Q7Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N3 | C19 | sing | 1.37Å | 1.37Å | Aromatic |
| N3 | C20 | sing | 1.37Å | 1.36Å | Aromatic |
| C19 | C18 | doub | 1.34Å | 1.37Å | Aromatic |
| N4 | C20 | doub | 1.33Å | 1.34Å | Aromatic |
| N4 | C21 | sing | 1.32Å | 1.33Å | Aromatic |
| C20 | C23 | sing | 1.40Å | 1.42Å | Aromatic |
| C18 | C23 | sing | 1.47Å | 1.41Å | Aromatic |
| C18 | C17 | sing | 1.50Å | 1.57Å | |
| C21 | N5 | doub | 1.32Å | 1.33Å | Aromatic |
| C23 | C22 | doub | 1.41Å | 1.37Å | Aromatic |
| C16 | N2 | sing | 1.51Å | 1.47Å | |
| C17 | N2 | sing | 1.49Å | 1.45Å | |
| N5 | C22 | sing | 1.33Å | 1.34Å | Aromatic |
| C22 | N6 | sing | 1.35Å | 1.37Å | |
| N2 | C15 | sing | 1.50Å | 1.45Å | |
| N6 | C7 | sing | 1.38Å | 1.39Å | |
| C15 | C14 | sing | 1.52Å | 1.52Å | |
| C14 | C13 | sing | 1.53Å | 1.51Å | |
| C7 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.40Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.38Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | N1 | sing | 1.48Å | 1.46Å | |
| C5 | C4 | doub | 1.39Å | 1.38Å | Aromatic |
| C9 | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| C9 | O3 | sing | 1.36Å | 1.37Å | |
| C4 | O2 | sing | 1.36Å | 1.36Å | |
| N1 | C12 | sing | 1.47Å | 1.47Å | |
| N1 | C11 | sing | 1.36Å | 1.36Å | |
| C10 | O3 | sing | 1.44Å | 1.49Å | |
| C10 | C11 | sing | 1.51Å | 1.52Å | |
| C11 | O4 | doub | 1.22Å | 1.22Å | |
| O2 | C3 | sing | 1.43Å | 1.43Å | |
| C3 | C2 | sing | 1.53Å | 1.48Å | |
| C2 | O1 | sing | 1.43Å | 1.41Å | |
| O1 | C1 | sing | 1.43Å | 1.44Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C8 | H3 | sing | 1.08Å | 1.08Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| N3 | H10 | sing | 0.97Å | 1.00Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | 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 | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C1 | H17 | sing | 1.09Å | 1.10Å | |
| C1 | H18 | sing | 1.09Å | 1.10Å | |
| C1 | H19 | sing | 1.09Å | 1.10Å | |
| C2 | H20 | sing | 1.09Å | 1.10Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C17 | H27 | sing | 1.09Å | 1.10Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.08Å | 1.08Å | |
| C21 | H30 | sing | 1.08Å | 1.08Å | |
| N6 | H31 | sing | 0.98Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | N3 | C20 | 108.6° | 109.9° |
| N3 | C19 | C18 | 110.6° | 110.3° |
| C19 | N3 | H10 | 125.7° | 125.0° |
| N3 | C19 | H29 | 124.7° | 124.1° |
| N3 | C20 | N4 | 126.8° | 134.8° |
| N3 | C20 | C23 | 107.0° | 107.0° |
| C20 | N3 | H10 | 125.7° | 125.1° |
