A1AR4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.56Å | |
| C1 | C4 | sing | 1.54Å | 1.52Å | |
| C1 | C13 | sing | 1.52Å | 1.56Å | |
| C1 | C15 | sing | 1.52Å | 1.56Å | |
| C2 | N1 | sing | 1.48Å | 1.48Å | |
| N1 | C3 | sing | 1.47Å | 1.45Å | |
| N1 | C16 | sing | 1.35Å | 1.45Å | |
| C3 | C4 | sing | 1.55Å | 1.51Å | |
| C3 | C5 | sing | 1.51Å | 1.54Å | |
| C5 | O1 | doub | 1.21Å | 1.20Å | |
| C5 | N2 | sing | 1.35Å | 1.45Å | |
| C6 | C7 | sing | 1.53Å | 1.53Å | |
| C6 | O3 | sing | 1.43Å | 1.41Å | |
| N2 | C7 | sing | 1.46Å | 1.45Å | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| C8 | C9 | sing | 1.53Å | 1.56Å | |
| C9 | C10 | sing | 1.51Å | 1.50Å | |
| C9 | C11 | sing | 1.54Å | 1.48Å | |
| C10 | O2 | doub | 1.21Å | 1.17Å | |
| C10 | N3 | sing | 1.34Å | 1.49Å | |
| N3 | C12 | sing | 1.47Å | 1.55Å | |
| C11 | C12 | sing | 1.55Å | 1.55Å | |
| C13 | C14 | sing | 1.54Å | 1.50Å | |
| C14 | C15 | sing | 1.54Å | 1.50Å | |
| C16 | O4 | doub | 1.22Å | 1.19Å | |
| C16 | O5 | sing | 1.35Å | 1.40Å | |
| O5 | C17 | sing | 1.45Å | 1.40Å | |
| C17 | C18 | sing | 1.51Å | 1.53Å | |
| C18 | C19 | doub | 1.38Å | 1.53Å | Aromatic |
| C18 | C23 | sing | 1.38Å | 1.32Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.32Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.53Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.32Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.53Å | Aromatic |
| N3 | H13 | sing | 0.97Å | 1.00Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.08Å | 1.08Å | |
| C21 | H29 | sing | 1.08Å | 1.08Å | |
| C22 | H30 | sing | 1.08Å | 1.08Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.08Å | 1.08Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| N2 | H8 | sing | 0.97Å | 1.00Å | |
| O3 | H18 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C4 | 100.3° | 103.5° |
| C2 | C1 | C13 | 110.4° | 116.4° |
| C2 | C1 | C15 | 120.1° | 116.4° |
| C1 | C2 | N1 | 101.3° | 104.7° |
| C1 | C2 | H1 | 111.5° | 110.4° |
| C1 | C2 | H2 | 111.5° | 110.4° |
| C4 | C1 | C13 | 109.2° | 116.3° |
| C4 | C1 | C15 | 128.2° | 116.0° |
| C1 | C4 | C3 | 101.9° | 102.8° |
| C1 | C4 | H5 | 111.3° | 110.8° |
| C1 | C4 | H4 | 111.3° | 110.7° |
| C13 | C1 | C15 | 86.9° | 88.6° |
| C1 | C13 | C14 | 90.6° | 86.6° |
| C1 | C13 | H19 | 114.0° | 113.7° |
| C1 | C13 | H20 | 114.0° | 113.8° |
| C1 | C15 | C14 | 90.7° | 86.6° |
| C1 | C15 | H24 | 113.9° | 113.7° |
