A1BIS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C38 | N35 | sing | 1.47Å | 1.46Å | |
| C10 | C4 | sing | 1.51Å | 1.50Å | |
| N35 | S34 | sing | 1.66Å | 1.62Å | |
| CL32 | C31 | sing | 1.74Å | 1.72Å | |
| O9 | C3 | doub | 1.22Å | 1.22Å | |
| C4 | C3 | sing | 1.40Å | 1.40Å | |
| C4 | C5 | doub | 1.38Å | 1.34Å | |
| C3 | N2 | sing | 1.34Å | 1.40Å | |
| N33 | S34 | sing | 1.66Å | 1.63Å | |
| N33 | C30 | sing | 1.40Å | 1.42Å | |
| C31 | C30 | doub | 1.39Å | 1.40Å | Aromatic |
| C31 | C26 | sing | 1.39Å | 1.40Å | Aromatic |
| S34 | O36 | doub | 1.42Å | 1.43Å | |
| S34 | O37 | doub | 1.42Å | 1.43Å | |
| C30 | C29 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | O11 | sing | 1.35Å | 1.34Å | |
| C5 | C6 | sing | 1.42Å | 1.41Å | |
| C7 | N2 | sing | 1.47Å | 1.47Å | |
| N2 | C1 | sing | 1.36Å | 1.37Å | |
| C26 | O11 | sing | 1.36Å | 1.39Å | |
| C26 | C27 | doub | 1.39Å | 1.38Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C6 | C1 | doub | 1.40Å | 1.40Å | |
| C6 | C8 | sing | 1.47Å | 1.47Å | |
| C1 | N17 | sing | 1.37Å | 1.35Å | |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | N13 | sing | 1.35Å | 1.34Å | |
| C8 | O12 | doub | 1.22Å | 1.23Å | |
| C16 | C15 | sing | 1.53Å | 1.48Å | |
| C16 | C14 | sing | 1.53Å | 1.48Å | |
| N13 | C14 | sing | 1.47Å | 1.46Å | |
| C15 | C14 | sing | 1.53Å | 1.48Å | |
| N17 | C18 | sing | 1.40Å | 1.40Å | |
| C18 | C23 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.38Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| F24 | C19 | sing | 1.35Å | 1.35Å | |
| C19 | C20 | doub | 1.38Å | 1.37Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | I25 | sing | 2.10Å | 2.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.08Å | 1.08Å | |
| C22 | H13 | sing | 1.08Å | 1.08Å | |
| C28 | H14 | sing | 1.08Å | 1.08Å | |
| N13 | H16 | sing | 0.97Å | 1.00Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| N17 | H20 | sing | 0.97Å | 1.00Å | |
| C23 | H21 | sing | 1.08Å | 1.08Å | |
| C27 | H22 | sing | 1.08Å | 1.08Å | |
| C29 | H23 | sing | 1.08Å | 1.08Å | |
| N33 | H24 | sing | 0.97Å | 1.00Å | |
| N35 | H25 | sing | 0.97Å | 1.00Å | |
| C38 | H26 | sing | 1.09Å | 1.10Å | |
| C38 | H27 | sing | 1.09Å | 1.10Å | |
| C38 | H28 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C38 | N35 | S34 | 121.6° | 120.0° |
| C38 | N35 | H25 | 106.3° | 120.0° |
| N35 | C38 | H26 | 109.5° | 109.4° |
| N35 | C38 | H27 | 109.4° | 109.4° |
| N35 | C38 | H28 | 109.4° | 109.5° |
