 | sing | 1.08Å | 1.08Å | |
| C21 | H6 | sing | 1.08Å | 1.08Å | |
| C23 | H7 | sing | 1.08Å | 1.08Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| O26 | H10 | sing | 0.97Å | 0.95Å | |
| C32 | H11 | sing | 1.08Å | 1.08Å | |
| C33 | H12 | sing | 1.08Å | 1.08Å | |
| C35 | H13 | sing | 1.08Å | 1.08Å | |
| C36 | H14 | sing | 1.08Å | 1.08Å | |
| C9 | H15 | sing | 1.08Å | 1.08Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| N17 | H19 | sing | 0.97Å | 1.00Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | H21 | sing | 1.08Å | 1.08Å | |
| N30 | H22 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F39 | C37 | F40 | 109.8° | 109.5° |
| F39 | C37 | C34 | 109.3° | 109.4° |
| F39 | C37 | F38 | 108.6° | 109.4° |
| C32 | C33 | C34 | 120.3° | 120.0° |
| C33 | C32 | C31 | 120.0° | 119.9° |
| C33 | C32 | H11 | 120.0° | 120.0° |
| C32 | C33 | H12 | 119.8° | 119.9° |
| C33 | C34 | C37 | 120.4° | 119.9° |
| C33 | C34 | C35 | 119.3° | 120.2° |
| C34 | C33 | H12 | 119.8° | 120.0° |
| C32 | C31 | N30 | 122.3° | 120.0° |
| C32 | C31 | C36 | 119.1° | 119.9° |
| C31 | C32 | H11 | 120.0° | 120.1° |
| F40 | C37 | C34 | 109.2° | 109.5° |
| F40 | C37 | F38 | 108.6° | 109.5° |
| O27 | C25 | O26 | 119.7° | 120.0° |
| O27 | C25 | C24 | 122.4° | 120.0° |
| C34 | C37 | F38 | 111.3° | 109.5° |
| C37 | C34 | C35 | 120.2° | 119.9° |
| C34 | C35 | C36 | 120.6° | 120.1° |
| C34 | C35 | H13 | 119.7° | 120.0° |
| N30 | C31 | C36 | 118.5° | 120.1° |
| C31 | N30 | C28 | 124.9° | 120.0° |
| C31 | N30 | H22 | 117.6° | 120.1° |
| C31 | C36 | C35 | 120.6° | 119.9° |
| C31 | C36 | H14 | 119.7° | 120.0° |
| O26 | C25 | C24 | 117.9° | 120.0° |
| C25 | O26 | H10 | 109.5° | 117.0° |
| C25 | C24 | C2 | 110.0° | 109.5° |
| C25 | C24 | H8 | 109.4° | 109.5° |
| C25 | C24 | H9 | 109.3° | 109.5° |
| N30 | C28 | O29 | 122.0° | 120.0° |
| N30 | C28 | C1 | 116.9° | 120.1° |
| C28 | N30 | H22 | 117.5° | 119.9° |
| O29 | C28 | C1 | 121.0° | 120.0° |
| C28 | C1 | S5 | 121.7° | 126.1° |
| C28 | C1 | C2 | 131.5° | 126.1° |
| C36 | C35 | H13 | 119.7° | 120.0° |
| C35 | C36 | H14 | 119.7° | 120.1° |
| S5 | C1 | C2 | 106.7° | 107.7° |
| C1 | S5 | C4 | 91.6° | 90.4° |
| C1 | C2 | C24 | 127.9° | 123.0° |
| C1 | C2 | N3 | 113.6° | 114.0° |
| S5 | C4 | N3 | 108.4° | 110.5° |