| C1 | C15 | H23 | 113.9° | 113.7° |
| C2 | N1 | C3 | 108.8° | 108.8° |
| C2 | N1 | C16 | 126.2° | 125.6° |
| N1 | C2 | H1 | 111.5° | 110.3° |
| N1 | C2 | H2 | 111.5° | 110.4° |
| C3 | N1 | C16 | 125.0° | 125.6° |
| N1 | C3 | C4 | 107.1° | 107.4° |
| N1 | C3 | C5 | 110.5° | 109.9° |
| N1 | C3 | H3 | 111.0° | 109.9° |
| N1 | C16 | O4 | 120.3° | 120.0° |
| N1 | C16 | O5 | 117.6° | 120.0° |
| C4 | C3 | C5 | 108.2° | 109.8° |
| C3 | C4 | H5 | 111.3° | 111.0° |
| C3 | C4 | H4 | 111.3° | 110.6° |
| C4 | C3 | H3 | 110.2° | 109.9° |
| C3 | C5 | O1 | 120.5° | 120.0° |
| C3 | C5 | N2 | 117.8° | 120.0° |
| C5 | C3 | H3 | 109.7° | 110.0° |
| O1 | C5 | N2 | 121.6° | 120.0° |
| C5 | N2 | C7 | 122.1° | 120.0° |
| C5 | N2 | H8 | 118.9° | 120.0° |
| C7 | C6 | O3 | 111.3° | 109.4° |
| C6 | C7 | N2 | 104.2° | 109.5° |
| C6 | C7 | C8 | 108.2° | 109.5° |
| C7 | C6 | H7 | 109.0° | 109.5° |
| C7 | C6 | H6 | 109.0° | 109.5° |
| C6 | C7 | H9 | 110.6° | 109.4° |
| O3 | C6 | H7 | 109.0° | 109.4° |
| O3 | C6 | H6 | 109.0° | 109.5° |
| C6 | O3 | H18 | 109.5° | 113.9° |
| N2 | C7 | C8 | 111.2° | 109.5° |
| N2 | C7 | H9 | 111.8° | 109.5° |
| C7 | N2 | H8 | 119.0° | 120.0° |
| C7 | C8 | C9 | 111.3° | 109.5° |
| C8 | C7 | H9 | 110.6° | 109.5° |
| C7 | C8 | H11 | 109.0° | 109.5° |
| C7 | C8 | H10 | 109.0° | 109.5° |
| C8 | C9 | C10 | 107.3° | 110.5° |
| C8 | C9 | C11 | 110.7° | 110.2° |
| C9 | C8 | H11 | 109.0° | 109.5° |
| C9 | C8 | H10 | 109.0° | 109.4° |
| C8 | C9 | H12 | 109.9° | 110.4° |
| C10 | C9 | C11 | 106.9° | 104.3° |
| C9 | C10 | O2 | 126.1° | 124.9° |
| C9 | C10 | N3 | 108.2° | 110.1° |
| C10 | C9 | H12 | 110.8° | 110.5° |
| C9 | C11 | C12 | 105.6° | 101.9° |
| C9 | C11 | H15 | 110.4° | 110.5° |
| C9 | C11 | H14 | 110.4° | 111.3° |
| C11 | C9 | H12 | 111.0° | 110.8° |
| O2 | C10 | N3 | 125.7° | 124.9° |
| C10 | N3 | C12 | 107.1° | 111.3° |
| C10 | N3 | H13 | 126.4° | 124.4° |
| N3 | C12 | C11 | 103.8° | 105.5° |
| C12 | N3 | H13 | 126.4° | 124.3° |
| N3 | C12 | H17 | 110.9° | 110.3° |
| N3 | C12 | H16 | 110.9° | 110.2° |
| C12 | C11 | H15 | 110.4° | 110.9° |
| C12 | C11 | H14 | 110.4° | 111.0° |
| C11 | C12 | H17 | 110.9° | 110.3° |
| C11 | C12 | H16 | 110.9° | 110.2° |
| C13 | C14 | C15 | 91.4° | 87.4° |
| C14 | C13 | H19 | 114.0° | 113.7° |
| C14 | C13 | H20 | 113.9° | 113.6° |
| C13 | C14 | H21 | 113.8° | 113.6° |
| C13 | C14 | H22 | 113.8° | 113.6° |
| C14 | C15 | H24 | 113.9° | 113.6° |