| C10 | C4 | C3 | 116.3° | 120.1° |
| C10 | C4 | C5 | 123.7° | 120.2° |
| C4 | C10 | H7 | 109.5° | 109.5° |
| C4 | C10 | H8 | 109.5° | 109.5° |
| C4 | C10 | H9 | 109.5° | 109.5° |
| N35 | S34 | N33 | 107.2° | 107.2° |
| N35 | S34 | O36 | 107.8° | 106.5° |
| N35 | S34 | O37 | 107.5° | 106.4° |
| S34 | N35 | H25 | 106.4° | 120.1° |
| CL32 | C31 | C30 | 119.6° | 120.1° |
| CL32 | C31 | C26 | 120.1° | 120.1° |
| O9 | C3 | C4 | 122.3° | 119.5° |
| O9 | C3 | N2 | 120.6° | 119.6° |
| C3 | C4 | C5 | 120.0° | 119.7° |
| C4 | C3 | N2 | 117.1° | 120.9° |
| C4 | C5 | O11 | 121.5° | 120.6° |
| C4 | C5 | C6 | 122.7° | 118.9° |
| C3 | N2 | C7 | 116.6° | 119.4° |
| C3 | N2 | C1 | 121.7° | 121.2° |
| S34 | N33 | C30 | 127.6° | 120.0° |
| N33 | S34 | O36 | 103.5° | 106.4° |
| N33 | S34 | O37 | 110.6° | 106.4° |
| S34 | N33 | H24 | 104.8° | 120.0° |
| N33 | C30 | C31 | 119.4° | 120.0° |
| N33 | C30 | C29 | 121.0° | 120.1° |
| C30 | N33 | H24 | 104.8° | 120.0° |
| C30 | C31 | C26 | 120.1° | 119.9° |
| C31 | C30 | C29 | 118.9° | 119.9° |
| C31 | C26 | O11 | 120.6° | 120.0° |
| C31 | C26 | C27 | 120.4° | 120.0° |
| O36 | S34 | O37 | 119.7° | 123.1° |
| C30 | C29 | C28 | 120.5° | 120.0° |
| C30 | C29 | H23 | 119.7° | 120.0° |
| O11 | C5 | C6 | 111.4° | 120.6° |
| C5 | O11 | C26 | 119.4° | 118.0° |
| C5 | C6 | C1 | 116.5° | 119.2° |
| C5 | C6 | C8 | 123.3° | 120.4° |
| C7 | N2 | C1 | 120.7° | 119.4° |
| N2 | C7 | H4 | 109.5° | 109.5° |
| N2 | C7 | H5 | 109.5° | 109.4° |
| N2 | C7 | H6 | 109.4° | 109.4° |
| N2 | C1 | C6 | 119.2° | 120.2° |
| N2 | C1 | N17 | 118.1° | 119.9° |
| O11 | C26 | C27 | 118.1° | 120.0° |
| C26 | C27 | C28 | 119.5° | 120.1° |
| C26 | C27 | H22 | 120.3° | 120.0° |
| C29 | C28 | C27 | 120.6° | 120.1° |
| C29 | C28 | H14 | 119.7° | 120.0° |
| C28 | C29 | H23 | 119.7° | 119.9° |
| C1 | C6 | C8 | 120.0° | 120.4° |
| C6 | C1 | N17 | 122.4° | 119.9° |
| C6 | C8 | N13 | 116.0° | 120.0° |
| C6 | C8 | O12 | 120.9° | 120.0° |
| C1 | N17 | C18 | 134.4° | 120.0° |
| C1 | N17 | H20 | 112.8° | 119.9° |
| C27 | C28 | H14 | 119.7° | 119.9° |
| C28 | C27 | H22 | 120.2° | 119.9° |
| N13 | C8 | O12 | 123.1° | 120.1° |
| C8 | N13 | C14 | 122.5° | 120.0° |
| C8 | N13 | H16 | 118.8° | 120.1° |
| C15 | C16 | C14 | 59.9° | 60.0° |
| C16 | C15 | C14 | 60.1° | 60.0° |
| C16 | C15 | H10 | 120.0° | 117.5° |
| C16 | C15 | H11 | 120.0° | 117.5° |
| C15 | C16 | H18 | 120.0° | 117.5° |
| C15 | C16 | H19 | 120.0° | 117.5° |
