CVQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C39 | O38 | sing | 1.43Å | 1.48Å | |
| C2 | N1 | doub | 1.32Å | 1.34Å | Aromatic |
| C2 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| N1 | C6 | sing | 1.33Å | 1.37Å | Aromatic |
| O38 | C3 | sing | 1.36Å | 1.36Å | |
| C3 | C4 | doub | 1.40Å | 1.41Å | Aromatic |
| N8 | N9 | sing | 1.40Å | 1.24Å | Aromatic |
| N8 | C7 | doub | 1.31Å | 1.33Å | Aromatic |
| C16 | N9 | sing | 1.46Å | 1.45Å | |
| C16 | C17 | sing | 1.51Å | 1.53Å | |
| C6 | C7 | sing | 1.48Å | 1.39Å | |
| C6 | N5 | doub | 1.33Å | 1.32Å | Aromatic |
| N9 | C10 | sing | 1.37Å | 1.33Å | Aromatic |
| C7 | C11 | sing | 1.47Å | 1.39Å | Aromatic |
| C4 | N5 | sing | 1.33Å | 1.34Å | Aromatic |
| C4 | N29 | sing | 1.39Å | 1.34Å | |
| F28 | C18 | sing | 1.35Å | 1.34Å | |
| C17 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C10 | C11 | doub | 1.41Å | 1.37Å | Aromatic |
| C10 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| F23 | C22 | sing | 1.35Å | 1.35Å | |
| C11 | C12 | sing | 1.40Å | 1.41Å | Aromatic |
| N29 | C30 | sing | 1.40Å | 1.36Å | |
| C18 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C14 | doub | 1.37Å | 1.39Å | Aromatic |
| C12 | C13 | doub | 1.37Å | 1.40Å | Aromatic |
| C19 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| O36 | C37 | sing | 1.43Å | 1.41Å | |
| O36 | C31 | sing | 1.36Å | 1.37Å | |
| C21 | C20 | sing | 1.39Å | 1.38Å | Aromatic |
| C30 | C31 | doub | 1.40Å | 1.39Å | Aromatic |
| C30 | C35 | sing | 1.39Å | 1.40Å | Aromatic |
| C20 | O24 | sing | 1.36Å | 1.36Å | |
| C14 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C31 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
| C25 | O24 | sing | 1.43Å | 1.42Å | |
| C25 | C26 | sing | 1.53Å | 1.50Å | |
| C32 | N33 | doub | 1.32Å | 1.34Å | Aromatic |
| O27 | C26 | sing | 1.43Å | 1.42Å | |
| C34 | N33 | sing | 1.32Å | 1.33Å | Aromatic |
| C14 | H1 | sing | 1.08Å | 1.08Å | |
| C12 | H2 | sing | 1.08Å | 1.08Å | |
| C13 | H3 | sing | 1.08Å | 1.08Å | |
| C37 | H4 | sing | 1.09Å | 1.10Å | |
| C37 | H5 | sing | 1.09Å | 1.10Å | |
| C37 | H6 | sing | 1.09Å | 1.10Å | |
| C32 | H7 | sing | 1.08Å | 1.08Å | |
| C34 | H8 | sing | 1.08Å | 1.08Å | |
| C35 | H9 | sing | 1.08Å | 1.08Å | |
| N29 | H10 | sing | 0.97Å | 1.00Å | |
| C39 | H11 | sing | 1.09Å | 1.10Å | |
| C39 | H12 | sing | 1.09Å | 1.10Å | |
| C39 | H13 | sing | 1.09Å | 1.10Å | |
