9RR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N37 | C31 | sing | 1.38Å | 1.34Å | |
| C31 | N32 | doub | 1.33Å | 1.34Å | Aromatic |
| C31 | N30 | sing | 1.32Å | 1.36Å | Aromatic |
| N32 | C33 | sing | 1.32Å | 1.38Å | Aromatic |
| N30 | C29 | doub | 1.33Å | 1.38Å | Aromatic |
| C35 | C34 | sing | 1.53Å | 1.47Å | |
| C33 | C34 | sing | 1.51Å | 1.51Å | |
| C33 | C28 | doub | 1.39Å | 1.50Å | Aromatic |
| C29 | C28 | sing | 1.41Å | 1.48Å | Aromatic |
| C29 | N36 | sing | 1.38Å | 1.33Å | |
| C28 | C25 | sing | 1.48Å | 1.49Å | |
| N7 | C2 | sing | 1.38Å | 1.37Å | |
| C2 | N3 | doub | 1.32Å | 1.35Å | Aromatic |
| C2 | N1 | sing | 1.33Å | 1.38Å | Aromatic |
| N3 | C4 | sing | 1.33Å | 1.36Å | Aromatic |
| C25 | C24 | doub | 1.39Å | 1.37Å | Aromatic |
| C25 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.53Å | 1.51Å | |
| N1 | C6 | doub | 1.32Å | 1.37Å | Aromatic |
| C4 | N8 | sing | 1.38Å | 1.36Å | |
| C4 | C5 | doub | 1.41Å | 1.49Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.37Å | Aromatic |
| C12 | C11 | sing | 1.39Å | 1.41Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.37Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.47Å | Aromatic |
| C6 | C9 | sing | 1.51Å | 1.51Å | |
| C5 | C11 | sing | 1.48Å | 1.50Å | |
| C13 | C14 | sing | 1.39Å | 1.43Å | Aromatic |
| C11 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C23 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C27 | C22 | sing | 1.39Å | 1.36Å | Aromatic |
| C14 | O17 | sing | 1.36Å | 1.40Å | |
| C14 | C15 | doub | 1.39Å | 1.41Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | O21 | sing | 1.36Å | 1.40Å | |
| O17 | C18 | sing | 1.43Å | 1.40Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| O21 | C20 | sing | 1.43Å | 1.46Å | |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| N37 | H1 | sing | 0.97Å | 1.00Å | |
| N37 | H2 | sing | 0.97Å | 1.00Å | |
| N36 | H3 | sing | 0.97Å | 1.00Å | |
| N36 | H4 | sing | 0.97Å | 1.00Å | |
| C34 | H5 | sing | 1.09Å | 1.10Å | |
| C34 | H6 | sing | 1.09Å | 1.10Å | |
| C35 | H7 | sing | 1.09Å | 1.10Å | |
| C35 | H8 | sing | 1.09Å | 1.10Å | |
| C35 | H9 | sing | 1.09Å | 1.10Å | |
| C24 | H10 | sing | 1.08Å | 1.08Å | |
| C23 | H11 | sing | 1.08Å | 1.08Å | |
| C26 | H12 | sing | 1.08Å | 1.08Å | |
| C27 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.08Å | 1.08Å | |