| C16 | C14 | N13 | 118.7° | 117.5° |
| C16 | C14 | C15 | 60.0° | 60.0° |
| C16 | C14 | H17 | 115.8° | 117.5° |
| C14 | C16 | H18 | 120.0° | 117.5° |
| C14 | C16 | H19 | 120.0° | 117.5° |
| N13 | C14 | C15 | 118.5° | 117.5° |
| C14 | N13 | H16 | 118.8° | 120.0° |
| N13 | C14 | H17 | 116.2° | 115.5° |
| C14 | C15 | H10 | 120.0° | 117.6° |
| C14 | C15 | H11 | 120.0° | 117.5° |
| C15 | C14 | H17 | 115.8° | 117.5° |
| N17 | C18 | C23 | 120.1° | 120.1° |
| N17 | C18 | C19 | 120.7° | 120.0° |
| C18 | N17 | H20 | 112.8° | 120.1° |
| C23 | C18 | C19 | 117.1° | 119.8° |
| C18 | C23 | C22 | 121.1° | 120.0° |
| C18 | C23 | H21 | 119.5° | 120.0° |
| C18 | C19 | F24 | 117.5° | 120.1° |
| C18 | C19 | C20 | 123.2° | 119.9° |
| C23 | C22 | C21 | 119.5° | 120.1° |
| C23 | C22 | H13 | 120.2° | 119.9° |
| C22 | C23 | H21 | 119.5° | 120.0° |
| F24 | C19 | C20 | 119.2° | 120.0° |
| C19 | C20 | C21 | 118.2° | 120.1° |
| C19 | C20 | H12 | 120.8° | 120.0° |
| C22 | C21 | C20 | 120.9° | 120.1° |
| C22 | C21 | I25 | 119.5° | 119.9° |
| C21 | C22 | H13 | 120.3° | 119.9° |
| C20 | C21 | I25 | 119.5° | 119.9° |
| C21 | C20 | H12 | 120.9° | 120.0° |
| H4 | C7 | H5 | 109.5° | 109.5° |
| H4 | C7 | H6 | 109.5° | 109.5° |
| H5 | C7 | H6 | 109.4° | 109.5° |
| H7 | C10 | H8 | 109.5° | 109.5° |
| H7 | C10 | H9 | 109.5° | 109.4° |
| H8 | C10 | H9 | 109.5° | 109.5° |
| H10 | C15 | H11 | 109.5° | 115.5° |
| H18 | C16 | H19 | 109.5° | 115.6° |
| H26 | C38 | H27 | 109.5° | 109.5° |
| H26 | C38 | H28 | 109.5° | 109.5° |
| H27 | C38 | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C38 | N35 | S34 | H25 | 121.7° | 180.0° |
| C38 | N35 | S34 | N33 | 107.5° | 65.0° |
| C38 | N35 | S34 | O36 | 141.7° | 48.6° |
| C38 | N35 | S34 | O37 | 11.5° | 178.5° |
| N35 | C38 | H26 | H27 | 120.0° | 119.9° |
| N35 | C38 | H26 | H28 | 120.0° | 120.0° |
| N35 | C38 | H27 | H28 | 119.9° | 120.0° |
| C10 | C4 | C3 | O9 | 7.4° | 0.2° |
| C10 | C4 | C3 | C5 | 178.8° | 179.8° |
| C10 | C4 | C3 | N2 | 171.1° | 179.7° |
| C10 | C4 | C5 | O11 | 36.6° | 0.2° |
| C10 | C4 | C5 | C6 | 169.2° | 179.8° |
| C4 | C10 | H7 | H8 | 120.0° | 120.1° |
| C4 | C10 | H7 | H9 | 120.0° | 120.0° |
| C4 | C10 | H8 | H9 | 120.0° | 120.0° |
| N35 | S34 | N33 | O36 | 113.7° | 113.6° |
| N35 | S34 | N33 | O37 | 116.9° | 113.5° |
| N35 | S34 | N33 | C30 | 130.8° | 66.4° |
| N35 | S34 | O36 | O37 | 123.1° | 123.0° |
| N35 | S34 | N33 | H24 | 106.8° | 113.6° |
