XG5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | N4 | doub | 1.32Å | 1.36Å | |
| O5 | N4 | sing | 1.32Å | 1.45Å | |
| N4 | C14 | sing | 1.48Å | 1.47Å | |
| O1 | C1 | sing | 1.43Å | 1.50Å | |
| O2 | C2 | sing | 1.43Å | 1.46Å | |
| C2 | C1 | sing | 1.53Å | 1.44Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| O4 | C6 | sing | 1.43Å | 1.45Å | |
| C14 | C15 | doub | 1.35Å | 1.45Å | Aromatic |
| C14 | C13 | sing | 1.41Å | 1.37Å | Aromatic |
| C15 | C16 | sing | 1.48Å | 1.38Å | Aromatic |
| N3 | C13 | sing | 1.36Å | 1.46Å | |
| N3 | C12 | sing | 1.47Å | 1.50Å | |
| C1 | C4 | sing | 1.53Å | 1.47Å | |
| C13 | C18 | doub | 1.41Å | 1.38Å | Aromatic |
| C4 | O3 | sing | 1.43Å | 1.43Å | |
| C4 | C5 | sing | 1.53Å | 1.55Å | |
| N7 | N6 | doub | 1.12Å | 1.42Å | |
| C16 | N5 | sing | 1.30Å | 1.47Å | |
| C16 | C17 | doub | 1.48Å | 1.40Å | Aromatic |
| C3 | N1 | sing | 1.47Å | 1.50Å | |
| N1 | C5 | sing | 1.47Å | 1.43Å | |
| N1 | C7 | sing | 1.47Å | 1.26Å | |
| N5 | N6 | doub | 1.12Å | 1.44Å | |
| C18 | C17 | sing | 1.35Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.53Å | 1.56Å | |
| C6 | C5 | sing | 1.53Å | 1.56Å | |
| C7 | C8 | sing | 1.53Å | 1.56Å | |
| C11 | C10 | sing | 1.51Å | 1.55Å | |
| N2 | C10 | doub | 1.32Å | 1.37Å | Aromatic |
| N2 | C9 | sing | 1.32Å | 1.35Å | Aromatic |
| C8 | C9 | sing | 1.51Å | 1.54Å | |
| C10 | C19 | sing | 1.38Å | 1.44Å | Aromatic |
| C9 | C20 | doub | 1.38Å | 1.48Å | Aromatic |
| C19 | N8 | doub | 1.32Å | 1.37Å | Aromatic |
| C20 | N8 | sing | 1.32Å | 1.33Å | Aromatic |
| N3 | H2 | sing | 0.97Å | 1.00Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.08Å | 1.08Å | |
| C17 | H12 | sing | 1.08Å | 1.08Å | |
| C20 | H13 | sing | 1.08Å | 1.08Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.08Å | 1.08Å | |
| C19 | H20 | sing | 1.08Å | 1.08Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| O1 | H28 | sing | 0.97Å | 0.95Å | |
| O2 | H29 | sing | 0.97Å | 0.95Å | |
| O3 | H30 | sing | 0.97Å | 0.95Å | |
| O4 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | N4 | O5 | 121.6° | 120.0° |
| O6 | N4 | C14 | 114.8° | 120.0° |
| O5 | N4 | C14 | 123.6° | 120.0° |
| N4 | C14 | C15 | 118.9° | 119.6° |
| N4 | C14 | C13 | 118.8° | 119.6° |
| O1 | C1 | C2 | 109.8° | 109.6° |
| O1 | C1 | C4 | 108.6° | 109.5° |
| O1 | C1 | H14 | 109.1° | 109.6° |
| C1 | O1 | H28 | 109.5° | 113.9° |
| O2 | C2 | C1 | 110.7° | 109.4° |
| O2 | C2 | C3 | 112.6° | 109.5° |