| C14 | C15 | H23 | 113.9° | 113.8° |
| C15 | C14 | H21 | 113.8° | 113.6° |
| C15 | C14 | H22 | 113.8° | 113.6° |
| O4 | C16 | O5 | 122.1° | 120.0° |
| C16 | O5 | C17 | 114.6° | 117.0° |
| O5 | C17 | C18 | 106.6° | 109.5° |
| O5 | C17 | H26 | 110.2° | 109.5° |
| O5 | C17 | H25 | 110.2° | 109.5° |
| C17 | C18 | C19 | 119.6° | 120.0° |
| C17 | C18 | C23 | 120.0° | 120.0° |
| C18 | C17 | H26 | 110.2° | 109.5° |
| C18 | C17 | H25 | 110.2° | 109.5° |
| C19 | C18 | C23 | 120.4° | 120.0° |
| C18 | C19 | C20 | 120.3° | 120.0° |
| C18 | C19 | H27 | 119.9° | 120.0° |
| C18 | C23 | C22 | 119.2° | 119.9° |
| C18 | C23 | H31 | 120.4° | 120.0° |
| C19 | C20 | C21 | 119.5° | 120.0° |
| C19 | C20 | H28 | 120.2° | 120.0° |
| C20 | C19 | H27 | 119.9° | 120.0° |
| C20 | C21 | C22 | 119.8° | 120.0° |
| C21 | C20 | H28 | 120.2° | 120.0° |
| C20 | C21 | H29 | 120.1° | 120.0° |
| C21 | C22 | C23 | 120.8° | 120.0° |
| C22 | C21 | H29 | 120.1° | 120.0° |
| C21 | C22 | H30 | 119.6° | 120.0° |
| C23 | C22 | H30 | 119.6° | 120.0° |
| C22 | C23 | H31 | 120.4° | 120.1° |
| H5 | C4 | H4 | 109.5° | 110.7° |
| H7 | C6 | H6 | 109.5° | 109.5° |
| H11 | C8 | H10 | 109.5° | 109.5° |
| H19 | C13 | H20 | 109.5° | 113.0° |
| H24 | C15 | H23 | 109.5° | 112.9° |
| H26 | C17 | H25 | 109.5° | 109.5° |
| H15 | C11 | H14 | 109.5° | 110.9° |
| H17 | C12 | H16 | 109.5° | 110.3° |
| H21 | C14 | H22 | 109.5° | 112.9° |
| H1 | C2 | H2 | 109.4° | 110.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C4 | C13 | 116.0° | 129.0° |
| C2 | C1 | C4 | C15 | 142.4° | 128.8° |
| C2 | C1 | C13 | C15 | 121.1° | 119.0° |
| C1 | C2 | N1 | H1 | 118.7° | 118.8° |
| C1 | C2 | N1 | H2 | 118.7° | 118.8° |
| C1 | C2 | N1 | C3 | 25.7° | 22.6° |
| C1 | C2 | N1 | C16 | 154.0° | 157.7° |
| C2 | C1 | C4 | C3 | 42.9° | 33.5° |
| C2 | C1 | C13 | C14 | 116.7° | 143.6° |
| C2 | C1 | C15 | C14 | 107.5° | 143.6° |
| C2 | C1 | C4 | H5 | 161.6° | 152.1° |
| C2 | C1 | C4 | H4 | 75.9° | 84.6° |
| C2 | C1 | C13 | H19 | 0.0° | 29.2° |
| C2 | C1 | C13 | H20 | 126.7° | 102.0° |
| C2 | C1 | C15 | H24 | 135.8° | 102.0° |
| C2 | C1 | C15 | H23 | 9.2° | 29.1° |
| C1 | C2 | H1 | H2 | 123.8° | 122.5° |
| C4 | C1 | C13 | C15 | 129.6° | 118.5° |
| C4 | C1 | C2 | N1 | 42.1° | 35.0° |
| C1 | C4 | C3 | N1 | 28.4° | 20.5° |
| C1 | C4 | C3 | H5 | 118.8° | 118.5° |
| C1 | C4 | C3 | H4 | 118.8° | 118.2° |
| C1 | C4 | C3 | C5 | 147.6° | 139.9° |
| C4 | C1 | C13 | C14 | 133.9° | 93.9° |