| C2 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| O27 | H24 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C39 | O38 | C3 | 118.1° | 117.0° |
| O38 | C39 | H11 | 109.5° | 109.5° |
| O38 | C39 | H12 | 109.5° | 109.4° |
| O38 | C39 | H13 | 109.5° | 109.5° |
| N1 | C2 | C3 | 117.4° | 119.2° |
| C2 | N1 | C6 | 122.4° | 121.0° |
| N1 | C2 | H14 | 121.3° | 120.4° |
| C2 | C3 | O38 | 122.6° | 120.8° |
| C2 | C3 | C4 | 119.5° | 118.4° |
| C3 | C2 | H14 | 121.3° | 120.4° |
| N1 | C6 | C7 | 118.6° | 119.1° |
| N1 | C6 | N5 | 120.2° | 121.7° |
| O38 | C3 | C4 | 117.8° | 120.8° |
| C3 | C4 | N5 | 119.1° | 119.0° |
| C3 | C4 | N29 | 116.9° | 120.5° |
| N9 | N8 | C7 | 108.4° | 109.9° |
| N8 | N9 | C16 | 124.7° | 125.4° |
| N8 | N9 | C10 | 113.1° | 109.3° |
| N8 | C7 | C6 | 126.7° | 126.2° |
| N8 | C7 | C11 | 108.0° | 107.5° |
| N9 | C16 | C17 | 112.7° | 109.5° |
| C16 | N9 | C10 | 122.2° | 125.3° |
| N9 | C16 | H16 | 108.7° | 109.5° |
| N9 | C16 | H17 | 108.6° | 109.5° |
| C16 | C17 | C18 | 122.8° | 120.0° |
| C16 | C17 | C22 | 119.5° | 119.9° |
| C17 | C16 | H16 | 108.6° | 109.4° |
| C17 | C16 | H17 | 108.7° | 109.5° |
| C7 | C6 | N5 | 121.2° | 119.2° |
| C6 | C7 | C11 | 125.3° | 126.3° |
| C6 | N5 | C4 | 121.2° | 120.7° |
| N9 | C10 | C11 | 106.0° | 106.9° |
| N9 | C10 | C15 | 132.6° | 133.7° |
| C7 | C11 | C10 | 104.6° | 106.3° |
| C7 | C11 | C12 | 135.6° | 133.9° |
| N5 | C4 | N29 | 124.0° | 120.5° |
| C4 | N29 | C30 | 129.5° | 120.0° |
| C4 | N29 | H10 | 115.2° | 120.0° |
| F28 | C18 | C17 | 121.5° | 120.0° |
| F28 | C18 | C19 | 117.0° | 120.0° |
| C18 | C17 | C22 | 117.7° | 120.0° |
| C17 | C18 | C19 | 121.4° | 120.1° |
| C17 | C22 | F23 | 121.4° | 120.0° |
| C17 | C22 | C21 | 121.1° | 120.0° |
| C11 | C10 | C15 | 121.4° | 119.4° |
| C10 | C11 | C12 | 119.9° | 119.7° |
| C10 | C15 | C14 | 119.3° | 119.8° |
| C10 | C15 | H15 | 120.3° | 120.0° |
| F23 | C22 | C21 | 117.3° | 120.0° |
| C11 | C12 | C13 | 118.8° | 119.7° |
| C11 | C12 | H2 | 120.6° | 120.2° |
| N29 | C30 | C31 | 114.2° | 120.9° |
| N29 | C30 | C35 | 127.4° | 120.9° |
| C30 | N29 | H10 | 115.2° | 120.0° |
| C18 | C19 | C20 | 120.3° | 120.0° |
| C18 | C19 | H19 | 119.9° | 120.1° |
| C22 | C21 | C20 | 120.1° | 120.0° |
| C22 | C21 | H18 | 119.9° | 120.0° |
| C15 | C14 | C13 | 120.1° | 120.8° |
| C15 | C14 | H1 | 119.9° | 119.6° |
| C14 | C15 | H15 | 120.3° | 120.1° |
| C12 | C13 | C14 | 120.5° | 120.5° |
| C13 | C12 | H2 | 120.6° | 120.2° |
| C12 | C13 | H3 | 119.7° | 119.8° |
