QSY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | C19 | sing | 1.53Å | 1.55Å | |
| C21 | C15 | sing | 1.53Å | 1.55Å | |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| C14 | C13 | sing | 1.53Å | 1.55Å | |
| C14 | N4 | sing | 1.47Å | 1.52Å | |
| C15 | N4 | sing | 1.47Å | 1.52Å | |
| C15 | C17 | sing | 1.53Å | 1.55Å | |
| C16 | N4 | sing | 1.47Å | 1.52Å | |
| C13 | C12 | sing | 1.53Å | 1.55Å | |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| C12 | N2 | sing | 1.47Å | 1.47Å | |
| N2 | C11 | sing | 1.36Å | 1.40Å | |
| N2 | C10 | sing | 1.35Å | 1.40Å | |
| O2 | C10 | doub | 1.22Å | 1.22Å | |
| C11 | N3 | doub | 1.30Å | 1.34Å | |
| C10 | C8 | sing | 1.41Å | 1.46Å | |
| N3 | C9 | sing | 1.34Å | 1.38Å | |
| C8 | C9 | doub | 1.39Å | 1.38Å | Aromatic |
| C8 | N1 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | C5 | sing | 1.47Å | 1.43Å | Aromatic |
| N1 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | doub | 1.40Å | 1.37Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C1 | doub | 1.38Å | 1.42Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.41Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.42Å | Aromatic |
| C1 | O1 | sing | 1.36Å | 1.37Å | |
| O1 | C7 | sing | 1.43Å | 1.44Å | |
| N1 | H7 | sing | 0.97Å | 1.00Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| N4 | H29 | sing | 1.01Å | 1.00Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C19 | 111.8° | 109.5° |
| C20 | C21 | C15 | 111.7° | 109.5° |
| C21 | C20 | H26 | 108.9° | 109.5° |
| C21 | C20 | H25 | 108.9° | 109.5° |
| C20 | C21 | H27 | 108.9° | 109.5° |
| C20 | C21 | H28 | 108.9° | 109.5° |
| C20 | C19 | C18 | 111.6° | 109.5° |
| C20 | C19 | H24 | 108.9° | 109.4° |
| C20 | C19 | H23 | 108.9° | 109.5° |
| C19 | C20 | H26 | 108.9° | 109.5° |
| C19 | C20 | H25 | 108.9° | 109.5° |
| C21 | C15 | N4 | 115.2° | 109.5° |
| C21 | C15 | C17 | 110.9° | 109.5° |
| C21 | C15 | H15 | 105.8° | 109.5° |
| C15 | C21 | H27 | 108.9° | 109.5° |
| C15 | C21 | H28 | 108.9° | 109.5° |
| C19 | C18 | C17 | 111.5° | 109.5° |
| C19 | C18 | H22 | 109.0° | 109.5° |
| C19 | C18 | H21 | 109.0° | 109.5° |
| C18 | C19 | H24 | 108.9° | 109.5° |
| C18 | C19 | H23 | 108.9° | 109.5° |
| C13 | C14 | N4 | 115.7° | 109.5° |
| C14 | C13 | C12 | 114.7° | 109.4° |
| C14 | C13 | H12 | 108.1° | 109.5° |
| C14 | C13 | H11 | 108.2° | 109.5° |
| C13 | C14 | H13 | 107.9° | 109.5° |
| C13 | C14 | H14 | 107.9° | 109.4° |
| C14 | N4 | C15 | 110.2° | 109.5° |