| C4 | C1 | C15 | C14 | 116.4° | 94.2° |
| C1 | C4 | H5 | H4 | 123.5° | 123.3° |
| C4 | C1 | C13 | H19 | 109.4° | 151.7° |
| C4 | C1 | C13 | H20 | 17.3° | 20.5° |
| C4 | C1 | C15 | H24 | 0.3° | 20.2° |
| C4 | C1 | C15 | H23 | 126.8° | 151.3° |
| C4 | C1 | C2 | H1 | 76.5° | 153.7° |
| C4 | C1 | C2 | H2 | 160.8° | 83.8° |
| C1 | C4 | C3 | H3 | 92.4° | 99.0° |
| C13 | C1 | C2 | N1 | 157.2° | 163.9° |
| C13 | C1 | C4 | C3 | 158.9° | 162.5° |
| C1 | C13 | C14 | H19 | 116.7° | 114.4° |
| C1 | C13 | C14 | H20 | 116.7° | 114.5° |
| C13 | C1 | C15 | C14 | 4.4° | 24.6° |
| C13 | C1 | C4 | H5 | 82.3° | 78.9° |
| C13 | C1 | C4 | H4 | 40.1° | 44.4° |
| C1 | C13 | H19 | H20 | 129.0° | 131.6° |
| C13 | C1 | C15 | H24 | 112.3° | 139.0° |
| C13 | C1 | C15 | H23 | 121.1° | 89.9° |
| C1 | C13 | C14 | H21 | 112.3° | 138.9° |
| C1 | C13 | C14 | H22 | 121.4° | 90.3° |
| C13 | C1 | C2 | H1 | 38.5° | 77.3° |
| C13 | C1 | C2 | H2 | 84.1° | 45.1° |
| C15 | C1 | C2 | N1 | 104.2° | 93.5° |
| C15 | C1 | C4 | C3 | 99.5° | 95.3° |
| C1 | C15 | C14 | H24 | 116.7° | 114.5° |
| C1 | C15 | C14 | H23 | 116.7° | 114.4° |
| C15 | C1 | C4 | H5 | 19.3° | 23.3° |
| C15 | C1 | C4 | H4 | 141.7° | 146.6° |
| C15 | C1 | C13 | H19 | 121.0° | 89.8° |
| C15 | C1 | C13 | H20 | 112.3° | 139.0° |
| C1 | C15 | H24 | H23 | 128.9° | 131.5° |
| C1 | C15 | C14 | H21 | 112.3° | 139.0° |
| C1 | C15 | C14 | H22 | 121.4° | 90.3° |
| C15 | C1 | C2 | H1 | 137.1° | 25.2° |
| C15 | C1 | C2 | H2 | 14.5° | 147.7° |
| C2 | N1 | C3 | C16 | 179.6° | 179.7° |
| C2 | N1 | C3 | C4 | 1.2° | 1.2° |
| C2 | N1 | C3 | C5 | 118.9° | 118.2° |
| C2 | N1 | C16 | O4 | 173.7° | 179.7° |
| C2 | N1 | C16 | O5 | 5.8° | 0.3° |
| N1 | C2 | H1 | H2 | 123.8° | 122.3° |
| C2 | N1 | C3 | H3 | 119.2° | 120.7° |
| N1 | C3 | C4 | C5 | 119.2° | 119.4° |
| N1 | C3 | C4 | H3 | 120.9° | 119.5° |
| N1 | C3 | C5 | H3 | 122.8° | 121.1° |
| N1 | C3 | C5 | O1 | 40.8° | 18.5° |
| N1 | C3 | C5 | N2 | 140.1° | 161.4° |
| C3 | N1 | C16 | O4 | 6.7° | 0.0° |
| C3 | N1 | C16 | O5 | 173.8° | 180.0° |
| N1 | C3 | C4 | H5 | 147.2° | 139.0° |
| N1 | C3 | C4 | H4 | 90.3° | 97.8° |
| C3 | N1 | C2 | H1 | 93.0° | 141.3° |
| C3 | N1 | C2 | H2 | 144.3° | 96.3° |
| C16 | N1 | C3 | C4 | 179.2° | 179.1° |
| C16 | N1 | C3 | C5 | 61.5° | 61.6° |
| N1 | C16 | O4 | O5 | 179.5° | 180.0° |
| N1 | C16 | O5 | C17 | 147.3° | 180.0° |
| C16 | N1 | C2 | H1 | 87.3° | 38.9° |
| C16 | N1 | C2 | H2 | 35.3° | 83.5° |