| C19 | C20 | C21 | 119.2° | 119.9° |
| C19 | C20 | O24 | 123.8° | 120.0° |
| C20 | C19 | H19 | 119.9° | 120.0° |
| C37 | O36 | C31 | 121.9° | 117.0° |
| O36 | C37 | H4 | 109.5° | 109.5° |
| O36 | C37 | H5 | 109.5° | 109.5° |
| O36 | C37 | H6 | 109.4° | 109.4° |
| O36 | C31 | C30 | 114.9° | 120.5° |
| O36 | C31 | C32 | 125.1° | 120.5° |
| C21 | C20 | O24 | 116.9° | 120.1° |
| C20 | C21 | H18 | 120.0° | 120.0° |
| C31 | C30 | C35 | 118.2° | 118.3° |
| C30 | C31 | C32 | 120.0° | 119.0° |
| C30 | C35 | C34 | 119.0° | 119.1° |
| C30 | C35 | H9 | 120.5° | 120.4° |
| C20 | O24 | C25 | 119.4° | 117.0° |
| C13 | C14 | H1 | 120.0° | 119.6° |
| C14 | C13 | H3 | 119.7° | 119.7° |
| C31 | C32 | N33 | 120.6° | 120.7° |
| C31 | C32 | H7 | 119.7° | 119.7° |
| C35 | C34 | N33 | 120.8° | 121.0° |
| C35 | C34 | H8 | 119.6° | 119.5° |
| C34 | C35 | H9 | 120.5° | 120.5° |
| O24 | C25 | C26 | 102.5° | 109.5° |
| O24 | C25 | H20 | 111.2° | 109.5° |
| O24 | C25 | H21 | 111.2° | 109.5° |
| C25 | C26 | O27 | 104.5° | 109.4° |
| C26 | C25 | H20 | 111.2° | 109.5° |
| C26 | C25 | H21 | 111.2° | 109.4° |
| C25 | C26 | H22 | 110.7° | 109.5° |
| C25 | C26 | H23 | 110.7° | 109.5° |
| C32 | N33 | C34 | 121.2° | 121.9° |
| N33 | C32 | H7 | 119.7° | 119.6° |
| O27 | C26 | H22 | 110.7° | 109.5° |
| O27 | C26 | H23 | 110.7° | 109.4° |
| C26 | O27 | H24 | 109.5° | 114.0° |
| N33 | C34 | H8 | 119.6° | 119.5° |
| H4 | C37 | H5 | 109.4° | 109.5° |
| H4 | C37 | H6 | 109.5° | 109.5° |
| H5 | C37 | H6 | 109.5° | 109.4° |
| H11 | C39 | H12 | 109.4° | 109.5° |
| H11 | C39 | H13 | 109.5° | 109.5° |
| H12 | C39 | H13 | 109.5° | 109.5° |
| H16 | C16 | H17 | 109.5° | 109.4° |
| H20 | C25 | H21 | 109.5° | 109.5° |
| H22 | C26 | H23 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C39 | O38 | C3 | C2 | 8.3° | 0.1° |
| C39 | O38 | C3 | C4 | 168.7° | 180.0° |
| O38 | C39 | H11 | H12 | 120.0° | 119.9° |
| O38 | C39 | H11 | H13 | 120.0° | 120.0° |
| O38 | C39 | H12 | H13 | 120.0° | 120.0° |
| N1 | C2 | C3 | H14 | 180.0° | 179.7° |
| N1 | C2 | C3 | O38 | 179.5° | 180.0° |
| N1 | C2 | C3 | C4 | 2.5° | 0.1° |
| C2 | N1 | C6 | C7 | 179.7° | 180.0° |
| C2 | N1 | C6 | N5 | 0.6° | 0.6° |
| C3 | C2 | N1 | C6 | 0.7° | 0.3° |
| C2 | C3 | O38 | C4 | 177.0° | 179.9° |
| C2 | C3 | C4 | N5 | 4.4° | 0.1° |
| C2 | C3 | C4 | N29 | 179.1° | 179.8° |
| N1 | C6 | C7 | N8 | 33.8° | 179.2° |
| N1 | C6 | C7 | N5 | 179.1° | 179.4° |
| N1 | C6 | C7 | C11 | 143.0° | 0.5° |