| C14 | N4 | C16 | 111.2° | 109.4° |
| C14 | N4 | H29 | 107.8° | 109.5° |
| N4 | C14 | H13 | 107.9° | 109.5° |
| N4 | C14 | H14 | 107.9° | 109.4° |
| N4 | C15 | C17 | 112.2° | 109.5° |
| C15 | N4 | C16 | 111.8° | 109.5° |
| C15 | N4 | H29 | 107.8° | 109.5° |
| N4 | C15 | H15 | 106.1° | 109.5° |
| C15 | C17 | C18 | 111.5° | 109.5° |
| C17 | C15 | H15 | 105.8° | 109.4° |
| C15 | C17 | H19 | 109.0° | 109.5° |
| C15 | C17 | H20 | 109.0° | 109.5° |
| C16 | N4 | H29 | 107.9° | 109.5° |
| N4 | C16 | H17 | 109.5° | 109.5° |
| N4 | C16 | H18 | 109.5° | 109.5° |
| N4 | C16 | H16 | 109.5° | 109.5° |
| C13 | C12 | N2 | 113.8° | 109.4° |
| C13 | C12 | H10 | 108.3° | 109.4° |
| C13 | C12 | H9 | 108.4° | 109.5° |
| C12 | C13 | H12 | 108.2° | 109.4° |
| C12 | C13 | H11 | 108.1° | 109.5° |
| C18 | C17 | H19 | 109.0° | 109.4° |
| C18 | C17 | H20 | 109.0° | 109.4° |
| C17 | C18 | H22 | 109.0° | 109.4° |
| C17 | C18 | H21 | 108.9° | 109.4° |
| C12 | N2 | C11 | 118.4° | 119.8° |
| C12 | N2 | C10 | 119.4° | 119.8° |
| N2 | C12 | H10 | 108.4° | 109.4° |
| N2 | C12 | H9 | 108.4° | 109.5° |
| C11 | N2 | C10 | 121.9° | 120.4° |
| N2 | C11 | N3 | 126.7° | 121.9° |
| N2 | C11 | H8 | 116.6° | 119.0° |
| N2 | C10 | O2 | 125.4° | 120.8° |
| N2 | C10 | C8 | 110.2° | 118.4° |
| O2 | C10 | C8 | 124.4° | 120.8° |
| C11 | N3 | C9 | 114.3° | 121.2° |
| N3 | C11 | H8 | 116.7° | 119.1° |
| C10 | C8 | C9 | 125.5° | 118.2° |
| C10 | C8 | N1 | 124.8° | 133.0° |
| N3 | C9 | C8 | 121.3° | 119.8° |
| N3 | C9 | C5 | 131.5° | 133.8° |
| C9 | C8 | N1 | 109.6° | 108.7° |
| C8 | C9 | C5 | 107.2° | 106.5° |
| C8 | N1 | C4 | 106.2° | 110.1° |
| C8 | N1 | H7 | 126.9° | 125.0° |
| C9 | C5 | C4 | 106.4° | 106.6° |
| C9 | C5 | C6 | 131.2° | 133.5° |
| N1 | C4 | C5 | 110.5° | 108.1° |
| N1 | C4 | C3 | 128.1° | 132.4° |
| C4 | N1 | H7 | 126.9° | 125.0° |
| C4 | C5 | C6 | 122.3° | 120.0° |
| C5 | C4 | C3 | 121.4° | 119.4° |
| C5 | C6 | C1 | 117.4° | 119.8° |
| C5 | C6 | H3 | 121.3° | 120.1° |
| C4 | C3 | C2 | 117.9° | 120.1° |
| C4 | C3 | H2 | 121.1° | 119.9° |
| C6 | C1 | C2 | 120.2° | 120.2° |
| C6 | C1 | O1 | 122.5° | 119.9° |
| C1 | C6 | H3 | 121.3° | 120.1° |
| C3 | C2 | C1 | 120.8° | 120.6° |
| C3 | C2 | H1 | 119.6° | 119.7° |
| C2 | C3 | H2 | 121.0° | 120.0° |
| C2 | C1 | O1 | 117.3° | 119.9° |
| C1 | C2 | H1 | 119.6° | 119.7° |
| C1 | O1 | C7 | 122.6° | 117.0° |
| O1 | C7 | H4 | 109.5° | 109.4° |
| O1 | C7 | H5 | 109.5° | 109.5° |
| O1 | C7 | H6 | 109.5° | 109.5° |
| H4 | C7 | H5 | 109.5° | 109.4° |