| S5 | C4 | C6 | 128.8° | 124.8° |
| C24 | C2 | N3 | 118.4° | 123.0° |
| C2 | C24 | H8 | 109.3° | 109.5° |
| C2 | C24 | H9 | 109.4° | 109.4° |
| C2 | N3 | C4 | 119.6° | 117.3° |
| N3 | C4 | C6 | 122.8° | 124.7° |
| C4 | C6 | C7 | 120.0° | 120.0° |
| C4 | C6 | C11 | 121.1° | 120.0° |
| C7 | C6 | C11 | 118.8° | 119.9° |
| C6 | C7 | C8 | 120.3° | 119.7° |
| C6 | C7 | H1 | 119.9° | 120.1° |
| C6 | C11 | C12 | 129.7° | 130.4° |
| C6 | C11 | C10 | 120.2° | 119.8° |
| C7 | C8 | C9 | 120.4° | 120.1° |
| C8 | C7 | H1 | 119.8° | 120.2° |
| C7 | C8 | H2 | 119.8° | 119.9° |
| C12 | C11 | C10 | 110.1° | 109.8° |
| C11 | C12 | C13 | 107.2° | 105.2° |
| C11 | C12 | H3 | 110.0° | 110.3° |
| C11 | C12 | H4 | 110.1° | 110.3° |
| C11 | C10 | C9 | 120.3° | 119.9° |
| C11 | C10 | C14 | 110.6° | 109.8° |
| C8 | C9 | C10 | 120.0° | 120.6° |
| C9 | C8 | H2 | 119.8° | 120.0° |
| C8 | C9 | H15 | 120.0° | 119.8° |
| C12 | C13 | C14 | 104.7° | 102.3° |
| C12 | C13 | C15 | 112.4° | 110.9° |
| C13 | C12 | H3 | 110.1° | 110.3° |
| C13 | C12 | H4 | 110.1° | 110.3° |
| C12 | C13 | H16 | 109.0° | 110.8° |
| C9 | C10 | C14 | 129.0° | 130.3° |
| C10 | C9 | H15 | 120.0° | 119.7° |
| C10 | C14 | C13 | 107.0° | 105.2° |
| C10 | C14 | H17 | 110.1° | 110.3° |
| C10 | C14 | H18 | 110.1° | 110.3° |
| C14 | C13 | C15 | 112.5° | 110.8° |
| C14 | C13 | H16 | 108.9° | 110.8° |
| C13 | C14 | H17 | 110.1° | 110.4° |
| C13 | C14 | H18 | 110.1° | 110.3° |
| C13 | C15 | N17 | 115.2° | 120.0° |
| C13 | C15 | O16 | 120.2° | 120.0° |
| C15 | C13 | H16 | 109.3° | 110.9° |
| C15 | N17 | C18 | 127.5° | 120.0° |
| N17 | C15 | O16 | 124.7° | 120.0° |
| C15 | N17 | H19 | 116.2° | 120.0° |
| N17 | C18 | C23 | 115.1° | 120.0° |
| N17 | C18 | C19 | 125.4° | 120.1° |
| C18 | N17 | H19 | 116.2° | 120.1° |
| C18 | C23 | C22 | 120.6° | 119.9° |
| C23 | C18 | C19 | 119.5° | 119.8° |
| C18 | C23 | H7 | 119.7° | 120.0° |
| C23 | C22 | C21 | 119.8° | 120.1° |
| C22 | C23 | H7 | 119.7° | 120.1° |
| C23 | C22 | H21 | 120.1° | 119.9° |
| C18 | C19 | C20 | 119.8° | 120.0° |
| C18 | C19 | H5 | 120.1° | 120.0° |
| C22 | C21 | C20 | 120.7° | 120.1° |
| C22 | C21 | H6 | 119.6° | 120.0° |
| C21 | C22 | H21 | 120.1° | 120.0° |
| C19 | C20 | C21 | 119.6° | 120.1° |
| C20 | C19 | H5 | 120.1° | 120.0° |