| O2 | C2 | H21 | 109.2° | 109.6° |
| C2 | O2 | H29 | 109.5° | 113.9° |
| C1 | C2 | C3 | 106.7° | 109.3° |
| C2 | C1 | C4 | 109.9° | 109.1° |
| C2 | C1 | H14 | 109.9° | 109.5° |
| C1 | C2 | H21 | 109.5° | 109.5° |
| C2 | C3 | N1 | 107.7° | 109.5° |
| C3 | C2 | H21 | 108.1° | 109.5° |
| C2 | C3 | H22 | 109.9° | 109.5° |
| C2 | C3 | H23 | 109.9° | 109.4° |
| O4 | C6 | C5 | 114.4° | 109.4° |
| O4 | C6 | H5 | 108.2° | 109.5° |
| O4 | C6 | H6 | 108.2° | 109.5° |
| C6 | O4 | H31 | 109.5° | 114.0° |
| C15 | C14 | C13 | 122.3° | 120.8° |
| C14 | C15 | C16 | 117.9° | 119.1° |
| C14 | C15 | H11 | 121.1° | 120.4° |
| C14 | C13 | N3 | 121.7° | 119.1° |
| C14 | C13 | C18 | 118.8° | 121.7° |
| C15 | C16 | N5 | 123.0° | 120.8° |
| C15 | C16 | C17 | 119.6° | 118.4° |
| C16 | C15 | H11 | 121.1° | 120.5° |
| C13 | N3 | C12 | 122.3° | 120.0° |
| N3 | C13 | C18 | 119.5° | 119.2° |
| C13 | N3 | H2 | 106.2° | 120.0° |
| N3 | C12 | C11 | 116.0° | 109.4° |
| C12 | N3 | H2 | 106.1° | 120.0° |
| N3 | C12 | H17 | 107.8° | 109.5° |
| N3 | C12 | H18 | 107.8° | 109.5° |
| C1 | C4 | O3 | 108.4° | 109.5° |
| C1 | C4 | C5 | 112.5° | 109.3° |
| C1 | C4 | H3 | 107.7° | 109.5° |
| C4 | C1 | H14 | 109.4° | 109.5° |
| C13 | C18 | C17 | 120.2° | 120.8° |
| C13 | C18 | H19 | 119.9° | 119.6° |
| O3 | C4 | C5 | 112.9° | 109.5° |
| O3 | C4 | H3 | 108.3° | 109.5° |
| C4 | O3 | H30 | 109.5° | 114.0° |
| C4 | C5 | N1 | 111.6° | 109.5° |
| C4 | C5 | C6 | 109.5° | 109.5° |
| C5 | C4 | H3 | 106.8° | 109.5° |
| C4 | C5 | H4 | 107.7° | 109.5° |
| N7 | N6 | N5 | 114.8° | 179.9° |
| N5 | C16 | C17 | 117.5° | 120.8° |
| C16 | N5 | N6 | 120.2° | 120.0° |
| C16 | C17 | C18 | 121.2° | 119.1° |
| C16 | C17 | H12 | 119.4° | 120.4° |
| C3 | N1 | C5 | 110.8° | 111.2° |
| C3 | N1 | C7 | 113.7° | 111.0° |
| N1 | C3 | H22 | 109.9° | 109.5° |
| N1 | C3 | H23 | 109.9° | 109.4° |
| C5 | N1 | C7 | 115.1° | 111.0° |
| N1 | C5 | C6 | 110.9° | 109.5° |
| N1 | C5 | H4 | 109.3° | 109.4° |
| N1 | C7 | C8 | 115.1° | 109.5° |
| N1 | C7 | H7 | 108.0° | 109.5° |
| N1 | C7 | H8 | 108.0° | 109.4° |
| C18 | C17 | H12 | 119.4° | 120.4° |
| C17 | C18 | H19 | 119.9° | 119.6° |
| C12 | C11 | C10 | 112.7° | 109.5° |
| C12 | C11 | H15 | 108.7° | 109.5° |
| C12 | C11 | H16 | 108.7° | 109.5° |
| C11 | C12 | H17 | 107.8° | 109.4° |
| C11 | C12 | H18 | 107.8° | 109.4° |
| C6 | C5 | H4 | 107.7° | 109.4° |
| C5 | C6 | H5 | 108.2° | 109.4° |
| C5 | C6 | H6 | 108.2° | 109.5° |
| C7 | C8 | C9 | 109.9° | 109.5° |