| S34 | N35 | C38 | H26 | 180.0° | 60.0° |
| S34 | N35 | C38 | H27 | 60.0° | 60.0° |
| S34 | N35 | C38 | H28 | 60.0° | 180.0° |
| CL32 | C31 | C30 | N33 | 16.1° | 0.2° |
| CL32 | C31 | C30 | C26 | 175.1° | 180.0° |
| CL32 | C31 | C30 | C29 | 173.6° | 180.0° |
| CL32 | C31 | C26 | O11 | 18.0° | 0.1° |
| CL32 | C31 | C26 | C27 | 173.3° | 179.7° |
| O9 | C3 | C4 | N2 | 178.5° | 179.9° |
| O9 | C3 | C4 | C5 | 173.8° | 180.0° |
| O9 | C3 | N2 | C7 | 21.9° | 0.1° |
| O9 | C3 | N2 | C1 | 170.0° | 180.0° |
| C3 | C4 | C5 | O11 | 144.7° | 180.0° |
| C3 | C4 | C5 | C6 | 9.5° | 0.0° |
| C4 | C3 | N2 | C7 | 156.7° | 180.0° |
| C4 | C3 | N2 | C1 | 11.5° | 0.1° |
| C3 | C4 | C10 | H7 | 180.0° | 5.0° |
| C3 | C4 | C10 | H8 | 60.0° | 115.0° |
| C3 | C4 | C10 | H9 | 60.0° | 125.0° |
| C5 | C4 | C3 | N2 | 7.7° | 0.1° |
| C4 | C5 | O11 | C6 | 156.9° | 180.0° |
| C4 | C5 | O11 | C26 | 20.9° | 88.9° |
| C4 | C5 | C6 | C1 | 14.1° | 0.0° |
| C4 | C5 | C6 | C8 | 171.3° | 180.0° |
| C5 | C4 | C10 | H7 | 1.3° | 174.7° |
| C5 | C4 | C10 | H8 | 121.2° | 65.2° |
| C5 | C4 | C10 | H9 | 118.8° | 54.8° |
| C3 | N2 | C7 | C1 | 168.3° | 179.9° |
| C3 | N2 | C1 | C6 | 16.7° | 0.1° |
| C3 | N2 | C1 | N17 | 168.6° | 179.9° |
| C3 | N2 | C7 | H4 | 180.0° | 94.9° |
| C3 | N2 | C7 | H5 | 60.0° | 25.2° |
| C3 | N2 | C7 | H6 | 60.0° | 145.1° |
| S34 | N33 | C30 | H24 | 122.4° | 180.0° |
| S34 | N33 | C30 | C31 | 164.2° | 147.5° |
| N33 | S34 | O36 | O37 | 123.6° | 122.9° |
| S34 | N33 | C30 | C29 | 6.0° | 32.2° |
| N33 | S34 | N35 | H25 | 130.8° | 114.9° |
| N33 | C30 | C31 | C29 | 170.4° | 179.8° |
| N33 | C30 | C31 | C26 | 168.8° | 179.8° |
| C30 | N33 | S34 | O36 | 115.4° | 180.0° |
| C30 | N33 | S34 | O37 | 13.9° | 47.1° |
| N33 | C30 | C29 | C28 | 169.3° | 180.0° |
| N33 | C30 | C29 | H23 | 10.6° | 0.2° |
| C30 | C31 | C26 | O11 | 166.9° | 179.9° |
| C30 | C31 | C26 | C27 | 1.8° | 0.3° |
| C31 | C30 | C29 | C28 | 0.9° | 0.2° |
| C31 | C30 | C29 | H23 | 179.1° | 179.9° |
| C31 | C30 | N33 | H24 | 41.8° | 32.5° |
| C26 | C31 | C30 | C29 | 1.5° | 0.0° |
| C31 | C26 | O11 | C5 | 126.9° | 176.3° |
| C31 | C26 | O11 | C27 | 169.0° | 179.8° |
| C31 | C26 | C27 | C28 | 1.4° | 0.3° |
| C31 | C26 | C27 | H22 | 178.6° | 179.8° |
| O36 | S34 | N33 | H24 | 6.9° | 0.0° |
| O36 | S34 | N35 | H25 | 20.0° | 131.5° |
| O37 | S34 | N33 | H24 | 136.3° | 132.9° |
| O37 | S34 | N35 | H25 | 110.2° | 1.4° |
| C30 | C29 | C28 | H23 | 180.0° | 179.8° |