| C12 | H21 | sing | 1.08Å | 1.08Å | |
| C15 | H22 | sing | 1.08Å | 1.08Å | |
| C16 | H23 | sing | 1.08Å | 1.08Å | |
| C9 | H24 | sing | 1.09Å | 1.10Å | |
| C9 | H25 | sing | 1.09Å | 1.10Å | |
| C10 | H26 | sing | 1.09Å | 1.10Å | |
| C10 | H27 | sing | 1.09Å | 1.10Å | |
| C10 | H28 | sing | 1.09Å | 1.10Å | |
| N8 | H29 | sing | 0.97Å | 1.00Å | |
| N8 | H30 | sing | 0.97Å | 1.00Å | |
| N7 | H31 | sing | 0.97Å | 1.00Å | |
| N7 | H32 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N37 | C31 | N32 | 118.4° | 119.0° |
| N37 | C31 | N30 | 118.6° | 119.0° |
| C31 | N37 | H1 | 109.5° | 120.0° |
| C31 | N37 | H2 | 109.5° | 120.0° |
| N32 | C31 | N30 | 122.9° | 121.9° |
| C31 | N32 | C33 | 122.6° | 121.0° |
| C31 | N30 | C29 | 120.7° | 120.7° |
| N32 | C33 | C34 | 120.9° | 120.4° |
| N32 | C33 | C28 | 118.4° | 119.1° |
| N30 | C29 | C28 | 120.1° | 118.9° |
| N30 | C29 | N36 | 118.5° | 120.6° |
| C35 | C34 | C33 | 109.0° | 109.5° |
| C35 | C34 | H5 | 109.6° | 109.5° |
| C35 | C34 | H6 | 109.6° | 109.4° |
| C34 | C35 | H7 | 109.5° | 109.5° |
| C34 | C35 | H8 | 109.5° | 109.5° |
| C34 | C35 | H9 | 109.4° | 109.5° |
| C34 | C33 | C28 | 120.7° | 120.4° |
| C33 | C34 | H5 | 109.6° | 109.5° |
| C33 | C34 | H6 | 109.6° | 109.5° |
| C33 | C28 | C29 | 115.3° | 118.2° |
| C33 | C28 | C25 | 121.6° | 120.9° |
| C28 | C29 | N36 | 121.4° | 120.5° |
| C29 | C28 | C25 | 123.1° | 120.9° |
| C29 | N36 | H3 | 109.5° | 120.0° |
| C29 | N36 | H4 | 109.5° | 120.0° |
| C28 | C25 | C24 | 118.2° | 120.1° |
| C28 | C25 | C26 | 123.0° | 120.1° |
| N7 | C2 | N3 | 119.1° | 119.1° |
| N7 | C2 | N1 | 117.8° | 119.0° |
| C2 | N7 | H31 | 109.5° | 120.0° |
| C2 | N7 | H32 | 109.5° | 120.0° |
| N3 | C2 | N1 | 123.1° | 121.9° |
| C2 | N3 | C4 | 118.8° | 120.8° |
| C2 | N1 | C6 | 122.5° | 121.1° |
| N3 | C4 | N8 | 119.4° | 120.6° |
| N3 | C4 | C5 | 121.7° | 118.9° |
| C24 | C25 | C26 | 118.7° | 119.8° |
| C25 | C24 | C23 | 119.8° | 120.0° |
| C25 | C24 | H10 | 120.1° | 120.0° |
| C25 | C26 | C27 | 121.0° | 119.9° |
| C25 | C26 | H12 | 119.5° | 120.0° |
| C10 | C9 | C6 | 109.3° | 109.5° |
| C10 | C9 | H24 | 109.5° | 109.5° |
| C10 | C9 | H25 | 109.5° | 109.5° |
| C9 | C10 | H26 | 109.5° | 109.5° |
| C9 | C10 | H27 | 109.5° | 109.5° |
| C9 | C10 | H28 | 109.5° | 109.5° |
| N1 | C6 | C5 | 117.9° | 119.1° |