| C8 | C7 | H7 | 108.0° | 109.5° |
| C8 | C7 | H8 | 108.0° | 109.5° |
| C7 | C8 | H9 | 109.4° | 109.4° |
| C7 | C8 | H10 | 109.3° | 109.5° |
| C11 | C10 | N2 | 121.9° | 120.0° |
| C11 | C10 | C19 | 120.8° | 120.0° |
| C10 | C11 | H15 | 108.7° | 109.5° |
| C10 | C11 | H16 | 108.6° | 109.4° |
| C10 | N2 | C9 | 120.9° | 120.0° |
| N2 | C10 | C19 | 117.2° | 120.0° |
| N2 | C9 | C8 | 120.0° | 120.0° |
| N2 | C9 | C20 | 120.8° | 120.0° |
| C8 | C9 | C20 | 119.0° | 120.0° |
| C9 | C8 | H9 | 109.4° | 109.5° |
| C9 | C8 | H10 | 109.4° | 109.5° |
| C10 | C19 | N8 | 122.6° | 120.0° |
| C10 | C19 | H20 | 118.7° | 120.0° |
| C9 | C20 | N8 | 118.8° | 120.0° |
| C9 | C20 | H13 | 120.6° | 120.0° |
| C19 | N8 | C20 | 119.6° | 120.0° |
| N8 | C19 | H20 | 118.7° | 120.0° |
| N8 | C20 | H13 | 120.6° | 120.0° |
| H5 | C6 | H6 | 109.5° | 109.5° |
| H7 | C7 | H8 | 109.5° | 109.5° |
| H9 | C8 | H10 | 109.5° | 109.5° |
| H15 | C11 | H16 | 109.5° | 109.5° |
| H17 | C12 | H18 | 109.5° | 109.5° |
| H22 | C3 | H23 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | N4 | O5 | C14 | 179.8° | 180.0° |
| O6 | N4 | C14 | C15 | 0.3° | 141.6° |
| O6 | N4 | C14 | C13 | 179.6° | 38.4° |
| O5 | N4 | C14 | C15 | 179.9° | 38.3° |
| O5 | N4 | C14 | C13 | 0.6° | 141.6° |
| N4 | C14 | C15 | C13 | 179.3° | 180.0° |
| N4 | C14 | C15 | C16 | 179.2° | 180.0° |
| N4 | C14 | C13 | N3 | 0.5° | 0.1° |
| N4 | C14 | C13 | C18 | 179.3° | 179.7° |
| N4 | C14 | C15 | H11 | 0.8° | 0.2° |
| O1 | C1 | C2 | O2 | 53.6° | 62.5° |
| O1 | C1 | C2 | C4 | 119.5° | 119.9° |
| O1 | C1 | C2 | H14 | 120.0° | 120.3° |
| O1 | C1 | C2 | C3 | 176.5° | 177.6° |
| O1 | C1 | C4 | H14 | 119.0° | 120.2° |
| O1 | C1 | C4 | O3 | 58.4° | 62.4° |
| O1 | C1 | C4 | C5 | 176.0° | 177.6° |
| O1 | C1 | C4 | H3 | 58.5° | 57.6° |
| O1 | C1 | C2 | H21 | 66.8° | 57.6° |
| O2 | C2 | C1 | C3 | 122.9° | 119.9° |
| O2 | C2 | C1 | H21 | 120.4° | 120.1° |
| O2 | C2 | C3 | H21 | 120.7° | 120.2° |
| O2 | C2 | C1 | C4 | 173.1° | 177.6° |
| O2 | C2 | C3 | N1 | 171.5° | 179.1° |
| O2 | C2 | C1 | H14 | 66.4° | 57.8° |
| O2 | C2 | C3 | H22 | 51.8° | 59.1° |
| O2 | C2 | C3 | H23 | 68.8° | 60.9° |
| C1 | C2 | C3 | H21 | 117.7° | 119.9° |
| C2 | C1 | C4 | H14 | 120.8° | 119.9° |
| C2 | C1 | C4 | O3 | 178.7° | 177.6° |
| C2 | C1 | C4 | C5 | 55.7° | 57.6° |
| C1 | C2 | C3 | N1 | 66.9° | 59.2° |
| C2 | C1 | C4 | H3 | 61.7° | 62.3° |
| C1 | C2 | C3 | H22 | 173.4° | 60.8° |