| C30 | C29 | C28 | C27 | 0.5° | 0.2° |
| C30 | C29 | C28 | H14 | 179.5° | 179.7° |
| C29 | C30 | N33 | H24 | 128.3° | 147.8° |
| C5 | O11 | C26 | C27 | 64.1° | 4.0° |
| O11 | C5 | C6 | C1 | 142.4° | 180.0° |
| O11 | C5 | C6 | C8 | 32.1° | 0.0° |
| C5 | C6 | C1 | N2 | 17.2° | 0.0° |
| C6 | C5 | O11 | C26 | 136.0° | 91.1° |
| C5 | C6 | C1 | C8 | 174.8° | 180.0° |
| C5 | C6 | C1 | N17 | 168.3° | 180.0° |
| C5 | C6 | C8 | N13 | 22.1° | 7.6° |
| C5 | C6 | C8 | O12 | 159.4° | 172.4° |
| C7 | N2 | C1 | C6 | 151.0° | 179.9° |
| C7 | N2 | C1 | N17 | 23.7° | 0.0° |
| N2 | C7 | H4 | H5 | 120.0° | 120.0° |
| N2 | C7 | H4 | H6 | 120.0° | 119.9° |
| N2 | C7 | H5 | H6 | 120.0° | 119.9° |
| N2 | C1 | C6 | N17 | 174.5° | 180.0° |
| N2 | C1 | C6 | C8 | 168.0° | 180.0° |
| N2 | C1 | N17 | C18 | 22.1° | 95.3° |
| C1 | N2 | C7 | H4 | 11.7° | 85.0° |
| C1 | N2 | C7 | H5 | 108.3° | 154.9° |
| C1 | N2 | C7 | H6 | 131.7° | 35.0° |
| N2 | C1 | N17 | H20 | 157.9° | 84.7° |
| O11 | C26 | C27 | C28 | 167.6° | 179.9° |
| O11 | C26 | C27 | H22 | 12.4° | 0.0° |
| C26 | C27 | C28 | C29 | 0.7° | 0.1° |
| C26 | C27 | C28 | H22 | 180.0° | 179.9° |
| C26 | C27 | C28 | H14 | 179.3° | 180.0° |
| C29 | C28 | C27 | H14 | 180.0° | 179.9° |
| C29 | C28 | C27 | H22 | 179.3° | 180.0° |
| C1 | C6 | C8 | N13 | 152.3° | 172.4° |
| C1 | C6 | C8 | O12 | 26.2° | 7.6° |
| C6 | C1 | N17 | C18 | 163.4° | 84.6° |
| C6 | C1 | N17 | H20 | 16.6° | 95.3° |
| C8 | C6 | C1 | N17 | 6.4° | 0.0° |
| C6 | C8 | N13 | O12 | 178.4° | 180.0° |
| C6 | C8 | N13 | C14 | 179.4° | 175.4° |
| C6 | C8 | N13 | H16 | 0.6° | 4.6° |
| C1 | N17 | C18 | H20 | 180.0° | 180.0° |
| C1 | N17 | C18 | C23 | 28.9° | 5.1° |
| C1 | N17 | C18 | C19 | 167.9° | 175.7° |
| C27 | C28 | C29 | H23 | 179.6° | 180.0° |
| C8 | N13 | C14 | C16 | 75.6° | 136.4° |
| C8 | N13 | C14 | H16 | 180.0° | 180.0° |
| C8 | N13 | C14 | C15 | 145.1° | 155.0° |
| C8 | N13 | C14 | H17 | 69.9° | 9.3° |
| O12 | C8 | N13 | C14 | 1.0° | 4.6° |
| O12 | C8 | N13 | H16 | 179.0° | 175.4° |
| C15 | C16 | C14 | H18 | 109.4° | 107.5° |
| C15 | C16 | C14 | H19 | 109.5° | 107.5° |
| C16 | C15 | C14 | N13 | 108.6° | 107.5° |
| C16 | C15 | C14 | H10 | 109.5° | 107.5° |
| C16 | C15 | C14 | H11 | 109.5° | 107.5° |
| C16 | C15 | H10 | H11 | 144.7° | 145.6° |
| C15 | C16 | C14 | H17 | 106.3° | 107.5° |
| C15 | C16 | H18 | H19 | 144.8° | 145.7° |
| C16 | C14 | N13 | H17 | 145.5° | 145.7° |
| C16 | C14 | N13 | H16 | 104.4° | 43.6° |