| N1 | C6 | C9 | 123.4° | 120.5° |
| N8 | C4 | C5 | 118.9° | 120.5° |
| C4 | N8 | H29 | 109.5° | 120.0° |
| C4 | N8 | H30 | 109.5° | 120.0° |
| C4 | C5 | C6 | 116.0° | 118.2° |
| C4 | C5 | C11 | 124.1° | 120.9° |
| C13 | C12 | C11 | 118.9° | 119.9° |
| C12 | C13 | C14 | 120.2° | 120.1° |
| C12 | C13 | H20 | 119.9° | 120.0° |
| C13 | C12 | H21 | 120.6° | 120.1° |
| C12 | C11 | C5 | 118.3° | 120.0° |
| C12 | C11 | C16 | 121.2° | 119.9° |
| C11 | C12 | H21 | 120.5° | 120.0° |
| C24 | C23 | C22 | 122.7° | 120.1° |
| C23 | C24 | H10 | 120.1° | 120.0° |
| C24 | C23 | H11 | 118.6° | 120.0° |
| C26 | C27 | C22 | 120.2° | 120.1° |
| C27 | C26 | H12 | 119.5° | 120.1° |
| C26 | C27 | H13 | 119.9° | 119.9° |
| C5 | C6 | C9 | 118.7° | 120.4° |
| C6 | C5 | C11 | 119.9° | 120.9° |
| C6 | C9 | H24 | 109.5° | 109.5° |
| C6 | C9 | H25 | 109.5° | 109.5° |
| C5 | C11 | C16 | 120.5° | 120.1° |
| C13 | C14 | O17 | 116.4° | 119.9° |
| C13 | C14 | C15 | 120.8° | 120.1° |
| C14 | C13 | H20 | 119.9° | 120.0° |
| C11 | C16 | C15 | 120.5° | 119.9° |
| C11 | C16 | H23 | 119.8° | 120.0° |
| C23 | C22 | C27 | 117.6° | 120.1° |
| C23 | C22 | O21 | 123.2° | 119.9° |
| C22 | C23 | H11 | 118.7° | 119.9° |
| C27 | C22 | O21 | 119.2° | 119.9° |
| C22 | C27 | H13 | 119.9° | 120.0° |
| O17 | C14 | C15 | 122.7° | 120.0° |
| C14 | O17 | C18 | 127.3° | 117.0° |
| C14 | C15 | C16 | 118.4° | 120.1° |
| C14 | C15 | H22 | 120.8° | 120.0° |
| C16 | C15 | H22 | 120.8° | 119.9° |
| C15 | C16 | H23 | 119.7° | 120.1° |
| C22 | O21 | C20 | 115.5° | 117.0° |
| O17 | C18 | C19 | 102.5° | 109.5° |
| O17 | C18 | H18 | 111.2° | 109.4° |
| O17 | C18 | H19 | 111.2° | 109.5° |
| C18 | C19 | C20 | 119.5° | 109.5° |
| C18 | C19 | H16 | 106.9° | 109.5° |
| C18 | C19 | H17 | 106.9° | 109.5° |
| C19 | C18 | H18 | 111.2° | 109.5° |
| C19 | C18 | H19 | 111.2° | 109.5° |
| O21 | C20 | C19 | 109.9° | 109.5° |
| O21 | C20 | H14 | 109.4° | 109.5° |
| O21 | C20 | H15 | 109.4° | 109.5° |
| C19 | C20 | H14 | 109.4° | 109.5° |
| C19 | C20 | H15 | 109.4° | 109.5° |
| C20 | C19 | H16 | 106.9° | 109.5° |
| C20 | C19 | H17 | 106.9° | 109.5° |
| H1 | N37 | H2 | 109.4° | 120.0° |
| H3 | N36 | H4 | 109.4° | 120.0° |
| H5 | C34 | H6 | 109.5° | 109.5° |
| H7 | C35 | H8 | 109.5° | 109.5° |
| H7 | C35 | H9 | 109.5° | 109.5° |
| H8 | C35 | H9 | 109.5° | 109.4° |
| H14 | C20 | H15 | 109.5° | 109.4° |