| C19 | C20 | H20 | 120.2° | 120.0° |
| C20 | C21 | H6 | 119.7° | 119.9° |
| C21 | C20 | H20 | 120.2° | 119.9° |
| H3 | C12 | H4 | 109.5° | 110.3° |
| H8 | C24 | H9 | 109.5° | 109.5° |
| H17 | C14 | H18 | 109.5° | 110.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F39 | C37 | C34 | C33 | 65.1° | 150.1° |
| F39 | C37 | F40 | C34 | 119.9° | 120.0° |
| F39 | C37 | F40 | F38 | 118.6° | 120.0° |
| F39 | C37 | C34 | F38 | 119.9° | 119.9° |
| F39 | C37 | C34 | C35 | 114.6° | 30.0° |
| C32 | C33 | C34 | H12 | 180.0° | 179.9° |
| C33 | C32 | C31 | H11 | 180.0° | 179.9° |
| C32 | C33 | C34 | C37 | 179.6° | 180.0° |
| C32 | C33 | C34 | C35 | 0.1° | 0.1° |
| C33 | C32 | C31 | N30 | 178.1° | 179.9° |
| C33 | C32 | C31 | C36 | 1.9° | 0.2° |
| C34 | C33 | C32 | C31 | 0.7° | 0.1° |
| C33 | C34 | C37 | F40 | 55.1° | 30.1° |
| C33 | C34 | C37 | C35 | 179.7° | 180.0° |
| C33 | C34 | C37 | F38 | 174.9° | 90.0° |
| C33 | C34 | C35 | C36 | 0.4° | 0.2° |
| C34 | C33 | C32 | H11 | 179.3° | 180.0° |
| C33 | C34 | C35 | H13 | 179.6° | 180.0° |
| C32 | C31 | N30 | C36 | 176.2° | 179.7° |
| C32 | C31 | N30 | C28 | 127.0° | 144.6° |
| C32 | C31 | C36 | C35 | 2.4° | 0.5° |
| C31 | C32 | C33 | H12 | 179.3° | 180.0° |
| C32 | C31 | C36 | H14 | 177.6° | 179.7° |
| C32 | C31 | N30 | H22 | 53.0° | 35.4° |
| F40 | C37 | C34 | F38 | 119.9° | 120.1° |
| F40 | C37 | C34 | C35 | 125.2° | 150.0° |
| O27 | C25 | O26 | C24 | 179.7° | 179.9° |
| O27 | C25 | C24 | C2 | 5.9° | 0.1° |
| O27 | C25 | C24 | H8 | 126.0° | 120.0° |
| O27 | C25 | C24 | H9 | 114.2° | 120.0° |
| O27 | C25 | O26 | H10 | 0.0° | 0.1° |
| C37 | C34 | C35 | C36 | 179.9° | 179.8° |
| C37 | C34 | C33 | H12 | 0.4° | 0.0° |
| C37 | C34 | C35 | H13 | 0.1° | 0.0° |
| F38 | C37 | C34 | C35 | 5.4° | 90.0° |
| C34 | C35 | C36 | C31 | 1.6° | 0.5° |
| C34 | C35 | C36 | H13 | 180.0° | 179.8° |
| C35 | C34 | C33 | H12 | 179.9° | 180.0° |
| C34 | C35 | C36 | H14 | 178.4° | 179.7° |
| C31 | N30 | C28 | H22 | 180.0° | 180.0° |
| C31 | N30 | C28 | O29 | 0.0° | 4.6° |
| C31 | N30 | C28 | C1 | 176.9° | 175.4° |
| N30 | C31 | C36 | C35 | 178.7° | 179.8° |
| N30 | C31 | C32 | H11 | 1.9° | 0.0° |
| N30 | C31 | C36 | H14 | 1.3° | 0.0° |
| C36 | C31 | N30 | C28 | 56.8° | 35.1° |
| C31 | C36 | C35 | H14 | 180.0° | 179.8° |
