LHD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N6 | C1 | sing | 1.38Å | 1.34Å | |
| C1 | C2 | doub | 1.40Å | 1.41Å | Aromatic |
| C1 | N2 | sing | 1.33Å | 1.35Å | Aromatic |
| N4 | C2 | sing | 1.35Å | 1.39Å | Aromatic |
| N4 | C5 | doub | 1.30Å | 1.31Å | Aromatic |
| C2 | C3 | sing | 1.41Å | 1.38Å | Aromatic |
| N2 | C4 | doub | 1.32Å | 1.34Å | Aromatic |
| C5 | N3 | sing | 1.36Å | 1.37Å | Aromatic |
| C3 | N3 | sing | 1.37Å | 1.37Å | Aromatic |
| C3 | N1 | doub | 1.33Å | 1.34Å | Aromatic |
| C4 | N1 | sing | 1.32Å | 1.34Å | Aromatic |
| N3 | C6 | sing | 1.47Å | 1.46Å | |
| C15 | O4 | sing | 1.43Å | 1.40Å | |
| C15 | N8 | sing | 1.46Å | 1.47Å | |
| C6 | C9 | sing | 1.55Å | 1.53Å | |
| C6 | O1 | sing | 1.44Å | 1.41Å | |
| O4 | C16 | sing | 1.43Å | 1.42Å | |
| C9 | O2 | sing | 1.43Å | 1.42Å | |
| C9 | C8 | sing | 1.55Å | 1.53Å | |
| O1 | C7 | sing | 1.44Å | 1.45Å | |
| C17 | C7 | sing | 1.53Å | 1.51Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| N5 | C18 | sing | 1.47Å | 1.49Å | |
| N5 | C10 | sing | 1.47Å | 1.49Å | |
| C14 | N8 | sing | 1.36Å | 1.37Å | |
| C14 | C11 | doub | 1.35Å | 1.35Å | |
| N8 | C13 | sing | 1.35Å | 1.40Å | |
| C7 | C8 | sing | 1.54Å | 1.53Å | |
| C10 | C11 | sing | 1.51Å | 1.49Å | |
| C8 | O3 | sing | 1.43Å | 1.42Å | |
| C11 | C12 | sing | 1.41Å | 1.44Å | |
| C13 | O5 | doub | 1.22Å | 1.23Å | |
| C13 | N7 | sing | 1.33Å | 1.36Å | |
| C12 | N7 | doub | 1.33Å | 1.34Å | |
| C12 | N9 | sing | 1.38Å | 1.34Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| O2 | H7 | sing | 0.97Å | 0.95Å | |
| O3 | H8 | sing | 0.97Å | 0.95Å | |
| N5 | H26 | sing | 1.01Å | 1.00Å | |
| N5 | H9 | sing | 1.01Å | 1.00Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| N6 | H12 | sing | 0.97Å | 1.00Å | |
| N6 | H13 | sing | 0.97Å | 1.00Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| N9 | H16 | sing | 0.97Å | 1.00Å | |
| N9 | H15 | sing | 0.97Å | 1.00Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N6 | C1 | C2 | 123.8° | 120.8° |
| N6 | C1 | N2 | 118.6° | 120.7° |
| C1 | N6 | H12 | 109.5° | 120.0° |
| C1 | N6 | H13 | 109.5° | 120.0° |
| C2 | C1 | N2 | 117.6° | 118.5° |
| C1 | C2 | N4 | 132.3° | 134.7° |
| C1 | C2 | C3 | 117.0° | 118.2° |
| C1 | N2 | C4 | 118.8° | 121.1° |
| C2 | N4 | C5 | 103.6° | 109.4° |
| N4 | C2 | C3 | 110.8° | 107.1° |
| N4 | C5 | N3 | 114.0° | 110.0° |
| N4 | C5 | H2 | 123.0° | 125.0° |
| C2 | C3 | N3 | 105.7° | 106.0° |
| C2 | C3 | N1 | 126.8° | 119.1° |
| N2 | C4 | N1 | 128.9° | 122.5° |
| N2 | C4 | H1 | 115.5° | 118.7° |
| C5 | N3 | C3 | 105.9° | 107.4° |
| C5 | N3 | C6 | 126.7° | 126.3° |
| N3 | C5 | H2 | 123.0° | 125.0° |
| N3 | C3 | N1 | 127.5° | 134.9° |
| C3 | N3 | C6 | 127.4° | 126.3° |
| C3 | N1 | C4 | 110.9° | 120.6° |
| N1 | C4 | H1 | 115.5° | 118.8° |