| H16 | C19 | H17 | 109.4° | 109.5° |
| H18 | C18 | H19 | 109.5° | 109.5° |
| H24 | C9 | H25 | 109.5° | 109.5° |
| H26 | C10 | H27 | 109.5° | 109.5° |
| H26 | C10 | H28 | 109.5° | 109.4° |
| H27 | C10 | H28 | 109.5° | 109.4° |
| H29 | N8 | H30 | 109.4° | 120.0° |
| H31 | N7 | H32 | 109.4° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N37 | C31 | N32 | N30 | 176.4° | 179.8° |
| N37 | C31 | N32 | C33 | 178.3° | 180.0° |
| N37 | C31 | N30 | C29 | 179.7° | 179.9° |
| C31 | N37 | H1 | H2 | 120.0° | 179.6° |
| N32 | C31 | N30 | C29 | 3.2° | 0.3° |
| C31 | N32 | C33 | C34 | 179.1° | 180.0° |
| C31 | N32 | C33 | C28 | 0.7° | 0.1° |
| N32 | C31 | N37 | H1 | 0.0° | 0.1° |
| N32 | C31 | N37 | H2 | 120.0° | 179.7° |
| N30 | C31 | N32 | C33 | 1.9° | 0.2° |
| C31 | N30 | C29 | C28 | 2.0° | 0.0° |
| C31 | N30 | C29 | N36 | 178.2° | 180.0° |
| N30 | C31 | N37 | H1 | 176.6° | 179.7° |
| N30 | C31 | N37 | H2 | 63.4° | 0.1° |
| N32 | C33 | C34 | C35 | 63.0° | 94.7° |
| N32 | C33 | C34 | C28 | 178.3° | 179.9° |
| N32 | C33 | C28 | C29 | 1.7° | 0.3° |
| N32 | C33 | C28 | C25 | 179.3° | 180.0° |
| N32 | C33 | C34 | H5 | 57.0° | 25.3° |
| N32 | C33 | C34 | H6 | 177.1° | 145.4° |
| N30 | C29 | C28 | C33 | 0.4° | 0.2° |
| N30 | C29 | C28 | N36 | 179.8° | 179.9° |
| N30 | C29 | C28 | C25 | 179.3° | 180.0° |
| N30 | C29 | N36 | H3 | 0.0° | 0.1° |
| N30 | C29 | N36 | H4 | 120.0° | 180.0° |
| C35 | C34 | C33 | H5 | 119.9° | 120.0° |
| C35 | C34 | C33 | H6 | 119.9° | 119.9° |
| C35 | C34 | C33 | C28 | 118.7° | 85.4° |
| C35 | C34 | H5 | H6 | 120.2° | 120.0° |
| C34 | C35 | H7 | H8 | 120.0° | 120.0° |
| C34 | C35 | H7 | H9 | 120.0° | 120.0° |
| C34 | C35 | H8 | H9 | 120.0° | 120.0° |
| C34 | C33 | C28 | C29 | 179.9° | 179.8° |
| C34 | C33 | C28 | C25 | 1.0° | 0.1° |
| C33 | C34 | H5 | H6 | 120.2° | 120.0° |
| C33 | C34 | C35 | H7 | 180.0° | 55.0° |
| C33 | C34 | C35 | H8 | 60.0° | 65.0° |
| C33 | C34 | C35 | H9 | 60.0° | 175.1° |
| C33 | C28 | C29 | C25 | 178.9° | 179.7° |
| C33 | C28 | C29 | N36 | 179.4° | 179.7° |
| C33 | C28 | C25 | C24 | 79.3° | 111.5° |
| C33 | C28 | C25 | C26 | 98.0° | 68.2° |
| C28 | C33 | C34 | H5 | 121.4° | 154.6° |
| C28 | C33 | C34 | H6 | 1.2° | 34.6° |
| C29 | C28 | C25 | C24 | 101.9° | 68.2° |
| C29 | C28 | C25 | C26 | 80.9° | 112.0° |
| C28 | C29 | N36 | H3 | 179.9° | 180.0° |