| C36 | C31 | C32 | H11 | 178.1° | 179.7° |
| C31 | C36 | C35 | H13 | 178.4° | 179.7° |
| C36 | C31 | N30 | H22 | 123.2° | 144.9° |
| O26 | C25 | C24 | C2 | 173.8° | 180.0° |
| O26 | C25 | C24 | H8 | 53.7° | 60.0° |
| O26 | C25 | C24 | H9 | 66.2° | 60.1° |
| C25 | C24 | C2 | C1 | 113.2° | 90.0° |
| C25 | C24 | C2 | H8 | 120.1° | 120.1° |
| C25 | C24 | C2 | H9 | 120.0° | 120.0° |
| C25 | C24 | C2 | N3 | 65.2° | 90.0° |
| C25 | C24 | H8 | H9 | 119.7° | 120.0° |
| C24 | C25 | O26 | H10 | 179.7° | 180.0° |
| N30 | C28 | O29 | C1 | 176.8° | 179.9° |
| N30 | C28 | C1 | S5 | 9.8° | 0.1° |
| N30 | C28 | C1 | C2 | 173.9° | 179.7° |
| O29 | C28 | C1 | S5 | 167.2° | 180.0° |
| O29 | C28 | C1 | C2 | 9.1° | 0.4° |
| O29 | C28 | N30 | H22 | 180.0° | 175.4° |
| C28 | C1 | S5 | C2 | 177.1° | 179.7° |
| C28 | C1 | S5 | C4 | 177.8° | 179.7° |
| C28 | C1 | C2 | C24 | 4.0° | 0.3° |
| C28 | C1 | C2 | N3 | 177.5° | 179.7° |
| C1 | C28 | N30 | H22 | 3.1° | 4.6° |
| S5 | C1 | C2 | C24 | 179.3° | 180.0° |
| S5 | C1 | C2 | N3 | 0.8° | 0.1° |
| C1 | S5 | C4 | N3 | 0.5° | 0.0° |
| C1 | S5 | C4 | C6 | 179.9° | 180.0° |
| C2 | C1 | S5 | C4 | 0.7° | 0.0° |
| C1 | C2 | C24 | N3 | 178.5° | 179.9° |
| C1 | C2 | N3 | C4 | 0.4° | 0.0° |
| C1 | C2 | C24 | H8 | 126.7° | 149.9° |
| C1 | C2 | C24 | H9 | 6.8° | 30.0° |
| S5 | C4 | N3 | C2 | 0.2° | 0.0° |
| S5 | C4 | N3 | C6 | 179.4° | 180.0° |
| S5 | C4 | C6 | C7 | 166.3° | 180.0° |
| S5 | C4 | C6 | C11 | 15.1° | 0.3° |
| C24 | C2 | N3 | C4 | 179.1° | 180.0° |
| C2 | C24 | H8 | H9 | 119.8° | 119.9° |
| C2 | N3 | C4 | C6 | 179.6° | 180.0° |
| N3 | C2 | C24 | H8 | 54.8° | 30.0° |
| N3 | C2 | C24 | H9 | 174.7° | 150.0° |
| N3 | C4 | C6 | C7 | 14.4° | 0.0° |
| N3 | C4 | C6 | C11 | 164.2° | 179.7° |
| C4 | C6 | C7 | C11 | 178.6° | 179.7° |
| C4 | C6 | C7 | C8 | 179.9° | 180.0° |
| C4 | C6 | C11 | C12 | 1.6° | 0.1° |
| C4 | C6 | C11 | C10 | 179.9° | 180.0° |
| C4 | C6 | C7 | H1 | 0.1° | 0.1° |
| C6 | C7 | C8 | H1 | 180.0° | 180.0° |
| C7 | C6 | C11 | C12 | 179.8° | 179.8° |
| C7 | C6 | C11 | C10 | 1.4° | 0.3° |
| C6 | C7 | C8 | C9 | 1.0° | 0.0° |
| C6 | C7 | C8 | H2 | 179.0° | 179.9° |
| C11 | C6 | C7 | C8 | 1.4° | 0.3° |
| C6 | C11 | C12 | C10 | 178.5° | 179.9° |
| C6 | C11 | C12 | C13 | 174.9° | 162.8° |