| C19 | C18 | C23 | 105.9° | 106.1° |
| C19 | C18 | C17 | 126.9° | 129.8° |
| C18 | C19 | H29 | 124.7° | 125.6° |
| C20 | N4 | C21 | 111.5° | 120.2° |
| N4 | C20 | C23 | 126.2° | 118.2° |
| N4 | C21 | N5 | 128.8° | 123.6° |
| N4 | C21 | H30 | 115.6° | 118.2° |
| C20 | C23 | C18 | 107.6° | 106.7° |
| C20 | C23 | C22 | 114.6° | 119.7° |
| C23 | C18 | C17 | 125.1° | 124.2° |
| C18 | C23 | C22 | 137.7° | 133.6° |
| C18 | C17 | N2 | 105.5° | 112.3° |
| C18 | C17 | H27 | 110.5° | 109.6° |
| C18 | C17 | H28 | 110.5° | 109.7° |
| C21 | N5 | C22 | 118.0° | 120.9° |
| N5 | C21 | H30 | 115.6° | 118.2° |
| C23 | C22 | N5 | 120.8° | 117.2° |
| C23 | C22 | N6 | 120.5° | 118.5° |
| C16 | N2 | C17 | 109.6° | 104.9° |
| C16 | N2 | C15 | 115.3° | 103.3° |
| N2 | C16 | H24 | 109.5° | 109.4° |
| N2 | C16 | H25 | 109.4° | 109.4° |
| N2 | C16 | H26 | 109.5° | 109.5° |
| C17 | N2 | C15 | 113.3° | 104.2° |
| N2 | C17 | H27 | 110.5° | 107.5° |
| N2 | C17 | H28 | 110.5° | 107.9° |
| N5 | C22 | N6 | 118.6° | 124.3° |
| C22 | N6 | C7 | 133.3° | 132.4° |
| C22 | N6 | H31 | 113.3° | 114.0° |
| N2 | C15 | C14 | 113.0° | 110.1° |
| N2 | C15 | H15 | 108.6° | 107.7° |
| N2 | C15 | H16 | 108.6° | 107.8° |
| N6 | C7 | C6 | 123.4° | 124.1° |
| N6 | C7 | C8 | 116.9° | 116.1° |
| C7 | N6 | H31 | 113.4° | 113.6° |
| C15 | C14 | C13 | 113.8° | 110.4° |
| C15 | C14 | H13 | 108.4° | 109.7° |
| C15 | C14 | H14 | 108.4° | 109.2° |
| C14 | C15 | H15 | 108.6° | 110.2° |
| C14 | C15 | H16 | 108.6° | 110.2° |
| C14 | C13 | N1 | 116.6° | 108.6° |
| C14 | C13 | H11 | 107.7° | 109.7° |
| C14 | C13 | H12 | 107.7° | 109.5° |
| C13 | C14 | H13 | 108.4° | 109.4° |
| C13 | C14 | H14 | 108.4° | 108.9° |
| C6 | C7 | C8 | 119.6° | 119.8° |
| C7 | C6 | C5 | 120.0° | 120.2° |
| C7 | C6 | H2 | 120.0° | 120.0° |
| C7 | C8 | C9 | 120.3° | 119.8° |
| C7 | C8 | H3 | 119.9° | 119.6° |
| C6 | C5 | C4 | 120.7° | 120.2° |
| C6 | C5 | H1 | 119.7° | 119.9° |
| C5 | C6 | H2 | 120.0° | 119.8° |
| C8 | C9 | C4 | 119.7° | 120.4° |
| C8 | C9 | O3 | 124.0° | 119.6° |
| C9 | C8 | H3 | 119.8° | 120.6° |
| C13 | N1 | C12 | 114.9° | 122.3° |
| C13 | N1 | C11 | 123.8° | 114.4° |
| N1 | C13 | H11 | 107.7° | 109.6° |
| N1 | C13 | H12 | 107.7° | 109.8° |
| C5 | C4 | C9 | 119.7° | 119.7° |
| C5 | C4 | O2 | 124.5° | 120.1° |
| C4 | C5 | H1 | 119.6° | 119.9° |
| C4 | C9 | O3 | 116.3° | 119.9° |
| C9 | C4 | O2 | 115.8° | 120.2° |
| C9 | O3 | C10 | 118.3° | 114.9° |
| C4 | O2 | C3 | 118.9° | 117.0° |
| C12 | N1 | C11 | 121.2° | 123.3° |
| N1 | C12 | H7 | 109.5° | 109.5° |