| N1 | C6 | N5 | C4 | 2.6° | 0.6° |
| C6 | N1 | C2 | H14 | 179.3° | 180.0° |
| O38 | C3 | C4 | N5 | 178.5° | 180.0° |
| O38 | C3 | C4 | N29 | 2.0° | 0.3° |
| C3 | O38 | C39 | H11 | 180.0° | 60.0° |
| C3 | O38 | C39 | H12 | 60.0° | 60.0° |
| C3 | O38 | C39 | H13 | 60.0° | 179.9° |
| O38 | C3 | C2 | H14 | 0.5° | 0.4° |
| C3 | C4 | N5 | C6 | 4.4° | 0.3° |
| C3 | C4 | N5 | N29 | 176.2° | 179.7° |
| C3 | C4 | N29 | C30 | 168.3° | 173.9° |
| C3 | C4 | N29 | H10 | 11.6° | 6.2° |
| C4 | C3 | C2 | H14 | 177.5° | 179.7° |
| N8 | N9 | C16 | C10 | 179.6° | 179.9° |
| N8 | N9 | C16 | C17 | 110.1° | 90.0° |
| N9 | N8 | C7 | C6 | 177.6° | 179.5° |
| N9 | N8 | C7 | C11 | 0.4° | 0.7° |
| N8 | N9 | C10 | C11 | 0.2° | 0.0° |
| N8 | N9 | C10 | C15 | 179.1° | 179.6° |
| N8 | N9 | C16 | H16 | 129.5° | 150.0° |
| N8 | N9 | C16 | H17 | 10.4° | 30.1° |
| C7 | N8 | N9 | C16 | 179.5° | 179.6° |
| N8 | C7 | C6 | C11 | 176.8° | 179.7° |
| N8 | C7 | C6 | N5 | 147.1° | 0.2° |
| C7 | N8 | N9 | C10 | 0.1° | 0.5° |
| N8 | C7 | C11 | C10 | 0.5° | 0.7° |
| N8 | C7 | C11 | C12 | 179.2° | 179.7° |
| N9 | C16 | C17 | H16 | 120.5° | 120.0° |
| N9 | C16 | C17 | H17 | 120.5° | 120.0° |
| N9 | C16 | C17 | C18 | 59.3° | 90.0° |
| N9 | C16 | C17 | C22 | 119.7° | 89.7° |
| C16 | N9 | C10 | C11 | 179.8° | 180.0° |
| C16 | N9 | C10 | C15 | 1.3° | 0.3° |
| N9 | C16 | H16 | H17 | 118.5° | 120.0° |
| C17 | C16 | N9 | C10 | 69.5° | 90.0° |
| C16 | C17 | C18 | F28 | 1.3° | 0.0° |
| C16 | C17 | C18 | C22 | 179.1° | 179.7° |
| C16 | C17 | C22 | F23 | 1.9° | 0.0° |
| C16 | C17 | C18 | C19 | 179.2° | 180.0° |
| C16 | C17 | C22 | C21 | 177.7° | 180.0° |
| C17 | C16 | H16 | H17 | 118.5° | 120.0° |
| C7 | C6 | N5 | C4 | 178.4° | 180.0° |
| C6 | C7 | C11 | C10 | 177.8° | 179.5° |
| C6 | C7 | C11 | C12 | 1.9° | 0.0° |
| N5 | C6 | C7 | C11 | 36.1° | 179.9° |
| C6 | N5 | C4 | N29 | 179.4° | 179.9° |
| N9 | C10 | C11 | C7 | 0.4° | 0.4° |
| N9 | C10 | C11 | C15 | 179.0° | 179.7° |
| N9 | C10 | C11 | C12 | 179.3° | 180.0° |
| N9 | C10 | C15 | C14 | 179.4° | 179.6° |
| N9 | C10 | C15 | H15 | 0.6° | 0.3° |
| C10 | N9 | C16 | H16 | 50.9° | 30.0° |
| C10 | N9 | C16 | H17 | 170.0° | 150.0° |
| C7 | C11 | C10 | C12 | 179.7° | 179.6° |
| C7 | C11 | C10 | C15 | 179.4° | 179.9° |
| C7 | C11 | C12 | C13 | 179.3° | 180.0° |
| C7 | C11 | C12 | H2 | 0.7° | 0.5° |
| N5 | C4 | N29 | C30 | 15.4° | 6.4° |
| N5 | C4 | N29 | H10 | 164.6° | 173.5° |