| C6 | C11 | C10 | C9 | 1.0° | 0.1° |
| C6 | C11 | C10 | C14 | 179.4° | 180.0° |
| C11 | C6 | C7 | H1 | 178.5° | 179.8° |
| C6 | C11 | C12 | H3 | 65.4° | 78.3° |
| C6 | C11 | C12 | H4 | 55.3° | 43.8° |
| C7 | C8 | C9 | H2 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 0.6° | 0.2° |
| C7 | C8 | C9 | H15 | 179.4° | 180.0° |
| C11 | C12 | C13 | H3 | 119.6° | 118.9° |
| C11 | C12 | C13 | H4 | 119.7° | 118.9° |
| C12 | C11 | C10 | C9 | 179.7° | 180.0° |
| C12 | C11 | C10 | C14 | 0.8° | 0.0° |
| C11 | C12 | C13 | C14 | 6.1° | 26.3° |
| C11 | C12 | C13 | C15 | 128.5° | 144.5° |
| C11 | C12 | H3 | H4 | 121.1° | 122.1° |
| C11 | C12 | C13 | H16 | 110.2° | 91.9° |
| C11 | C10 | C9 | C8 | 0.6° | 0.2° |
| C10 | C11 | C12 | C13 | 3.5° | 17.1° |
| C11 | C10 | C9 | C14 | 179.5° | 179.9° |
| C11 | C10 | C14 | C13 | 4.7° | 17.2° |
| C10 | C11 | C12 | H3 | 116.1° | 101.8° |
| C10 | C11 | C12 | H4 | 123.2° | 136.1° |
| C11 | C10 | C9 | H15 | 179.4° | 180.0° |
| C11 | C10 | C14 | H17 | 124.3° | 136.2° |
| C11 | C10 | C14 | H18 | 114.9° | 101.7° |
| C8 | C9 | C10 | H15 | 180.0° | 179.8° |
| C8 | C9 | C10 | C14 | 179.9° | 179.7° |
| C9 | C8 | C7 | H1 | 179.0° | 180.0° |
| C12 | C13 | C14 | C10 | 6.5° | 26.3° |
| C12 | C13 | C14 | C15 | 122.3° | 118.2° |
| C12 | C13 | C14 | H16 | 116.4° | 118.2° |
| C12 | C13 | C15 | H16 | 121.1° | 123.5° |
| C12 | C13 | C15 | N17 | 137.3° | 180.0° |
| C12 | C13 | C15 | O16 | 43.0° | 0.0° |
| C13 | C12 | H3 | H4 | 121.1° | 122.2° |
| C12 | C13 | C14 | H17 | 126.1° | 145.2° |
| C12 | C13 | C14 | H18 | 113.0° | 92.6° |
| C9 | C10 | C14 | C13 | 175.7° | 162.9° |
| C10 | C9 | C8 | H2 | 179.4° | 179.8° |
| C9 | C10 | C14 | H17 | 56.1° | 43.9° |
| C9 | C10 | C14 | H18 | 64.7° | 78.2° |
| C10 | C14 | C13 | H17 | 119.6° | 118.9° |
| C10 | C14 | C13 | H18 | 119.6° | 118.9° |
| C10 | C14 | C13 | C15 | 128.9° | 144.5° |
| C14 | C10 | C9 | H15 | 0.1° | 0.0° |
| C10 | C14 | C13 | H16 | 109.9° | 91.9° |
| C10 | C14 | H17 | H18 | 121.2° | 122.1° |
| C14 | C13 | C15 | H16 | 121.0° | 123.5° |
| C14 | C13 | C15 | N17 | 104.8° | 67.0° |
| C14 | C13 | C15 | O16 | 74.8° | 112.9° |
| C14 | C13 | C12 | H3 | 113.5° | 92.6° |
| C14 | C13 | C12 | H4 | 125.8° | 145.2° |
| C13 | C14 | H17 | H18 | 121.2° | 122.1° |