| C28 | C29 | N36 | H4 | 60.2° | 0.0° |
| N36 | C29 | C28 | C25 | 0.5° | 0.0° |
| C29 | N36 | H3 | H4 | 120.0° | 180.0° |
| C28 | C25 | C24 | C26 | 177.4° | 179.7° |
| C28 | C25 | C24 | C23 | 179.0° | 180.0° |
| C28 | C25 | C26 | C27 | 179.2° | 180.0° |
| C28 | C25 | C24 | H10 | 1.0° | 0.0° |
| C28 | C25 | C26 | H12 | 0.8° | 0.0° |
| N7 | C2 | N3 | N1 | 178.9° | 179.8° |
| N7 | C2 | N3 | C4 | 179.4° | 180.0° |
| N7 | C2 | N1 | C6 | 178.7° | 180.0° |
| C2 | N7 | H31 | H32 | 120.0° | 180.0° |
| N3 | C2 | N1 | C6 | 2.4° | 0.2° |
| C2 | N3 | C4 | N8 | 179.3° | 180.0° |
| C2 | N3 | C4 | C5 | 0.6° | 0.0° |
| N3 | C2 | N7 | H31 | 0.0° | 0.0° |
| N3 | C2 | N7 | H32 | 120.0° | 180.0° |
| N1 | C2 | N3 | C4 | 0.5° | 0.3° |
| C2 | N1 | C6 | C5 | 3.0° | 0.0° |
| C2 | N1 | C6 | C9 | 178.1° | 180.0° |
| N1 | C2 | N7 | H31 | 178.9° | 179.8° |
| N1 | C2 | N7 | H32 | 59.0° | 0.2° |
| N3 | C4 | N8 | C5 | 179.9° | 180.0° |
| N3 | C4 | C5 | C6 | 0.1° | 0.2° |
| N3 | C4 | C5 | C11 | 179.4° | 180.0° |
| N3 | C4 | N8 | H29 | 0.0° | 180.0° |
| N3 | C4 | N8 | H30 | 120.0° | 0.0° |
| C25 | C24 | C23 | H10 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 3.5° | 0.3° |
| C25 | C24 | C23 | C22 | 1.1° | 0.1° |
| C25 | C24 | C23 | H11 | 178.9° | 179.9° |
| C24 | C25 | C26 | H12 | 176.5° | 179.7° |
| C26 | C25 | C24 | C23 | 1.6° | 0.2° |
| C25 | C26 | C27 | H12 | 180.0° | 180.0° |
| C25 | C26 | C27 | C22 | 2.7° | 0.0° |
| C26 | C25 | C24 | H10 | 178.4° | 179.8° |
| C25 | C26 | C27 | H13 | 177.3° | 180.0° |
| C10 | C9 | C6 | N1 | 65.7° | 85.4° |
| C10 | C9 | C6 | C5 | 113.1° | 94.6° |
| C10 | C9 | C6 | H24 | 120.0° | 120.0° |
| C10 | C9 | C6 | H25 | 120.0° | 120.0° |
| C10 | C9 | H24 | H25 | 120.1° | 120.0° |
| C9 | C10 | H26 | H27 | 120.0° | 120.1° |
| C9 | C10 | H26 | H28 | 120.0° | 120.0° |
| C9 | C10 | H27 | H28 | 120.0° | 120.0° |
| N1 | C6 | C5 | C4 | 1.8° | 0.3° |
| N1 | C6 | C5 | C9 | 178.9° | 180.0° |
| N1 | C6 | C5 | C11 | 178.8° | 180.0° |
| N1 | C6 | C9 | H24 | 54.2° | 34.6° |
| N1 | C6 | C9 | H25 | 174.3° | 154.6° |
| N8 | C4 | C5 | C6 | 180.0° | 179.8° |
| N8 | C4 | C5 | C11 | 0.7° | 0.0° |
| C4 | N8 | H29 | H30 | 120.0° | 180.0° |
| C4 | C5 | C11 | C12 | 104.2° | 68.3° |
| C4 | C5 | C6 | C11 | 179.4° | 179.8° |
| C4 | C5 | C6 | C9 | 179.3° | 179.7° |
| C4 | C5 | C11 | C16 | 76.0° | 111.4° |