| N3 | C6 | C9 | 113.8° | 110.6° |
| N3 | C6 | O1 | 108.3° | 110.6° |
| N3 | C6 | H3 | 109.5° | 110.5° |
| O4 | C15 | N8 | 112.8° | 109.5° |
| C15 | O4 | C16 | 114.4° | 114.0° |
| O4 | C15 | H18 | 108.6° | 109.5° |
| O4 | C15 | H17 | 108.6° | 109.5° |
| C15 | N8 | C14 | 117.0° | 119.8° |
| C15 | N8 | C13 | 122.8° | 119.8° |
| N8 | C15 | H18 | 108.7° | 109.5° |
| N8 | C15 | H17 | 108.6° | 109.5° |
| C9 | C6 | O1 | 106.3° | 103.5° |
| C6 | C9 | O2 | 111.6° | 110.9° |
| C6 | C9 | C8 | 101.1° | 102.1° |
| C9 | C6 | H3 | 108.6° | 110.6° |
| C6 | C9 | H6 | 110.1° | 110.9° |
| C6 | O1 | C7 | 110.1° | 107.0° |
| O1 | C6 | H3 | 110.2° | 110.8° |
| O4 | C16 | H20 | 109.5° | 109.4° |
| O4 | C16 | H19 | 109.4° | 109.4° |
| O4 | C16 | H21 | 109.5° | 109.5° |
| O2 | C9 | C8 | 112.0° | 110.9° |
| O2 | C9 | H6 | 111.6° | 110.8° |
| C9 | O2 | H7 | 109.5° | 114.0° |
| C9 | C8 | C7 | 102.7° | 104.2° |
| C9 | C8 | O3 | 112.2° | 110.5° |
| C9 | C8 | H5 | 109.6° | 110.6° |
| C8 | C9 | H6 | 110.0° | 110.9° |
| O1 | C7 | C17 | 109.1° | 109.8° |
| O1 | C7 | C8 | 106.0° | 107.3° |
| O1 | C7 | H4 | 109.4° | 109.9° |
| C7 | C17 | C18 | 115.9° | 109.5° |
| C17 | C7 | C8 | 115.5° | 109.9° |
| C17 | C7 | H4 | 108.5° | 110.0° |
| C7 | C17 | H22 | 107.8° | 109.5° |
| C7 | C17 | H23 | 107.8° | 109.5° |
| C17 | C18 | N5 | 111.5° | 109.5° |
| C18 | C17 | H22 | 107.9° | 109.4° |
| C18 | C17 | H23 | 107.9° | 109.5° |
| C17 | C18 | H25 | 108.9° | 109.5° |
| C17 | C18 | H24 | 109.0° | 109.4° |
| C18 | N5 | C10 | 113.5° | 109.5° |
| C18 | N5 | H26 | 108.4° | 109.5° |
| C18 | N5 | H9 | 108.5° | 109.4° |
| N5 | C18 | H25 | 109.0° | 109.5° |
| N5 | C18 | H24 | 109.0° | 109.5° |
| N5 | C10 | C11 | 106.2° | 109.5° |
| C10 | N5 | H26 | 108.4° | 109.5° |
| C10 | N5 | H9 | 108.4° | 109.5° |
| N5 | C10 | H10 | 110.3° | 109.5° |
| N5 | C10 | H11 | 110.3° | 109.5° |
| N8 | C14 | C11 | 122.9° | 119.3° |
| C14 | N8 | C13 | 120.2° | 120.3° |
| N8 | C14 | H14 | 118.5° | 120.3° |
| C14 | C11 | C10 | 121.0° | 120.5° |
| C14 | C11 | C12 | 115.3° | 119.0° |
| C11 | C14 | H14 | 118.5° | 120.4° |
| N8 | C13 | O5 | 119.1° | 119.5° |
| N8 | C13 | N7 | 118.5° | 121.0° |
| C7 | C8 | O3 | 111.4° | 110.5° |
| C8 | C7 | H4 | 108.3° | 109.9° |
| C7 | C8 | H5 | 109.6° | 110.5° |
| C10 | C11 | C12 | 123.7° | 120.5° |
| C11 | C10 | H10 | 110.3° | 109.4° |
| C11 | C10 | H11 | 110.3° | 109.5° |
| O3 | C8 | H5 | 111.1° | 110.5° |
| C8 | O3 | H8 | 109.5° | 114.0° |
| C11 | C12 | N7 | 122.3° | 119.6° |
| C11 | C12 | N9 | 119.0° | 120.2° |
| O5 | C13 | N7 | 122.4° | 119.5° |
| C13 | N7 | C12 | 120.7° | 120.7° |
| N7 | C12 | N9 | 118.7° | 120.2° |
| C12 | N9 | H16 | 120.0° | 120.0° |
| C12 | N9 | H15 | 120.0° | 120.0° |
| H26 | N5 | H9 | 109.5° | 109.4° |