| H4 | C7 | H6 | 109.5° | 109.4° |
| H5 | C7 | H6 | 109.5° | 109.5° |
| H10 | C12 | H9 | 109.5° | 109.5° |
| H12 | C13 | H11 | 109.5° | 109.5° |
| H13 | C14 | H14 | 109.4° | 109.5° |
| H17 | C16 | H18 | 109.5° | 109.4° |
| H17 | C16 | H16 | 109.5° | 109.4° |
| H18 | C16 | H16 | 109.4° | 109.5° |
| H19 | C17 | H20 | 109.5° | 109.5° |
| H22 | C18 | H21 | 109.5° | 109.5° |
| H24 | C19 | H23 | 109.5° | 109.4° |
| H26 | C20 | H25 | 109.5° | 109.4° |
| H27 | C21 | H28 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C19 | H26 | 120.4° | 120.0° |
| C21 | C20 | C19 | H25 | 120.4° | 120.0° |
| C20 | C21 | C15 | H27 | 120.3° | 120.0° |
| C20 | C21 | C15 | H28 | 120.4° | 120.0° |
| C21 | C20 | C19 | C18 | 53.8° | 60.0° |
| C20 | C21 | C15 | N4 | 176.7° | 180.0° |
| C20 | C21 | C15 | C17 | 54.5° | 60.0° |
| C20 | C21 | C15 | H15 | 59.8° | 60.0° |
| C21 | C20 | C19 | H24 | 174.1° | 60.1° |
| C21 | C20 | C19 | H23 | 66.5° | 180.0° |
| C21 | C20 | H26 | H25 | 118.9° | 120.0° |
| C20 | C21 | H27 | H28 | 119.0° | 120.0° |
| C19 | C20 | C21 | C15 | 53.8° | 60.0° |
| C20 | C19 | C18 | H24 | 120.3° | 120.0° |
| C20 | C19 | C18 | H23 | 120.3° | 120.0° |
| C20 | C19 | C18 | C17 | 54.8° | 60.0° |
| C20 | C19 | C18 | H22 | 65.5° | 180.0° |
| C20 | C19 | C18 | H21 | 175.1° | 59.9° |
| C20 | C19 | H24 | H23 | 119.0° | 119.9° |
| C19 | C20 | H26 | H25 | 119.0° | 120.0° |
| C19 | C20 | C21 | H27 | 66.5° | 180.0° |
| C19 | C20 | C21 | H28 | 174.2° | 60.0° |
| C21 | C15 | N4 | C14 | 70.6° | 180.0° |
| C21 | C15 | N4 | C17 | 128.2° | 120.0° |
| C21 | C15 | N4 | H15 | 116.7° | 120.1° |
| C21 | C15 | C17 | H15 | 114.3° | 120.0° |
| C21 | C15 | N4 | C16 | 53.6° | 60.0° |
| C21 | C15 | C17 | C18 | 55.5° | 60.0° |
| C21 | C15 | N4 | H29 | 172.0° | 60.0° |
| C21 | C15 | C17 | H19 | 64.8° | 60.0° |
| C21 | C15 | C17 | H20 | 175.8° | 180.0° |
| C15 | C21 | C20 | H26 | 66.5° | 180.0° |
| C15 | C21 | C20 | H25 | 174.2° | 60.0° |
| C15 | C21 | H27 | H28 | 119.0° | 120.0° |
| C19 | C18 | C17 | C15 | 55.8° | 60.0° |
| C19 | C18 | C17 | H22 | 120.3° | 120.0° |
| C19 | C18 | C17 | H21 | 120.3° | 120.0° |
| C19 | C18 | C17 | H19 | 64.4° | 60.0° |
| C19 | C18 | C17 | H20 | 176.1° | 180.0° |
| C19 | C18 | H22 | H21 | 119.1° | 120.1° |
| C18 | C19 | H24 | H23 | 119.0° | 120.0° |
| C18 | C19 | C20 | H26 | 66.5° | 180.0° |
| C18 | C19 | C20 | H25 | 174.2° | 60.0° |
| C13 | C14 | N4 | H13 | 120.9° | 120.0° |
| C13 | C14 | N4 | H14 | 120.9° | 119.9° |