| N1 | C12 | H8 | 109.5° | 109.4° |
| N1 | C12 | H9 | 109.4° | 109.4° |
| N1 | C11 | C10 | 122.3° | 119.4° |
| N1 | C11 | O4 | 121.6° | 120.5° |
| O3 | C10 | C11 | 111.3° | 107.6° |
| O3 | C10 | H5 | 109.0° | 109.1° |
| O3 | C10 | H6 | 109.0° | 109.7° |
| C10 | C11 | O4 | 116.1° | 120.1° |
| C11 | C10 | H5 | 109.0° | 110.3° |
| C11 | C10 | H6 | 109.0° | 110.1° |
| O2 | C3 | C2 | 109.4° | 109.5° |
| O2 | C3 | H22 | 109.5° | 109.5° |
| O2 | C3 | H23 | 109.5° | 109.5° |
| C3 | C2 | O1 | 110.1° | 109.5° |
| C3 | C2 | H20 | 109.3° | 109.5° |
| C3 | C2 | H21 | 109.3° | 109.5° |
| C2 | C3 | H22 | 109.5° | 109.5° |
| C2 | C3 | H23 | 109.5° | 109.5° |
| C2 | O1 | C1 | 113.0° | 114.0° |
| O1 | C2 | H20 | 109.3° | 109.4° |
| O1 | C2 | H21 | 109.3° | 109.5° |
| O1 | C1 | H17 | 109.5° | 109.5° |
| O1 | C1 | H18 | 109.5° | 109.5° |
| O1 | C1 | H19 | 109.5° | 109.5° |
| H5 | C10 | H6 | 109.5° | 110.0° |
| H7 | C12 | H8 | 109.5° | 109.6° |
| H7 | C12 | H9 | 109.5° | 109.5° |
| H8 | C12 | H9 | 109.5° | 109.5° |
| H11 | C13 | H12 | 109.4° | 109.5° |
| H13 | C14 | H14 | 109.5° | 109.1° |
| H15 | C15 | H16 | 109.5° | 110.7° |
| H17 | C1 | H18 | 109.4° | 109.5° |
| H17 | C1 | H19 | 109.5° | 109.5° |
| H18 | C1 | H19 | 109.5° | 109.4° |
| H20 | C2 | H21 | 109.5° | 109.5° |
| H22 | C3 | H23 | 109.4° | 109.5° |
| H24 | C16 | H25 | 109.4° | 109.5° |
| H24 | C16 | H26 | 109.5° | 109.5° |
| H25 | C16 | H26 | 109.5° | 109.5° |
| H27 | C17 | H28 | 109.4° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | N3 | C20 | H10 | 180.0° | 179.8° |
| N3 | C19 | C18 | H29 | 180.0° | 179.1° |
| C19 | N3 | C20 | N4 | 179.5° | 177.0° |
| C19 | N3 | C20 | C23 | 1.9° | 1.9° |
| N3 | C19 | C18 | C23 | 4.7° | 1.6° |
| N3 | C19 | C18 | C17 | 159.3° | 177.6° |
| C20 | N3 | C19 | C18 | 1.8° | 0.1° |
| N3 | C20 | N4 | C23 | 178.3° | 178.8° |
| N3 | C20 | N4 | C21 | 176.6° | 178.9° |
| N3 | C20 | C23 | C18 | 4.8° | 2.8° |
| N3 | C20 | C23 | C22 | 174.9° | 175.4° |
| C20 | N3 | C19 | H29 | 178.2° | 179.2° |
| C19 | C18 | C23 | C20 | 5.7° | 2.7° |
| C19 | C18 | C23 | C17 | 164.4° | 179.3° |
| C19 | C18 | C23 | C22 | 173.8° | 175.1° |
| C19 | C18 | C17 | N2 | 120.4° | 6.7° |
| C18 | C19 | N3 | H10 | 178.2° | 179.6° |
| C19 | C18 | C17 | H27 | 120.2° | 112.7° |
| C19 | C18 | C17 | H28 | 0.9° | 126.6° |
| N4 | C20 | C23 | C18 | 176.7° | 176.3° |
| C20 | N4 | C21 | N5 | 0.3° | 1.3° |
| N4 | C20 | C23 | C22 | 3.7° | 5.4° |
| N4 | C20 | N3 | H10 | 0.5° | 3.2° |
| C20 | N4 | C21 | H30 | 179.8° | 178.4° |
| C21 | N4 | C20 | C23 | 1.8° | 2.2° |