| C16 | N1 | C3 | H3 | 60.5° | 59.6° |
| C4 | C3 | C5 | H3 | 120.2° | 121.0° |
| C4 | C3 | C5 | O1 | 76.2° | 99.4° |
| C4 | C3 | C5 | N2 | 102.9° | 80.7° |
| C3 | C4 | H5 | H4 | 123.5° | 123.2° |
| C3 | C5 | O1 | N2 | 179.1° | 179.9° |
| C3 | C5 | N2 | C7 | 177.7° | 180.0° |
| C5 | C3 | C4 | H5 | 93.6° | 101.6° |
| C5 | C3 | C4 | H4 | 28.9° | 21.6° |
| C3 | C5 | N2 | H8 | 2.3° | 0.1° |
| O1 | C5 | N2 | C7 | 1.4° | 0.1° |
| O1 | C5 | C3 | H3 | 163.6° | 139.6° |
| O1 | C5 | N2 | H8 | 178.6° | 180.0° |
| C5 | N2 | C7 | C6 | 124.5° | 84.9° |
| C5 | N2 | C7 | H8 | 180.0° | 179.9° |
| C5 | N2 | C7 | C8 | 119.1° | 155.1° |
| C5 | N2 | C7 | H9 | 5.1° | 35.0° |
| N2 | C5 | C3 | H3 | 17.3° | 40.3° |
| C7 | C6 | O3 | H7 | 120.3° | 120.0° |
| C7 | C6 | O3 | H6 | 120.3° | 120.0° |
| C6 | C7 | N2 | C8 | 116.4° | 120.0° |
| C6 | C7 | N2 | H9 | 119.5° | 119.9° |
| C6 | C7 | C8 | H9 | 121.3° | 120.0° |
| C6 | C7 | C8 | C9 | 171.6° | 175.0° |
| C7 | C6 | H7 | H6 | 119.2° | 120.1° |
| C6 | C7 | C8 | H11 | 68.2° | 65.1° |
| C6 | C7 | C8 | H10 | 51.3° | 55.0° |
| C6 | C7 | N2 | H8 | 55.5° | 95.0° |
| C7 | C6 | O3 | H18 | 180.0° | 180.0° |
| O3 | C6 | C7 | N2 | 163.4° | 65.0° |
| O3 | C6 | C7 | C8 | 78.2° | 55.0° |
| O3 | C6 | H7 | H6 | 119.2° | 120.0° |
| O3 | C6 | C7 | H9 | 43.0° | 175.0° |
| N2 | C7 | C8 | H9 | 124.8° | 120.0° |
| N2 | C7 | C8 | C9 | 74.5° | 65.0° |
| N2 | C7 | C6 | H7 | 76.4° | 54.9° |
| N2 | C7 | C6 | H6 | 43.1° | 175.0° |
| N2 | C7 | C8 | H11 | 45.7° | 55.0° |
| N2 | C7 | C8 | H10 | 165.2° | 175.0° |
| C7 | C8 | C9 | H11 | 120.3° | 120.0° |
| C7 | C8 | C9 | H10 | 120.2° | 120.0° |
| C7 | C8 | C9 | C10 | 177.9° | 66.5° |
| C7 | C8 | C9 | C11 | 61.6° | 178.8° |
| C8 | C7 | C6 | H7 | 42.1° | 174.9° |
| C8 | C7 | C6 | H6 | 161.5° | 65.0° |
| C7 | C8 | H11 | H10 | 119.2° | 120.1° |
| C7 | C8 | C9 | H12 | 61.5° | 56.1° |
| C8 | C7 | N2 | H8 | 60.9° | 25.1° |
| C8 | C9 | C10 | C11 | 118.8° | 118.4° |
| C8 | C9 | C10 | H12 | 120.0° | 122.5° |
| C8 | C9 | C11 | H12 | 122.4° | 122.5° |
| C8 | C9 | C10 | O2 | 43.8° | 77.6° |
| C8 | C9 | C10 | N3 | 136.5° | 102.4° |
| C8 | C9 | C11 | C12 | 145.1° | 94.2° |
| C9 | C8 | C7 | H9 | 50.3° | 55.0° |
| C9 | C8 | H11 | H10 | 119.2° | 120.0° |
| C8 | C9 | C11 | H15 | 25.7° | 147.9° |
| C8 | C9 | C11 | H14 | 95.5° | 24.2° |
| C10 | C9 | C11 | H12 | 121.0° | 118.9° |
| C9 | C10 | O2 | N3 | 179.7° | 180.0° |