| C13 | C14 | N4 | C15 | 170.3° | 175.0° |
| C13 | C14 | N4 | C16 | 65.1° | 65.0° |
| C14 | C13 | C12 | H12 | 120.8° | 119.9° |
| C14 | C13 | C12 | H11 | 120.8° | 120.0° |
| C14 | C13 | C12 | N2 | 58.7° | 180.0° |
| C13 | C14 | N4 | H29 | 52.9° | 54.9° |
| C14 | C13 | C12 | H10 | 179.3° | 60.1° |
| C14 | C13 | C12 | H9 | 61.9° | 60.0° |
| C14 | C13 | H12 | H11 | 117.6° | 120.0° |
| C13 | C14 | H13 | H14 | 117.1° | 120.0° |
| C14 | N4 | C15 | C16 | 124.2° | 119.9° |
| C14 | N4 | C15 | H29 | 117.4° | 120.0° |
| C14 | N4 | C15 | C17 | 161.3° | 60.0° |
| C14 | N4 | C16 | H29 | 118.0° | 120.0° |
| N4 | C14 | C13 | C12 | 70.4° | 180.0° |
| N4 | C14 | C13 | H12 | 50.4° | 60.1° |
| N4 | C14 | C13 | H11 | 168.9° | 60.0° |
| N4 | C14 | H13 | H14 | 117.2° | 120.0° |
| C14 | N4 | C15 | H15 | 46.1° | 59.9° |
| C14 | N4 | C16 | H17 | 180.0° | 60.0° |
| C14 | N4 | C16 | H18 | 60.0° | 60.0° |
| C14 | N4 | C16 | H16 | 60.0° | 180.0° |
| N4 | C15 | C17 | H15 | 115.3° | 120.0° |
| C15 | N4 | C16 | H29 | 118.3° | 120.1° |
| N4 | C15 | C17 | C18 | 174.1° | 180.0° |
| C15 | N4 | C14 | H13 | 49.4° | 65.0° |
| C15 | N4 | C14 | H14 | 68.8° | 55.1° |
| C15 | N4 | C16 | H17 | 56.3° | 59.9° |
| C15 | N4 | C16 | H18 | 63.7° | 180.0° |
| C15 | N4 | C16 | H16 | 176.3° | 60.0° |
| N4 | C15 | C17 | H19 | 65.6° | 60.0° |
| N4 | C15 | C17 | H20 | 53.8° | 60.1° |
| N4 | C15 | C21 | H27 | 63.0° | 60.0° |
| N4 | C15 | C21 | H28 | 56.4° | 60.0° |
| C17 | C15 | N4 | C16 | 74.5° | 180.0° |
| C15 | C17 | C18 | H19 | 120.3° | 120.0° |
| C15 | C17 | C18 | H20 | 120.3° | 120.0° |
| C17 | C15 | N4 | H29 | 43.9° | 60.0° |
| C15 | C17 | H19 | H20 | 119.1° | 120.1° |
| C15 | C17 | C18 | H22 | 64.4° | 180.0° |
| C15 | C17 | C18 | H21 | 176.1° | 60.0° |
| C17 | C15 | C21 | H27 | 65.9° | 180.0° |
| C17 | C15 | C21 | H28 | 174.8° | 60.0° |
| C16 | N4 | C14 | H13 | 174.0° | 55.0° |
| C16 | N4 | C14 | H14 | 55.8° | 175.0° |
| C16 | N4 | C15 | H15 | 170.3° | 60.0° |
| N4 | C16 | H17 | H18 | 120.0° | 120.1° |
| N4 | C16 | H17 | H16 | 120.0° | 120.0° |
| N4 | C16 | H18 | H16 | 120.0° | 120.0° |
| C13 | C12 | N2 | H10 | 120.6° | 119.9° |
| C13 | C12 | N2 | H9 | 120.6° | 120.0° |
| C13 | C12 | N2 | C11 | 71.0° | 90.0° |
| C13 | C12 | N2 | C10 | 103.8° | 90.0° |
| C13 | C12 | H10 | H9 | 118.0° | 120.1° |
| C12 | C13 | H12 | H11 | 117.6° | 120.0° |
| C12 | C13 | C14 | H13 | 50.6° | 60.0° |
| C12 | C13 | C14 | H14 | 168.7° | 60.1° |
| C18 | C17 | C15 | H15 | 58.8° | 60.0° |