| C13 | C15 | N17 | O16 | 179.6° | 180.0° |
| C13 | C15 | N17 | C18 | 180.0° | 175.4° |
| C15 | C13 | C12 | H3 | 8.9° | 25.6° |
| C15 | C13 | C12 | H4 | 111.8° | 96.6° |
| C15 | C13 | C14 | H17 | 111.6° | 96.5° |
| C15 | C13 | C14 | H18 | 9.3° | 25.6° |
| C13 | C15 | N17 | H19 | 0.1° | 4.7° |
| C15 | N17 | C18 | H19 | 180.0° | 179.9° |
| C15 | N17 | C18 | C23 | 158.2° | 145.2° |
| C15 | N17 | C18 | C19 | 23.8° | 35.0° |
| N17 | C15 | C13 | H16 | 16.2° | 56.5° |
| C18 | N17 | C15 | O16 | 0.5° | 4.6° |
| N17 | C18 | C23 | C19 | 178.1° | 179.7° |
| N17 | C18 | C23 | C22 | 179.4° | 179.7° |
| N17 | C18 | C19 | C20 | 178.9° | 179.7° |
| N17 | C18 | C19 | H5 | 1.1° | 0.3° |
| N17 | C18 | C23 | H7 | 0.6° | 0.3° |
| O16 | C15 | C13 | H16 | 164.2° | 123.6° |
| O16 | C15 | N17 | H19 | 179.5° | 175.4° |
| C18 | C23 | C22 | H7 | 180.0° | 180.0° |
| C18 | C23 | C22 | C21 | 0.8° | 0.0° |
| C23 | C18 | C19 | C20 | 1.0° | 0.0° |
| C23 | C18 | C19 | H5 | 179.0° | 180.0° |
| C23 | C18 | N17 | H19 | 21.7° | 34.8° |
| C18 | C23 | C22 | H21 | 179.2° | 180.0° |
| C22 | C23 | C18 | C19 | 1.3° | 0.0° |
| C23 | C22 | C21 | H21 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 0.1° | 0.0° |
| C23 | C22 | C21 | H6 | 179.9° | 179.9° |
| C18 | C19 | C20 | H5 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.3° | 0.1° |
| C19 | C18 | C23 | H7 | 178.7° | 180.0° |
| C19 | C18 | N17 | H19 | 156.2° | 144.9° |
| C18 | C19 | C20 | H20 | 179.7° | 180.0° |
| C22 | C21 | C20 | C19 | 0.2° | 0.1° |
| C22 | C21 | C20 | H6 | 180.0° | 180.0° |
| C21 | C22 | C23 | H7 | 179.2° | 180.0° |
| C22 | C21 | C20 | H20 | 179.8° | 180.0° |
| C19 | C20 | C21 | H20 | 180.0° | 179.9° |
| C19 | C20 | C21 | H6 | 179.8° | 179.9° |
| C21 | C20 | C19 | H5 | 179.7° | 180.0° |
| C20 | C21 | C22 | H21 | 179.9° | 180.0° |
| H1 | C7 | C8 | H2 | 1.0° | 0.0° |
| H2 | C8 | C9 | H15 | 0.6° | 0.1° |
| H3 | C12 | C13 | H16 | 130.2° | 149.2° |
| H4 | C12 | C13 | H16 | 9.5° | 27.0° |
| H5 | C19 | C20 | H20 | 0.3° | 0.0° |
| H6 | C21 | C20 | H20 | 0.2° | 0.0° |
| H6 | C21 | C22 | H21 | 0.1° | 0.0° |
| H7 | C23 | C22 | H21 | 0.9° | 0.0° |
| H11 | C32 | C33 | H12 | 0.7° | 0.1° |
| H13 | C35 | C36 | H14 | 1.6° | 0.0° |
| H16 | C13 | C14 | H17 | 9.7° | 27.0° |
| H16 | C13 | C14 | H18 | 130.5° | 149.2° |