| C9 | C10 | N3 | C12 | 0.4° | 0.4° |
| C10 | C9 | C11 | C12 | 28.5° | 24.4° |
| C9 | C10 | N3 | H13 | 179.6° | 179.3° |
| C10 | C9 | C8 | H11 | 61.8° | 53.5° |
| C10 | C9 | C8 | H10 | 57.7° | 173.5° |
| C10 | C9 | C11 | H15 | 90.9° | 93.6° |
| C10 | C9 | C11 | H14 | 147.9° | 142.7° |
| C11 | C9 | C10 | O2 | 162.6° | 164.0° |
| C11 | C9 | C10 | N3 | 17.6° | 16.0° |
| C9 | C11 | C12 | N3 | 28.0° | 25.0° |
| C9 | C11 | C12 | H15 | 119.4° | 117.7° |
| C9 | C11 | C12 | H14 | 119.4° | 118.6° |
| C11 | C9 | C8 | H11 | 178.1° | 61.2° |
| C11 | C9 | C8 | H10 | 58.6° | 58.8° |
| C9 | C11 | H15 | H14 | 121.8° | 123.9° |
| C9 | C11 | C12 | H17 | 91.1° | 144.0° |
| C9 | C11 | C12 | H16 | 147.1° | 94.0° |
| O2 | C10 | N3 | C12 | 179.3° | 179.6° |
| O2 | C10 | N3 | H13 | 0.7° | 0.6° |
| O2 | C10 | C9 | H12 | 76.3° | 44.9° |
| C10 | N3 | C12 | H13 | 180.0° | 179.8° |
| C10 | N3 | C12 | C11 | 17.3° | 16.7° |
| C10 | N3 | C12 | H17 | 101.8° | 135.8° |
| C10 | N3 | C12 | H16 | 136.3° | 102.2° |
| N3 | C10 | C9 | H12 | 103.5° | 135.1° |
| N3 | C12 | C11 | H17 | 119.1° | 119.0° |
| N3 | C12 | C11 | H16 | 119.1° | 119.0° |
| N3 | C12 | C11 | H15 | 91.4° | 92.7° |
| N3 | C12 | C11 | H14 | 147.4° | 143.6° |
| N3 | C12 | H17 | H16 | 122.7° | 122.0° |
| C11 | C12 | N3 | H13 | 162.7° | 163.0° |
| C12 | C11 | H15 | H14 | 121.8° | 123.8° |
| C11 | C12 | H17 | H16 | 122.6° | 121.9° |
| C12 | C11 | C9 | H12 | 92.5° | 143.3° |
| C13 | C14 | C15 | H21 | 116.8° | 114.6° |
| C13 | C14 | C15 | H22 | 116.8° | 114.6° |
| C14 | C13 | H19 | H20 | 128.9° | 131.4° |
| C13 | C14 | C15 | H24 | 112.2° | 138.8° |
| C13 | C14 | C15 | H23 | 121.2° | 90.1° |
| C13 | C14 | H21 | H22 | 128.5° | 131.1° |
| C15 | C14 | C13 | H19 | 121.2° | 90.1° |
| C15 | C14 | C13 | H20 | 112.1° | 138.9° |
| C14 | C15 | H24 | H23 | 128.9° | 131.5° |
| C15 | C14 | H21 | H22 | 128.6° | 131.1° |
| O4 | C16 | O5 | C17 | 32.2° | 0.1° |
| C16 | O5 | C17 | C18 | 146.4° | 180.0° |
| C16 | O5 | C17 | H26 | 94.1° | 60.1° |
| C16 | O5 | C17 | H25 | 26.8° | 59.9° |
| O5 | C17 | C18 | H26 | 119.5° | 120.0° |
| O5 | C17 | C18 | H25 | 119.5° | 120.0° |
| O5 | C17 | C18 | C19 | 75.1° | 90.0° |
| O5 | C17 | C18 | C23 | 104.4° | 89.4° |
| O5 | C17 | H26 | H25 | 121.3° | 120.0° |
| C17 | C18 | C19 | C23 | 179.5° | 179.5° |
| C17 | C18 | C19 | C20 | 179.9° | 179.9° |
| C17 | C18 | C23 | C22 | 179.2° | 179.7° |
| C18 | C17 | H26 | H25 | 121.3° | 120.0° |