| C18 | C17 | H19 | H20 | 119.1° | 120.0° |
| C17 | C18 | H22 | H21 | 119.1° | 120.0° |
| C17 | C18 | C19 | H24 | 175.1° | 60.0° |
| C17 | C18 | C19 | H23 | 65.5° | 180.0° |
| C12 | N2 | C11 | C10 | 174.7° | 180.0° |
| C12 | N2 | C10 | O2 | 3.7° | 0.0° |
| C12 | N2 | C11 | N3 | 172.0° | 180.0° |
| C12 | N2 | C10 | C8 | 174.6° | 180.0° |
| C12 | N2 | C11 | H8 | 8.0° | 0.1° |
| N2 | C12 | H10 | H9 | 118.0° | 120.0° |
| N2 | C12 | C13 | H12 | 62.1° | 60.0° |
| N2 | C12 | C13 | H11 | 179.5° | 60.0° |
| C11 | N2 | C10 | O2 | 178.3° | 180.0° |
| N2 | C11 | N3 | H8 | 180.0° | 179.9° |
| C11 | N2 | C10 | C8 | 0.0° | 0.0° |
| N2 | C11 | N3 | C9 | 2.6° | 0.0° |
| C11 | N2 | C12 | H10 | 49.6° | 150.1° |
| C11 | N2 | C12 | H9 | 168.4° | 30.0° |
| N2 | C10 | O2 | C8 | 178.1° | 180.0° |
| C10 | N2 | C11 | N3 | 2.6° | 0.0° |
| N2 | C10 | C8 | C9 | 2.4° | 0.0° |
| N2 | C10 | C8 | N1 | 179.2° | 179.9° |
| C10 | N2 | C11 | H8 | 177.4° | 180.0° |
| C10 | N2 | C12 | H10 | 135.6° | 29.9° |
| C10 | N2 | C12 | H9 | 16.8° | 149.9° |
| O2 | C10 | C8 | C9 | 176.0° | 179.9° |
| O2 | C10 | C8 | N1 | 2.4° | 0.0° |
| C11 | N3 | C9 | C8 | 0.1° | 0.0° |
| C11 | N3 | C9 | C5 | 179.5° | 180.0° |
| C10 | C8 | C9 | N3 | 2.5° | 0.1° |
| C10 | C8 | C9 | N1 | 178.6° | 179.9° |
| C10 | C8 | C9 | C5 | 177.0° | 179.9° |
| C10 | C8 | N1 | C4 | 177.3° | 180.0° |
| C10 | C8 | N1 | H7 | 2.7° | 0.1° |
| N3 | C9 | C8 | C5 | 179.5° | 180.0° |
| N3 | C9 | C8 | N1 | 179.0° | 180.0° |
| N3 | C9 | C5 | C4 | 179.3° | 180.0° |
| N3 | C9 | C5 | C6 | 1.0° | 0.3° |
| C9 | N3 | C11 | H8 | 177.4° | 179.9° |
| C9 | C8 | N1 | C4 | 1.3° | 0.0° |
| C8 | C9 | C5 | C4 | 1.3° | 0.0° |
| C8 | C9 | C5 | C6 | 178.4° | 179.7° |
| C9 | C8 | N1 | H7 | 178.8° | 180.0° |
| N1 | C8 | C9 | C5 | 1.6° | 0.0° |
| C8 | N1 | C4 | H7 | 180.0° | 180.0° |
| C8 | N1 | C4 | C5 | 0.4° | 0.1° |
| C8 | N1 | C4 | C3 | 179.5° | 180.0° |
| C9 | C5 | C4 | N1 | 0.5° | 0.0° |
| C9 | C5 | C4 | C6 | 179.7° | 179.7° |
| C9 | C5 | C4 | C3 | 178.7° | 180.0° |
| C9 | C5 | C6 | C1 | 179.8° | 179.8° |
| C9 | C5 | C6 | H3 | 0.2° | 0.3° |
| N1 | C4 | C5 | C3 | 179.1° | 179.9° |
| N1 | C4 | C5 | C6 | 179.2° | 179.8° |
| N1 | C4 | C3 | C2 | 179.6° | 179.9° |
| N1 | C4 | C3 | H2 | 0.4° | 0.1° |
| C4 | C5 | C6 | C1 | 0.1° | 0.5° |
| C5 | C4 | C3 | C2 | 1.4° | 0.0° |
| C5 | C4 | N1 | H7 | 179.6° | 180.0° |
| C5 | C4 | C3 | H2 | 178.6° | 180.0° |
| C4 | C5 | C6 | H3 | 179.9° | 180.0° |
| C6 | C5 | C4 | C3 | 1.6° | 0.3° |
| C5 | C6 | C1 | H3 | 180.0° | 179.5° |