| C1 | C2 | C3 | H23 | 52.9° | 179.2° |
| C2 | C1 | O1 | H28 | 180.0° | 60.3° |
| C1 | C2 | O2 | H29 | 180.0° | 180.0° |
| C3 | C2 | C1 | C4 | 64.1° | 57.7° |
| C2 | C3 | N1 | H22 | 119.7° | 120.0° |
| C2 | C3 | N1 | H23 | 119.7° | 120.0° |
| C2 | C3 | N1 | C5 | 61.6° | 61.8° |
| C2 | C3 | N1 | C7 | 166.8° | 174.1° |
| C3 | C2 | C1 | H14 | 56.4° | 62.2° |
| C2 | C3 | H22 | H23 | 120.8° | 120.0° |
| C3 | C2 | O2 | H29 | 60.7° | 60.2° |
| O4 | C6 | C5 | C4 | 58.9° | 55.6° |
| O4 | C6 | C5 | N1 | 64.6° | 64.5° |
| O4 | C6 | C5 | H5 | 120.7° | 119.9° |
| O4 | C6 | C5 | H6 | 120.7° | 120.0° |
| O4 | C6 | C5 | H4 | 175.8° | 175.6° |
| O4 | C6 | H5 | H6 | 117.8° | 120.0° |
| C14 | C15 | C16 | H11 | 180.0° | 179.8° |
| C15 | C14 | C13 | N3 | 179.8° | 180.0° |
| C15 | C14 | C13 | C18 | 1.4° | 0.3° |
| C14 | C15 | C16 | N5 | 179.9° | 179.7° |
| C14 | C15 | C16 | C17 | 1.1° | 0.2° |
| C13 | C14 | C15 | C16 | 1.5° | 0.0° |
| C14 | C13 | N3 | C18 | 178.8° | 179.7° |
| C14 | C13 | N3 | C12 | 158.8° | 173.5° |
| C14 | C13 | C18 | C17 | 0.8° | 0.3° |
| C14 | C13 | N3 | H2 | 79.5° | 6.6° |
| C13 | C14 | C15 | H11 | 178.5° | 179.7° |
| C14 | C13 | C18 | H19 | 179.1° | 179.7° |
| C15 | C16 | N5 | C17 | 179.0° | 179.9° |
| C15 | C16 | N5 | N6 | 162.4° | 180.0° |
| C15 | C16 | C17 | C18 | 0.6° | 0.2° |
| C15 | C16 | C17 | H12 | 179.4° | 179.9° |
| C13 | N3 | C12 | H2 | 121.8° | 179.9° |
| N3 | C13 | C18 | C17 | 179.7° | 180.0° |
| C13 | N3 | C12 | C11 | 48.7° | 180.0° |
| C13 | N3 | C12 | H17 | 72.2° | 60.0° |
| C13 | N3 | C12 | H18 | 169.6° | 60.1° |
| N3 | C13 | C18 | H19 | 0.3° | 0.1° |
| C12 | N3 | C13 | C18 | 20.0° | 6.2° |
| N3 | C12 | C11 | H17 | 120.9° | 120.0° |
| N3 | C12 | C11 | H18 | 121.0° | 120.0° |
| N3 | C12 | C11 | C10 | 151.1° | 180.0° |
| N3 | C12 | C11 | H15 | 88.4° | 60.0° |
| N3 | C12 | C11 | H16 | 30.6° | 60.0° |
| N3 | C12 | H17 | H18 | 117.1° | 120.1° |
| C1 | C4 | O3 | C5 | 125.3° | 119.8° |
| C1 | C4 | O3 | H3 | 116.6° | 120.1° |
| C1 | C4 | C5 | H3 | 118.0° | 120.0° |
| C1 | C4 | C5 | N1 | 49.2° | 59.2° |
| C1 | C4 | C5 | C6 | 172.3° | 179.2° |
| C1 | C4 | C5 | H4 | 70.8° | 60.8° |
| C4 | C1 | C2 | H21 | 52.7° | 62.3° |
| C4 | C1 | O1 | H28 | 59.7° | 180.0° |
| C1 | C4 | O3 | H30 | 180.0° | 60.2° |
| C13 | C18 | C17 | C16 | 0.4° | 0.0° |
| C13 | C18 | C17 | H19 | 180.0° | 180.0° |
| C18 | C13 | N3 | H2 | 101.7° | 173.8° |
| C13 | C18 | C17 | H12 | 179.6° | 179.7° |
| O3 | C4 | C5 | H3 | 118.9° | 120.1° |