| C17 | C18 | C19 | H27 | 0.1° | 0.6° |
| C17 | C18 | C23 | H31 | 0.8° | 0.2° |
| C18 | C19 | C20 | H27 | 180.0° | 179.4° |
| C18 | C19 | C20 | C21 | 0.2° | 0.0° |
| C19 | C18 | C23 | C22 | 1.3° | 0.8° |
| C19 | C18 | C17 | H26 | 165.4° | 150.0° |
| C19 | C18 | C17 | H25 | 44.4° | 30.0° |
| C18 | C19 | C20 | H28 | 179.8° | 179.8° |
| C19 | C18 | C23 | H31 | 178.7° | 179.7° |
| C23 | C18 | C19 | C20 | 0.4° | 0.6° |
| C18 | C23 | C22 | C21 | 2.0° | 0.5° |
| C18 | C23 | C22 | H31 | 180.0° | 179.5° |
| C23 | C18 | C17 | H26 | 15.1° | 30.5° |
| C23 | C18 | C17 | H25 | 136.1° | 150.5° |
| C18 | C23 | C22 | H30 | 178.0° | 179.5° |
| C23 | C18 | C19 | H27 | 179.6° | 180.0° |
| C19 | C20 | C21 | H28 | 180.0° | 179.8° |
| C19 | C20 | C21 | C22 | 0.9° | 0.2° |
| C19 | C20 | C21 | H29 | 179.1° | 179.8° |
| C20 | C21 | C22 | H29 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 1.8° | 0.0° |
| C20 | C21 | C22 | H30 | 178.2° | 180.0° |
| C21 | C20 | C19 | H27 | 179.8° | 179.4° |
| C21 | C22 | C23 | H30 | 180.0° | 180.0° |
| C22 | C21 | C20 | H28 | 179.1° | 180.0° |
| C21 | C22 | C23 | H31 | 178.0° | 180.0° |
| C23 | C22 | C21 | H29 | 178.2° | 180.0° |
| H13 | N3 | C12 | H17 | 78.2° | 44.0° |
| H13 | N3 | C12 | H16 | 43.6° | 78.0° |
| H5 | C4 | C3 | H3 | 26.3° | 19.5° |
| H4 | C4 | C3 | H3 | 148.8° | 142.8° |
| H7 | C6 | C7 | H9 | 163.3° | 65.0° |
| H7 | C6 | O3 | H18 | 59.7° | 60.0° |
| H6 | C6 | C7 | H9 | 77.2° | 55.1° |
| H6 | C6 | O3 | H18 | 59.7° | 60.0° |
| H9 | C7 | C8 | H11 | 170.6° | 175.0° |
| H9 | C7 | C8 | H10 | 69.9° | 65.0° |
| H9 | C7 | N2 | H8 | 175.0° | 145.1° |
| H11 | C8 | C9 | H12 | 58.8° | 176.0° |
| H10 | C8 | C9 | H12 | 178.3° | 63.9° |
| H19 | C13 | C14 | H21 | 4.4° | 24.5° |
| H19 | C13 | C14 | H22 | 121.9° | 155.3° |
| H20 | C13 | C14 | H21 | 131.0° | 106.5° |
| H20 | C13 | C14 | H22 | 4.7° | 24.2° |
| H24 | C15 | C14 | H21 | 131.0° | 106.6° |
| H24 | C15 | C14 | H22 | 4.7° | 24.2° |
| H23 | C15 | C14 | H21 | 4.4° | 24.5° |
| H23 | C15 | C14 | H22 | 121.9° | 155.3° |
| H28 | C20 | C21 | H29 | 0.9° | 0.0° |
| H28 | C20 | C19 | H27 | 0.2° | 0.4° |
| H29 | C21 | C22 | H30 | 1.8° | 0.0° |
| H30 | C22 | C23 | H31 | 2.0° | 0.0° |
| H15 | C11 | C12 | H17 | 149.5° | 26.4° |
| H15 | C11 | C12 | H16 | 27.7° | 148.4° |
| H15 | C11 | C9 | H12 | 148.1° | 25.3° |
| H14 | C11 | C12 | H17 | 28.3° | 97.4° |
| H14 | C11 | C12 | H16 | 93.5° | 24.6° |
| H14 | C11 | C9 | H12 | 26.9° | 98.4° |