| N4 | C21 | N5 | H30 | 180.0° | 179.7° |
| N4 | C21 | N5 | C22 | 0.9° | 1.6° |
| C20 | C23 | C18 | C22 | 179.5° | 177.9° |
| C20 | C23 | C18 | C17 | 158.7° | 176.6° |
| C20 | C23 | C22 | N5 | 4.1° | 5.2° |
| C20 | C23 | C22 | N6 | 173.0° | 172.8° |
| C23 | C20 | N3 | H10 | 178.1° | 177.8° |
| C23 | C18 | C17 | N2 | 78.5° | 174.2° |
| C18 | C23 | C22 | N5 | 176.4° | 177.1° |
| C18 | C23 | C22 | N6 | 6.6° | 4.8° |
| C23 | C18 | C17 | H27 | 40.9° | 66.4° |
| C23 | C18 | C17 | H28 | 162.1° | 54.2° |
| C23 | C18 | C19 | H29 | 175.3° | 177.5° |
| C17 | C18 | C23 | C22 | 21.8° | 5.5° |
| C18 | C17 | N2 | C16 | 56.8° | 75.4° |
| C18 | C17 | N2 | H27 | 119.4° | 120.6° |
| C18 | C17 | N2 | H28 | 119.4° | 121.0° |
| C18 | C17 | N2 | C15 | 172.9° | 176.3° |
| C18 | C17 | H27 | H28 | 121.8° | 120.6° |
| C17 | C18 | C19 | H29 | 20.7° | 3.3° |
| C21 | N5 | C22 | C23 | 3.0° | 1.8° |
| C21 | N5 | C22 | N6 | 174.2° | 176.1° |
| C23 | C22 | N5 | N6 | 177.1° | 177.9° |
| C23 | C22 | N6 | C7 | 162.4° | 149.0° |
| C23 | C22 | N6 | H31 | 17.5° | 31.9° |
| C16 | N2 | C17 | C15 | 130.3° | 108.2° |
| C16 | N2 | C15 | C14 | 51.6° | 172.6° |
| C16 | N2 | C15 | H15 | 172.1° | 67.2° |
| C16 | N2 | C15 | H16 | 68.9° | 52.3° |
| N2 | C16 | H24 | H25 | 120.0° | 119.9° |
| N2 | C16 | H24 | H26 | 120.0° | 120.0° |
| N2 | C16 | H25 | H26 | 120.0° | 120.0° |
| C16 | N2 | C17 | H27 | 176.2° | 45.2° |
| C16 | N2 | C17 | H28 | 62.6° | 163.5° |
| C17 | N2 | C15 | C14 | 178.9° | 78.0° |
| C17 | N2 | C15 | H15 | 60.5° | 42.2° |
| C17 | N2 | C15 | H16 | 58.4° | 161.7° |
| C17 | N2 | C16 | H24 | 180.0° | 48.9° |
| C17 | N2 | C16 | H25 | 60.0° | 71.1° |
| C17 | N2 | C16 | H26 | 60.0° | 168.9° |
| N2 | C17 | H27 | H28 | 121.8° | 117.1° |
| N5 | C22 | N6 | C7 | 14.7° | 28.9° |
| C22 | N5 | C21 | H30 | 179.1° | 178.1° |
| N5 | C22 | N6 | H31 | 165.3° | 150.2° |
| C22 | N6 | C7 | H31 | 180.0° | 179.1° |
| C22 | N6 | C7 | C6 | 18.2° | 13.9° |
| C22 | N6 | C7 | C8 | 165.5° | 163.8° |
| N2 | C15 | C14 | H15 | 120.5° | 118.8° |
| N2 | C15 | C14 | H16 | 120.5° | 118.8° |
| N2 | C15 | C14 | C13 | 162.4° | 151.5° |
| N2 | C15 | C14 | H13 | 76.9° | 30.8° |
| N2 | C15 | C14 | H14 | 41.8° | 88.8° |
| N2 | C15 | H15 | H16 | 118.4° | 117.6° |
| C15 | N2 | C16 | H24 | 50.8° | 60.1° |
| C15 | N2 | C16 | H25 | 69.2° | 180.0° |
| C15 | N2 | C16 | H26 | 170.8° | 60.0° |
| C15 | N2 | C17 | H27 | 53.5° | 63.1° |
| C15 | N2 | C17 | H28 | 67.7° | 55.3° |
| N6 | C7 | C6 | C8 | 176.2° | 177.5° |
| N6 | C7 | C6 | C5 | 175.6° | 176.8° |