| C5 | C6 | C1 | C2 | 1.5° | 0.5° |
| C5 | C6 | C1 | O1 | 178.3° | 179.7° |
| C4 | C3 | C2 | H2 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.2° | 0.0° |
| C3 | C4 | N1 | H7 | 0.5° | 0.1° |
| C4 | C3 | C2 | H1 | 179.8° | 180.0° |
| C6 | C1 | C2 | C3 | 1.7° | 0.3° |
| C6 | C1 | C2 | O1 | 179.8° | 179.7° |
| C6 | C1 | O1 | C7 | 9.8° | 179.8° |
| C6 | C1 | C2 | H1 | 178.3° | 179.7° |
| C3 | C2 | C1 | H1 | 180.0° | 180.0° |
| C3 | C2 | C1 | O1 | 178.1° | 180.0° |
| C2 | C1 | O1 | C7 | 170.5° | 0.0° |
| C1 | C2 | C3 | H2 | 179.8° | 180.0° |
| C2 | C1 | C6 | H3 | 178.5° | 180.0° |
| O1 | C1 | C2 | H1 | 1.9° | 0.0° |
| O1 | C1 | C6 | H3 | 1.7° | 0.2° |
| C1 | O1 | C7 | H4 | 180.0° | 60.0° |
| C1 | O1 | C7 | H5 | 60.0° | 59.9° |
| C1 | O1 | C7 | H6 | 60.0° | 180.0° |
| O1 | C7 | H4 | H5 | 120.0° | 120.0° |
| O1 | C7 | H4 | H6 | 120.0° | 120.0° |
| O1 | C7 | H5 | H6 | 120.0° | 120.1° |
| H1 | C2 | C3 | H2 | 0.2° | 0.0° |
| H29 | N4 | C14 | H13 | 68.0° | 175.0° |
| H29 | N4 | C14 | H14 | 173.8° | 65.0° |
| H29 | N4 | C15 | H15 | 71.3° | 179.9° |
| H29 | N4 | C16 | H17 | 62.0° | 180.0° |
| H29 | N4 | C16 | H18 | 178.0° | 60.0° |
| H29 | N4 | C16 | H16 | 58.0° | 60.1° |
| H4 | C7 | H5 | H6 | 120.0° | 120.0° |
| H10 | C12 | C13 | H12 | 58.6° | 180.0° |
| H10 | C12 | C13 | H11 | 59.9° | 59.9° |
| H9 | C12 | C13 | H12 | 177.3° | 60.0° |
| H9 | C12 | C13 | H11 | 58.9° | 180.0° |
| H12 | C13 | C14 | H13 | 171.4° | 60.0° |
| H12 | C13 | C14 | H14 | 70.5° | 180.0° |
| H11 | C13 | C14 | H13 | 70.2° | 180.0° |
| H11 | C13 | C14 | H14 | 48.0° | 60.0° |
| H15 | C15 | C17 | H19 | 179.1° | 180.0° |
| H15 | C15 | C17 | H20 | 61.5° | 60.0° |
| H15 | C15 | C21 | H27 | 179.9° | 60.1° |
| H15 | C15 | C21 | H28 | 60.5° | 180.0° |
| H17 | C16 | H18 | H16 | 120.0° | 119.9° |
| H19 | C17 | C18 | H22 | 175.3° | 60.0° |
| H19 | C17 | C18 | H21 | 55.9° | 180.0° |
| H20 | C17 | C18 | H22 | 55.8° | 60.0° |
| H20 | C17 | C18 | H21 | 63.6° | 60.0° |
| H22 | C18 | C19 | H24 | 54.8° | 60.0° |
| H22 | C18 | C19 | H23 | 174.2° | 60.1° |
| H21 | C18 | C19 | H24 | 64.6° | 179.9° |
| H21 | C18 | C19 | H23 | 54.8° | 60.0° |
| H24 | C19 | C20 | H26 | 53.8° | 60.0° |
| H24 | C19 | C20 | H25 | 65.5° | 179.9° |
| H23 | C19 | C20 | H26 | 173.1° | 60.0° |
| H23 | C19 | C20 | H25 | 53.9° | 60.0° |
| H26 | C20 | C21 | H27 | 173.1° | 59.9° |
| H26 | C20 | C21 | H28 | 53.8° | 60.0° |
| H25 | C20 | C21 | H27 | 53.8° | 60.0° |
| H25 | C20 | C21 | H28 | 65.5° | 180.0° |