| C5 | C4 | N8 | H29 | 179.9° | 0.0° |
| C5 | C4 | N8 | H30 | 60.1° | 180.0° |
| C13 | C12 | C11 | H21 | 180.0° | 180.0° |
| C13 | C12 | C11 | C5 | 179.1° | 180.0° |
| C12 | C13 | C14 | H20 | 180.0° | 180.0° |
| C13 | C12 | C11 | C16 | 1.1° | 0.3° |
| C12 | C13 | C14 | O17 | 177.2° | 180.0° |
| C12 | C13 | C14 | C15 | 0.3° | 0.3° |
| C12 | C11 | C5 | C6 | 76.5° | 111.5° |
| C12 | C11 | C5 | C16 | 179.8° | 179.7° |
| C11 | C12 | C13 | C14 | 0.6° | 0.0° |
| C12 | C11 | C16 | C15 | 0.8° | 0.3° |
| C11 | C12 | C13 | H20 | 179.4° | 180.0° |
| C12 | C11 | C16 | H23 | 179.2° | 179.7° |
| C24 | C23 | C22 | H11 | 180.0° | 179.9° |
| C24 | C23 | C22 | C27 | 2.0° | 0.3° |
| C24 | C23 | C22 | O21 | 179.7° | 179.9° |
| C26 | C27 | C22 | C23 | 0.0° | 0.3° |
| C26 | C27 | C22 | H13 | 180.0° | 179.9° |
| C26 | C27 | C22 | O21 | 178.4° | 180.0° |
| C6 | C5 | C11 | C16 | 103.4° | 68.8° |
| C5 | C6 | C9 | H24 | 126.9° | 145.4° |
| C5 | C6 | C9 | H25 | 6.9° | 25.4° |
| C9 | C6 | C5 | C11 | 0.1° | 0.0° |
| C6 | C9 | H24 | H25 | 120.1° | 120.0° |
| C6 | C9 | C10 | H26 | 180.0° | 55.0° |
| C6 | C9 | C10 | H27 | 60.0° | 65.0° |
| C6 | C9 | C10 | H28 | 60.0° | 175.0° |
| C5 | C11 | C16 | C15 | 179.4° | 180.0° |
| C5 | C11 | C12 | H21 | 0.9° | 0.0° |
| C5 | C11 | C16 | H23 | 0.6° | 0.1° |
| C13 | C14 | O17 | C15 | 176.9° | 179.7° |
| C13 | C14 | C15 | C16 | 0.7° | 0.3° |
| C13 | C14 | O17 | C18 | 164.7° | 0.2° |
| C14 | C13 | C12 | H21 | 179.4° | 180.0° |
| C13 | C14 | C15 | H22 | 179.3° | 179.7° |
| C11 | C16 | C15 | C14 | 0.1° | 0.1° |
| C11 | C16 | C15 | H23 | 180.0° | 179.9° |
| C16 | C11 | C12 | H21 | 178.9° | 179.7° |
| C11 | C16 | C15 | H22 | 179.9° | 179.9° |
| C23 | C22 | C27 | O21 | 178.4° | 179.8° |
| C23 | C22 | O21 | C20 | 9.4° | 180.0° |
| C22 | C23 | C24 | H10 | 178.8° | 180.0° |
| C23 | C22 | C27 | H13 | 180.0° | 179.7° |
| C27 | C22 | O21 | C20 | 168.9° | 0.2° |
| C27 | C22 | C23 | H11 | 178.0° | 179.8° |
| C22 | C27 | C26 | H12 | 177.3° | 180.0° |
| O17 | C14 | C15 | C16 | 177.4° | 180.0° |
| C14 | O17 | C18 | C19 | 109.9° | 180.0° |
| C14 | O17 | C18 | H18 | 131.2° | 60.0° |
| C14 | O17 | C18 | H19 | 9.0° | 59.9° |
| O17 | C14 | C13 | H20 | 2.8° | 0.0° |
| O17 | C14 | C15 | H22 | 2.6° | 0.0° |
| C14 | C15 | C16 | H22 | 180.0° | 180.0° |
| C15 | C14 | O17 | C18 | 18.4° | 180.0° |