| C4 | N29 | C30 | H10 | 180.0° | 179.9° |
| C4 | N29 | C30 | C31 | 173.0° | 162.7° |
| C4 | N29 | C30 | C35 | 11.9° | 17.6° |
| F28 | C18 | C17 | C19 | 177.9° | 179.9° |
| F28 | C18 | C17 | C22 | 179.7° | 179.7° |
| F28 | C18 | C19 | C20 | 177.3° | 179.9° |
| F28 | C18 | C19 | H19 | 2.7° | 0.0° |
| C18 | C17 | C22 | F23 | 179.0° | 179.7° |
| C18 | C17 | C22 | C21 | 3.3° | 0.3° |
| C17 | C18 | C19 | C20 | 0.8° | 0.0° |
| C18 | C17 | C16 | H16 | 179.8° | 30.0° |
| C18 | C17 | C16 | H17 | 61.2° | 149.9° |
| C17 | C18 | C19 | H19 | 179.3° | 180.0° |
| C17 | C22 | F23 | C21 | 175.9° | 180.0° |
| C22 | C17 | C18 | C19 | 1.7° | 0.2° |
| C17 | C22 | C21 | C20 | 2.3° | 0.0° |
| C22 | C17 | C16 | H16 | 0.7° | 150.3° |
| C22 | C17 | C16 | H17 | 119.8° | 30.3° |
| C17 | C22 | C21 | H18 | 177.7° | 180.0° |
| C11 | C10 | C15 | C14 | 0.7° | 0.0° |
| C10 | C11 | C12 | C13 | 0.4° | 0.5° |
| C10 | C11 | C12 | H2 | 179.6° | 180.0° |
| C11 | C10 | C15 | H15 | 179.3° | 180.0° |
| C15 | C10 | C11 | C12 | 0.3° | 0.2° |
| C10 | C15 | C14 | H15 | 180.0° | 180.0° |
| C10 | C15 | C14 | C13 | 1.2° | 0.1° |
| C10 | C15 | C14 | H1 | 178.8° | 179.7° |
| F23 | C22 | C21 | C20 | 178.3° | 180.0° |
| F23 | C22 | C21 | H18 | 1.7° | 0.0° |
| C11 | C12 | C13 | H2 | 180.0° | 179.5° |
| C11 | C12 | C13 | C14 | 0.9° | 0.6° |
| C11 | C12 | C13 | H3 | 179.1° | 179.5° |
| N29 | C30 | C31 | O36 | 1.5° | 0.1° |
| N29 | C30 | C31 | C35 | 175.6° | 179.7° |
| N29 | C30 | C31 | C32 | 177.2° | 179.8° |
| N29 | C30 | C35 | C34 | 177.8° | 179.8° |
| N29 | C30 | C35 | H9 | 2.2° | 0.0° |
| C18 | C19 | C20 | H19 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 1.7° | 0.2° |
| C18 | C19 | C20 | O24 | 179.5° | 180.0° |
| C22 | C21 | C20 | C19 | 0.2° | 0.2° |
| C22 | C21 | C20 | H18 | 180.0° | 180.0° |
| C22 | C21 | C20 | O24 | 178.2° | 180.0° |
| C15 | C14 | C13 | C12 | 1.3° | 0.3° |
| C15 | C14 | C13 | H1 | 180.0° | 179.6° |
| C15 | C14 | C13 | H3 | 178.7° | 179.8° |
| C12 | C13 | C14 | H3 | 180.0° | 179.9° |
| C12 | C13 | C14 | H1 | 178.7° | 180.0° |
| C19 | C20 | C21 | O24 | 177.9° | 179.8° |
| C19 | C20 | O24 | C25 | 46.9° | 0.2° |
| C19 | C20 | C21 | H18 | 179.8° | 179.7° |
| C37 | O36 | C31 | C30 | 169.1° | 179.7° |
| C37 | O36 | C31 | C32 | 12.2° | 0.0° |
| O36 | C37 | H4 | H5 | 120.0° | 120.1° |
| O36 | C37 | H4 | H6 | 120.0° | 120.0° |
| O36 | C37 | H5 | H6 | 120.0° | 120.0° |
| O36 | C31 | C30 | C32 | 178.8° | 179.7° |