| O3 | C4 | C5 | N1 | 172.3° | 179.1° |
| O3 | C4 | C5 | C6 | 64.6° | 60.8° |
| O3 | C4 | C5 | H4 | 52.3° | 59.1° |
| O3 | C4 | C1 | H14 | 60.6° | 57.7° |
| C4 | C5 | N1 | C3 | 52.3° | 61.7° |
| C4 | C5 | N1 | C6 | 122.3° | 120.1° |
| C4 | C5 | N1 | H4 | 119.1° | 120.0° |
| C4 | C5 | N1 | C7 | 176.8° | 174.2° |
| C4 | C5 | C6 | H4 | 116.9° | 120.0° |
| C4 | C5 | C6 | H5 | 61.8° | 175.5° |
| C4 | C5 | C6 | H6 | 179.6° | 64.4° |
| C5 | C4 | C1 | H14 | 65.0° | 62.2° |
| C5 | C4 | O3 | H30 | 54.7° | 180.0° |
| N7 | N6 | N5 | C16 | 145.5° | 63.3° |
| N5 | C16 | C17 | C18 | 179.6° | 179.7° |
| N5 | C16 | C15 | H11 | 0.1° | 0.1° |
| N5 | C16 | C17 | H12 | 0.4° | 0.0° |
| C17 | C16 | N5 | N6 | 16.6° | 0.1° |
| C16 | C17 | C18 | H12 | 180.0° | 179.7° |
| C17 | C16 | C15 | H11 | 178.9° | 180.0° |
| C16 | C17 | C18 | H19 | 179.5° | 180.0° |
| C3 | N1 | C5 | C7 | 130.9° | 124.1° |
| C3 | N1 | C5 | C6 | 174.6° | 178.2° |
| C3 | N1 | C7 | C8 | 70.2° | 67.7° |
| C3 | N1 | C5 | H4 | 66.7° | 58.3° |
| C3 | N1 | C7 | H7 | 169.0° | 52.3° |
| C3 | N1 | C7 | H8 | 50.6° | 172.3° |
| N1 | C3 | C2 | H21 | 50.8° | 60.7° |
| N1 | C3 | H22 | H23 | 120.8° | 120.0° |
| N1 | C5 | C6 | H4 | 119.6° | 119.9° |
| C5 | N1 | C7 | C8 | 59.3° | 168.1° |
| N1 | C5 | C4 | H3 | 68.8° | 60.8° |
| N1 | C5 | C6 | H5 | 174.6° | 55.5° |
| N1 | C5 | C6 | H6 | 56.1° | 175.5° |
| C5 | N1 | C7 | H7 | 61.5° | 71.9° |
| C5 | N1 | C7 | H8 | 179.9° | 48.1° |
| C5 | N1 | C3 | H22 | 178.7° | 58.3° |
| C5 | N1 | C3 | H23 | 58.1° | 178.3° |
| C7 | N1 | C5 | C6 | 54.5° | 54.1° |
| N1 | C7 | C8 | H7 | 120.8° | 120.0° |
| N1 | C7 | C8 | H8 | 120.8° | 120.0° |
| N1 | C7 | C8 | C9 | 161.5° | 180.0° |
| C7 | N1 | C5 | H4 | 64.1° | 65.8° |
| N1 | C7 | H7 | H8 | 117.4° | 120.0° |
| N1 | C7 | C8 | H9 | 41.5° | 60.0° |
| N1 | C7 | C8 | H10 | 78.4° | 60.0° |
| C7 | N1 | C3 | H22 | 47.1° | 65.8° |
| C7 | N1 | C3 | H23 | 73.5° | 54.2° |
| C12 | C11 | C10 | H15 | 120.5° | 120.0° |
| C12 | C11 | C10 | H16 | 120.5° | 120.0° |
| C12 | C11 | C10 | N2 | 52.5° | 95.3° |
| C12 | C11 | C10 | C19 | 129.2° | 85.0° |
| C11 | C12 | N3 | H2 | 170.4° | 0.0° |
| C12 | C11 | H15 | H16 | 118.6° | 120.0° |
| C11 | C12 | H17 | H18 | 117.0° | 120.0° |
| C6 | C5 | C4 | H3 | 54.3° | 59.3° |
| C5 | C6 | H5 | H6 | 117.8° | 120.1° |
| C5 | C6 | O4 | H31 | 180.0° | 180.0° |
| C7 | C8 | C9 | N2 | 45.2° | 95.8° |
| C7 | C8 | C9 | H9 | 120.1° | 120.0° |
| C7 | C8 | C9 | H10 | 120.1° | 120.0° |