| C15 | C14 | C13 | H20 | 179.7° | 179.7° |
| C14 | C15 | C16 | H23 | 179.9° | 180.0° |
| C22 | O21 | C20 | C19 | 109.8° | 180.0° |
| O21 | C22 | C23 | H11 | 0.3° | 0.0° |
| O21 | C22 | C27 | H13 | 1.6° | 0.1° |
| C22 | O21 | C20 | H14 | 130.2° | 60.0° |
| C22 | O21 | C20 | H15 | 10.3° | 60.0° |
| O17 | C18 | C19 | H18 | 118.9° | 119.9° |
| O17 | C18 | C19 | H19 | 118.9° | 120.0° |
| O17 | C18 | C19 | C20 | 64.1° | 180.0° |
| O17 | C18 | C19 | H16 | 174.5° | 60.0° |
| O17 | C18 | C19 | H17 | 57.3° | 60.0° |
| O17 | C18 | H18 | H19 | 123.3° | 120.0° |
| C18 | C19 | C20 | O21 | 95.4° | 180.0° |
| C18 | C19 | C20 | H16 | 121.4° | 120.0° |
| C18 | C19 | C20 | H17 | 121.4° | 120.0° |
| C18 | C19 | C20 | H14 | 144.5° | 60.0° |
| C18 | C19 | C20 | H15 | 24.7° | 60.0° |
| C18 | C19 | H16 | H17 | 115.4° | 120.0° |
| C19 | C18 | H18 | H19 | 123.3° | 120.0° |
| O21 | C20 | C19 | H14 | 120.0° | 120.0° |
| O21 | C20 | C19 | H15 | 120.1° | 120.0° |
| O21 | C20 | H14 | H15 | 119.8° | 120.0° |
| O21 | C20 | C19 | H16 | 143.2° | 60.0° |
| O21 | C20 | C19 | H17 | 26.0° | 60.0° |
| C19 | C20 | H14 | H15 | 119.8° | 120.0° |
| C20 | C19 | H16 | H17 | 115.5° | 120.0° |
| C20 | C19 | C18 | H18 | 54.8° | 60.0° |
| C20 | C19 | C18 | H19 | 177.0° | 60.0° |
| H5 | C34 | C35 | H7 | 60.1° | 175.1° |
| H5 | C34 | C35 | H8 | 59.9° | 55.0° |
| H5 | C34 | C35 | H9 | 179.9° | 64.9° |
| H6 | C34 | C35 | H7 | 60.1° | 65.0° |
| H6 | C34 | C35 | H8 | 179.9° | 175.0° |
| H6 | C34 | C35 | H9 | 59.9° | 55.1° |
| H7 | C35 | H8 | H9 | 120.0° | 120.0° |
| H10 | C24 | C23 | H11 | 1.2° | 0.1° |
| H12 | C26 | C27 | H13 | 2.7° | 0.0° |
| H14 | C20 | C19 | H16 | 23.1° | 180.0° |
| H14 | C20 | C19 | H17 | 94.0° | 60.0° |
| H15 | C20 | C19 | H16 | 96.8° | 60.0° |
| H15 | C20 | C19 | H17 | 146.1° | 180.0° |
| H16 | C19 | C18 | H18 | 66.7° | 180.0° |
| H16 | C19 | C18 | H19 | 55.6° | 60.0° |
| H17 | C19 | C18 | H18 | 176.2° | 59.9° |
| H17 | C19 | C18 | H19 | 61.5° | 180.0° |
| H20 | C13 | C12 | H21 | 0.6° | 0.0° |
| H22 | C15 | C16 | H23 | 0.2° | 0.0° |
| H24 | C9 | C10 | H26 | 60.1° | 175.0° |
| H24 | C9 | C10 | H27 | 60.0° | 55.0° |
| H24 | C9 | C10 | H28 | 179.9° | 65.0° |
| H25 | C9 | C10 | H26 | 60.0° | 65.0° |
| H25 | C9 | C10 | H27 | 180.0° | 175.0° |
| H25 | C9 | C10 | H28 | 60.0° | 55.0° |
| H26 | C10 | H27 | H28 | 120.0° | 119.9° |