| O36 | C31 | C30 | C35 | 177.2° | 179.7° |
| O36 | C31 | C32 | N33 | 179.9° | 180.0° |
| C31 | O36 | C37 | H4 | 180.0° | 180.0° |
| C31 | O36 | C37 | H5 | 60.0° | 60.0° |
| C31 | O36 | C37 | H6 | 60.0° | 60.0° |
| O36 | C31 | C32 | H7 | 0.1° | 0.1° |
| C21 | C20 | O24 | C25 | 135.2° | 180.0° |
| C21 | C20 | C19 | H19 | 178.3° | 179.7° |
| C31 | C30 | C35 | C34 | 2.8° | 0.5° |
| C30 | C31 | C32 | N33 | 1.4° | 0.3° |
| C30 | C31 | C32 | H7 | 178.6° | 179.8° |
| C31 | C30 | C35 | H9 | 177.2° | 179.7° |
| C31 | C30 | N29 | H10 | 7.0° | 17.2° |
| C35 | C30 | C31 | C32 | 1.6° | 0.5° |
| C30 | C35 | C34 | H9 | 180.0° | 179.8° |
| C30 | C35 | C34 | N33 | 1.0° | 0.3° |
| C30 | C35 | C34 | H8 | 179.0° | 179.7° |
| C35 | C30 | N29 | H10 | 168.2° | 162.4° |
| C20 | O24 | C25 | C26 | 124.3° | 180.0° |
| O24 | C20 | C21 | H18 | 1.8° | 0.1° |
| O24 | C20 | C19 | H19 | 0.5° | 0.1° |
| C20 | O24 | C25 | H20 | 116.9° | 60.0° |
| C20 | O24 | C25 | H21 | 5.4° | 60.1° |
| C14 | C13 | C12 | H2 | 179.1° | 179.9° |
| C13 | C14 | C15 | H15 | 178.8° | 179.9° |
| C31 | C32 | N33 | H7 | 180.0° | 179.9° |
| C31 | C32 | N33 | C34 | 3.4° | 0.1° |
| C35 | C34 | N33 | C32 | 2.2° | 0.1° |
| C35 | C34 | N33 | H8 | 180.0° | 180.0° |
| O24 | C25 | C26 | H20 | 118.9° | 120.1° |
| O24 | C25 | C26 | H21 | 118.9° | 119.9° |
| O24 | C25 | C26 | O27 | 57.5° | 65.0° |
| O24 | C25 | H20 | H21 | 123.3° | 120.0° |
| O24 | C25 | C26 | H22 | 61.7° | 175.0° |
| O24 | C25 | C26 | H23 | 176.7° | 55.0° |
| C25 | C26 | O27 | H22 | 119.2° | 120.1° |
| C25 | C26 | O27 | H23 | 119.2° | 120.0° |
| C26 | C25 | H20 | H21 | 123.2° | 119.9° |
| C25 | C26 | H22 | H23 | 122.3° | 120.0° |
| C25 | C26 | O27 | H24 | 180.0° | 180.0° |
| C32 | N33 | C34 | H8 | 177.8° | 180.0° |
| O27 | C26 | C25 | H20 | 176.4° | 55.1° |
| O27 | C26 | C25 | H21 | 61.4° | 175.1° |
| O27 | C26 | H22 | H23 | 122.3° | 120.0° |
| C34 | N33 | C32 | H7 | 176.6° | 180.0° |
| N33 | C34 | C35 | H9 | 179.0° | 179.9° |
| H1 | C14 | C13 | H3 | 1.3° | 0.1° |
| H1 | C14 | C15 | H15 | 1.2° | 0.3° |
| H2 | C12 | C13 | H3 | 0.9° | 0.0° |
| H4 | C37 | H5 | H6 | 120.0° | 119.9° |
| H8 | C34 | C35 | H9 | 1.0° | 0.0° |
| H11 | C39 | H12 | H13 | 120.0° | 120.1° |
| H20 | C25 | C26 | H22 | 57.2° | 65.0° |
| H20 | C25 | C26 | H23 | 64.4° | 175.0° |
| H21 | C25 | C26 | H22 | 179.4° | 55.0° |
| H21 | C25 | C26 | H23 | 57.8° | 65.0° |
| H22 | C26 | O27 | H24 | 60.8° | 59.9° |
| H23 | C26 | O27 | H24 | 60.8° | 60.0° |