| N6 | C7 | C8 | C9 | 177.0° | 176.2° |
| N6 | C7 | C6 | H2 | 4.4° | 3.4° |
| N6 | C7 | C8 | H3 | 3.0° | 3.9° |
| C15 | C14 | C13 | H13 | 120.6° | 120.9° |
| C15 | C14 | C13 | H14 | 120.7° | 119.9° |
| C15 | C14 | C13 | N1 | 52.7° | 148.8° |
| C15 | C14 | C13 | H11 | 68.3° | 91.4° |
| C15 | C14 | C13 | H12 | 173.8° | 28.8° |
| C15 | C14 | H13 | H14 | 118.1° | 119.6° |
| C14 | C15 | H15 | H16 | 118.4° | 122.2° |
| C14 | C13 | N1 | H11 | 121.0° | 119.8° |
| C14 | C13 | N1 | H12 | 121.0° | 119.8° |
| C14 | C13 | N1 | C12 | 97.7° | 59.0° |
| C14 | C13 | N1 | C11 | 80.3° | 120.6° |
| C14 | C13 | H11 | H12 | 116.7° | 120.3° |
| C13 | C14 | H13 | H14 | 118.0° | 119.1° |
| C13 | C14 | C15 | H15 | 41.9° | 32.8° |
| C13 | C14 | C15 | H16 | 77.0° | 89.7° |
| C7 | C6 | C5 | H2 | 180.0° | 179.8° |
| C6 | C7 | C8 | C9 | 0.6° | 1.5° |
| C7 | C6 | C5 | C4 | 1.6° | 0.4° |
| C7 | C6 | C5 | H1 | 178.4° | 179.8° |
| C6 | C7 | C8 | H3 | 179.4° | 178.4° |
| C6 | C7 | N6 | H31 | 161.8° | 165.3° |
| C8 | C7 | C6 | C5 | 0.6° | 0.7° |
| C7 | C8 | C9 | H3 | 180.0° | 179.9° |
| C7 | C8 | C9 | C4 | 0.8° | 1.2° |
| C7 | C8 | C9 | O3 | 178.1° | 178.2° |
| C8 | C7 | C6 | H2 | 179.4° | 179.1° |
| C8 | C7 | N6 | H31 | 14.5° | 17.1° |
| C6 | C5 | C4 | H1 | 180.0° | 179.8° |
| C6 | C5 | C4 | C9 | 1.4° | 0.7° |
| C6 | C5 | C4 | O2 | 179.5° | 179.3° |
| C8 | C9 | C4 | C5 | 0.2° | 0.1° |
| C8 | C9 | C4 | O3 | 178.9° | 179.4° |
| C8 | C9 | C4 | O2 | 178.5° | 179.9° |
| C8 | C9 | O3 | C10 | 1.4° | 57.4° |
| C13 | N1 | C12 | C11 | 178.0° | 179.6° |
| C13 | N1 | C11 | C10 | 3.5° | 169.6° |
| C13 | N1 | C11 | O4 | 175.1° | 11.0° |
| C13 | N1 | C12 | H7 | 180.0° | 179.5° |
| C13 | N1 | C12 | H8 | 60.0° | 60.4° |
| C13 | N1 | C12 | H9 | 60.0° | 59.6° |
| N1 | C13 | H11 | H12 | 116.8° | 120.6° |
| N1 | C13 | C14 | H13 | 173.4° | 27.9° |
| N1 | C13 | C14 | H14 | 67.9° | 91.3° |
| C5 | C4 | C9 | O2 | 178.2° | 180.0° |
| C5 | C4 | C9 | O3 | 179.1° | 179.3° |
| C5 | C4 | O2 | C3 | 5.0° | 0.0° |
| C4 | C5 | C6 | H2 | 178.4° | 179.8° |
| C4 | C9 | O3 | C10 | 179.7° | 122.1° |
| C9 | C4 | O2 | C3 | 173.1° | 180.0° |
| C9 | C4 | C5 | H1 | 178.6° | 179.5° |
| C4 | C9 | C8 | H3 | 179.2° | 178.7° |
| O3 | C9 | C4 | O2 | 2.6° | 0.7° |
| C9 | O3 | C10 | C11 | 68.9° | 87.4° |
| O3 | C9 | C8 | H3 | 2.0° | 1.9° |
| C9 | O3 | C10 | H5 | 51.4° | 32.3° |
| C9 | O3 | C10 | H6 | 170.8° | 152.8° |
| C4 | O2 | C3 | C2 | 152.4° | 180.0° |
| O2 | C4 | C5 | H1 | 0.5° | 0.5° |
| C4 | O2 | C3 | H22 | 87.5° | 60.0° |
| C4 | O2 | C3 | H23 | 32.4° | 60.0° |