| C7 | C8 | C9 | C20 | 129.9° | 85.0° |
| C8 | C7 | H7 | H8 | 117.4° | 120.0° |
| C7 | C8 | H9 | H10 | 119.8° | 120.0° |
| C11 | C10 | N2 | C19 | 178.3° | 179.8° |
| C11 | C10 | N2 | C9 | 177.3° | 179.7° |
| C11 | C10 | C19 | N8 | 178.5° | 180.0° |
| C10 | C11 | H15 | H16 | 118.5° | 119.9° |
| C10 | C11 | C12 | H17 | 30.1° | 60.0° |
| C10 | C11 | C12 | H18 | 88.0° | 60.0° |
| C11 | C10 | C19 | H20 | 1.5° | 0.0° |
| C10 | N2 | C9 | C8 | 177.3° | 179.7° |
| C10 | N2 | C9 | C20 | 2.3° | 0.6° |
| N2 | C10 | C19 | N8 | 0.2° | 0.3° |
| N2 | C10 | C11 | H15 | 173.0° | 24.8° |
| N2 | C10 | C11 | H16 | 67.9° | 144.7° |
| N2 | C10 | C19 | H20 | 179.8° | 179.8° |
| N2 | C9 | C8 | C20 | 175.1° | 179.2° |
| C9 | N2 | C10 | C19 | 1.0° | 0.0° |
| N2 | C9 | C20 | N8 | 2.6° | 0.8° |
| N2 | C9 | C8 | H9 | 74.9° | 144.2° |
| N2 | C9 | C8 | H10 | 165.2° | 24.2° |
| N2 | C9 | C20 | H13 | 177.4° | 179.7° |
| C8 | C9 | C20 | N8 | 177.6° | 180.0° |
| C9 | C8 | C7 | H7 | 77.6° | 60.0° |
| C9 | C8 | C7 | H8 | 40.7° | 60.0° |
| C9 | C8 | H9 | H10 | 119.8° | 120.0° |
| C8 | C9 | C20 | H13 | 2.4° | 0.5° |
| C10 | C19 | N8 | H20 | 180.0° | 180.0° |
| C10 | C19 | N8 | C20 | 0.0° | 0.0° |
| C19 | C10 | C11 | H15 | 8.7° | 155.0° |
| C19 | C10 | C11 | H16 | 110.3° | 35.0° |
| C9 | C20 | N8 | C19 | 1.4° | 0.5° |
| C9 | C20 | N8 | H13 | 180.0° | 179.5° |
| C20 | C9 | C8 | H9 | 110.1° | 35.0° |
| C20 | C9 | C8 | H10 | 9.8° | 155.0° |
| C19 | N8 | C20 | H13 | 178.6° | 180.0° |
| C20 | N8 | C19 | H20 | 179.9° | 180.0° |
| H2 | N3 | C12 | H17 | 49.5° | 119.9° |
| H2 | N3 | C12 | H18 | 68.6° | 120.0° |
| H3 | C4 | C5 | H4 | 171.2° | 179.2° |
| H3 | C4 | C1 | H14 | 177.5° | 177.8° |
| H3 | C4 | O3 | H30 | 63.4° | 59.9° |
| H4 | C5 | C6 | H5 | 55.1° | 64.5° |
| H4 | C5 | C6 | H6 | 63.5° | 55.6° |
| H5 | C6 | O4 | H31 | 59.3° | 60.1° |
| H6 | C6 | O4 | H31 | 59.3° | 60.0° |
| H7 | C7 | C8 | H9 | 162.3° | 180.0° |
| H7 | C7 | C8 | H10 | 42.4° | 60.0° |
| H8 | C7 | C8 | H9 | 79.3° | 60.0° |
| H8 | C7 | C8 | H10 | 160.8° | 180.0° |
| H12 | C17 | C18 | H19 | 0.4° | 0.3° |
| H14 | C1 | C2 | H21 | 173.2° | 177.8° |
| H14 | C1 | O1 | H28 | 59.5° | 59.9° |
| H15 | C11 | C12 | H17 | 150.6° | 60.0° |
| H15 | C11 | C12 | H18 | 32.5° | 180.0° |
| H16 | C11 | C12 | H17 | 90.3° | 180.0° |
| H16 | C11 | C12 | H18 | 151.6° | 60.0° |
| H21 | C2 | C3 | H22 | 68.9° | 179.2° |
| H21 | C2 | C3 | H23 | 170.6° | 59.3° |
| H21 | C2 | O2 | H29 | 59.4° | 60.0° |