| C14 | C16 | H18 | H19 | 144.8° | 145.7° |
| N13 | C14 | C15 | H17 | 145.2° | 145.0° |
| N13 | C14 | C15 | H10 | 0.9° | 145.1° |
| N13 | C14 | C15 | H11 | 141.9° | 0.0° |
| N13 | C14 | C16 | H18 | 142.5° | 145.0° |
| N13 | C14 | C16 | H19 | 1.3° | 0.0° |
| C14 | C15 | H10 | H11 | 144.7° | 145.7° |
| C15 | C14 | N13 | H16 | 34.9° | 25.0° |
| N17 | C18 | C23 | C19 | 163.8° | 179.2° |
| N17 | C18 | C23 | C22 | 163.8° | 180.0° |
| N17 | C18 | C19 | F24 | 19.5° | 0.8° |
| N17 | C18 | C19 | C20 | 163.7° | 179.7° |
| N17 | C18 | C23 | H21 | 16.2° | 0.8° |
| C18 | C23 | C22 | H21 | 180.0° | 179.2° |
| C23 | C18 | C19 | F24 | 176.7° | 180.0° |
| C23 | C18 | C19 | C20 | 0.0° | 0.5° |
| C18 | C23 | C22 | C21 | 0.2° | 0.5° |
| C18 | C23 | C22 | H13 | 179.8° | 179.5° |
| C23 | C18 | N17 | H20 | 151.1° | 174.9° |
| C19 | C18 | C23 | C22 | 0.0° | 0.8° |
| C18 | C19 | F24 | C20 | 176.9° | 179.5° |
| C18 | C19 | C20 | C21 | 0.1° | 0.1° |
| C18 | C19 | C20 | H12 | 179.9° | 179.7° |
| C19 | C18 | N17 | H20 | 12.1° | 4.3° |
| C19 | C18 | C23 | H21 | 180.0° | 180.0° |
| C23 | C22 | C21 | H13 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 0.3° | 0.0° |
| C23 | C22 | C21 | I25 | 175.8° | 180.0° |
| F24 | C19 | C20 | C21 | 176.5° | 179.5° |
| F24 | C19 | C20 | H12 | 3.4° | 0.2° |
| C19 | C20 | C21 | C22 | 0.3° | 0.3° |
| C19 | C20 | C21 | H12 | 180.0° | 179.7° |
| C19 | C20 | C21 | I25 | 175.8° | 179.7° |
| C22 | C21 | C20 | I25 | 176.0° | 180.0° |
| C22 | C21 | C20 | H12 | 179.7° | 180.0° |
| C21 | C22 | C23 | H21 | 179.8° | 179.7° |
| C20 | C21 | C22 | H13 | 179.7° | 180.0° |
| I25 | C21 | C20 | H12 | 4.2° | 0.0° |
| I25 | C21 | C22 | H13 | 4.2° | 0.0° |
| H4 | C7 | H5 | H6 | 120.0° | 120.0° |
| H7 | C10 | H8 | H9 | 120.0° | 119.9° |
| H10 | C15 | C14 | H17 | 144.3° | 0.0° |
| H10 | C15 | C16 | H18 | 141.0° | 0.1° |
| H10 | C15 | C16 | H19 | 0.1° | 144.9° |
| H11 | C15 | C14 | H17 | 3.2° | 145.0° |
| H11 | C15 | C16 | H18 | 0.0° | 145.0° |
| H11 | C15 | C16 | H19 | 141.1° | 0.0° |
| H13 | C22 | C23 | H21 | 0.2° | 0.3° |
| H14 | C28 | C27 | H22 | 0.7° | 0.1° |
| H14 | C28 | C29 | H23 | 0.4° | 0.1° |
| H16 | N13 | C14 | H17 | 110.1° | 170.7° |
| H17 | C14 | C16 | H18 | 3.2° | 0.0° |
| H17 | C14 | C16 | H19 | 144.3° | 145.0° |
| H25 | N35 | C38 | H26 | 58.3° | 120.0° |
| H25 | N35 | C38 | H27 | 61.7° | 120.0° |
| H25 | N35 | C38 | H28 | 178.3° | 0.0° |
| H26 | C38 | H27 | H28 | 120.1° | 120.1° |