| C12 | N1 | C11 | C10 | 178.6° | 10.0° |
| C12 | N1 | C11 | O4 | 2.7° | 169.4° |
| N1 | C12 | H7 | H8 | 120.0° | 120.0° |
| N1 | C12 | H7 | H9 | 120.0° | 119.9° |
| N1 | C12 | H8 | H9 | 120.0° | 119.9° |
| C12 | N1 | C13 | H11 | 23.3° | 60.8° |
| C12 | N1 | C13 | H12 | 141.3° | 178.8° |
| N1 | C11 | C10 | O3 | 153.7° | 162.7° |
| N1 | C11 | C10 | O4 | 178.7° | 179.4° |
| N1 | C11 | C10 | H5 | 33.4° | 43.7° |
| N1 | C11 | C10 | H6 | 86.0° | 77.8° |
| C11 | N1 | C12 | H7 | 2.0° | 0.0° |
| C11 | N1 | C12 | H8 | 118.0° | 120.0° |
| C11 | N1 | C12 | H9 | 122.0° | 120.0° |
| C11 | N1 | C13 | H11 | 158.7° | 119.6° |
| C11 | N1 | C13 | H12 | 40.7° | 0.8° |
| O3 | C10 | C11 | H5 | 120.2° | 118.9° |
| O3 | C10 | C11 | H6 | 120.3° | 119.5° |
| O3 | C10 | C11 | O4 | 25.0° | 17.9° |
| O3 | C10 | H5 | H6 | 119.1° | 120.3° |
| C11 | C10 | H5 | H6 | 119.2° | 121.6° |
| O4 | C11 | C10 | H5 | 145.3° | 136.9° |
| O4 | C11 | C10 | H6 | 95.2° | 101.6° |
| O2 | C3 | C2 | H22 | 120.0° | 120.0° |
| O2 | C3 | C2 | H23 | 120.0° | 120.0° |
| O2 | C3 | C2 | O1 | 66.2° | 65.0° |
| O2 | C3 | C2 | H20 | 53.9° | 55.0° |
| O2 | C3 | C2 | H21 | 173.7° | 175.0° |
| O2 | C3 | H22 | H23 | 120.0° | 120.0° |
| C3 | C2 | O1 | H20 | 120.1° | 120.0° |
| C3 | C2 | O1 | H21 | 120.1° | 120.0° |
| C3 | C2 | O1 | C1 | 178.8° | 180.0° |
| C3 | C2 | H20 | H21 | 119.7° | 120.0° |
| C2 | C3 | H22 | H23 | 120.0° | 120.0° |
| C2 | O1 | C1 | H17 | 180.0° | 60.0° |
| C2 | O1 | C1 | H18 | 60.0° | 60.0° |
| C2 | O1 | C1 | H19 | 60.0° | 180.0° |
| O1 | C2 | H20 | H21 | 119.7° | 120.0° |
| O1 | C2 | C3 | H22 | 173.8° | 175.0° |
| O1 | C2 | C3 | H23 | 53.8° | 55.0° |
| O1 | C1 | H17 | H18 | 120.0° | 120.0° |
| O1 | C1 | H17 | H19 | 120.0° | 120.1° |
| O1 | C1 | H18 | H19 | 120.0° | 120.0° |
| C1 | O1 | C2 | H20 | 61.1° | 60.0° |
| C1 | O1 | C2 | H21 | 58.7° | 60.0° |
| H1 | C5 | C6 | H2 | 1.6° | 0.0° |
| H7 | C12 | H8 | H9 | 120.0° | 120.1° |
| H10 | N3 | C19 | H29 | 1.8° | 0.5° |
| H11 | C13 | C14 | H13 | 52.3° | 147.7° |
| H11 | C13 | C14 | H14 | 171.1° | 28.5° |
| H12 | C13 | C14 | H13 | 65.6° | 92.0° |
| H12 | C13 | C14 | H14 | 53.2° | 148.8° |
| H13 | C14 | C15 | H15 | 162.6° | 87.9° |
| H13 | C14 | C15 | H16 | 43.6° | 149.6° |
| H14 | C14 | C15 | H15 | 78.7° | 152.5° |
| H14 | C14 | C15 | H16 | 162.3° | 30.0° |
| H17 | C1 | H18 | H19 | 120.0° | 120.0° |
| H20 | C2 | C3 | H22 | 66.1° | 65.0° |
| H20 | C2 | C3 | H23 | 173.9° | 175.0° |
| H21 | C2 | C3 | H22 | 53.7° | 55.0° |
| H21 | C2 | C3 | H23 | 66.3° | 65.0° |
| H24 | C16 | H25 | H26 | 120.0° | 120.1° |