| H10 | C10 | H11 | 109.5° | 109.5° |
| H12 | N6 | H13 | 109.4° | 120.0° |
| H16 | N9 | H15 | 120.0° | 120.1° |
| H18 | C15 | H17 | 109.5° | 109.5° |
| H20 | C16 | H19 | 109.5° | 109.5° |
| H20 | C16 | H21 | 109.4° | 109.5° |
| H19 | C16 | H21 | 109.5° | 109.5° |
| H22 | C17 | H23 | 109.5° | 109.5° |
| H25 | C18 | H24 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N6 | C1 | C2 | N2 | 179.3° | 179.7° |
| N6 | C1 | C2 | N4 | 2.3° | 0.2° |
| N6 | C1 | C2 | C3 | 178.7° | 179.7° |
| N6 | C1 | N2 | C4 | 179.0° | 179.8° |
| C1 | N6 | H12 | H13 | 120.0° | 180.0° |
| C1 | C2 | N4 | C3 | 179.0° | 180.0° |
| C1 | C2 | N4 | C5 | 179.1° | 180.0° |
| C2 | C1 | N2 | C4 | 0.4° | 0.0° |
| C1 | C2 | C3 | N3 | 179.5° | 180.0° |
| C1 | C2 | C3 | N1 | 0.4° | 0.1° |
| C2 | C1 | N6 | H12 | 179.3° | 0.0° |
| C2 | C1 | N6 | H13 | 60.7° | 180.0° |
| N2 | C1 | C2 | N4 | 178.4° | 180.0° |
| N2 | C1 | C2 | C3 | 0.6° | 0.0° |
| C1 | N2 | C4 | N1 | 0.2° | 0.0° |
| C1 | N2 | C4 | H1 | 179.8° | 180.0° |
| N2 | C1 | N6 | H12 | 0.0° | 179.7° |
| N2 | C1 | N6 | H13 | 120.0° | 0.3° |
| C2 | N4 | C5 | N3 | 0.1° | 0.0° |
| N4 | C2 | C3 | N3 | 0.2° | 0.0° |
| N4 | C2 | C3 | N1 | 178.8° | 180.0° |
| C2 | N4 | C5 | H2 | 179.9° | 179.9° |
| C5 | N4 | C2 | C3 | 0.1° | 0.0° |
| N4 | C5 | N3 | H2 | 180.0° | 179.9° |
| N4 | C5 | N3 | C3 | 0.3° | 0.0° |
| N4 | C5 | N3 | C6 | 179.1° | 180.0° |
| C2 | C3 | N3 | C5 | 0.3° | 0.0° |
| C2 | C3 | N3 | N1 | 179.1° | 180.0° |
| C2 | C3 | N1 | C4 | 0.2° | 0.1° |
| C2 | C3 | N3 | C6 | 179.1° | 180.0° |
| N2 | C4 | N1 | C3 | 0.5° | 0.0° |
| N2 | C4 | N1 | H1 | 180.0° | 180.0° |
| C5 | N3 | C3 | C6 | 179.3° | 180.0° |
| C5 | N3 | C3 | N1 | 178.8° | 179.9° |
| C5 | N3 | C6 | C9 | 48.3° | 95.0° |
| C5 | N3 | C6 | O1 | 69.8° | 19.1° |
| C5 | N3 | C6 | H3 | 170.0° | 142.1° |
| N3 | C3 | N1 | C4 | 178.7° | 180.0° |
| C3 | N3 | C6 | C9 | 130.9° | 85.0° |
| C3 | N3 | C6 | O1 | 111.0° | 161.0° |
| C3 | N3 | C5 | H2 | 179.8° | 179.9° |
| C3 | N3 | C6 | H3 | 9.2° | 37.9° |
| N1 | C3 | N3 | C6 | 1.9° | 0.0° |
| C3 | N1 | C4 | H1 | 179.5° | 180.0° |
| N3 | C6 | C9 | O1 | 119.2° | 118.5° |
| N3 | C6 | C9 | H3 | 122.3° | 122.8° |
| N3 | C6 | O1 | H3 | 119.8° | 122.9° |
| N3 | C6 | C9 | O2 | 87.7° | 86.3° |
| N3 | C6 | C9 | C8 | 153.1° | 155.5° |
| N3 | C6 | O1 | C7 | 141.2° | 158.6° |
| C6 | N3 | C5 | H2 | 0.9° | 0.1° |
| N3 | C6 | C9 | H6 | 36.8° | 37.3° |
| O4 | C15 | N8 | H18 | 120.5° | 120.0° |
| O4 | C15 | N8 | H17 | 120.5° | 120.0° |
| O4 | C15 | N8 | C14 | 124.7° | 104.7° |
| O4 | C15 | N8 | C13 | 56.9° | 75.0° |
| O4 | C15 | H18 | H17 | 118.5° | 120.0° |
| C15 | O4 | C16 | H20 | 180.0° | 60.0° |
| C15 | O4 | C16 | H19 | 60.0° | 60.0° |
| C15 | O4 | C16 | H21 | 60.0° | 180.0° |
| N8 | C15 | O4 | C16 | 48.2° | 80.0° |
| C15 | N8 | C14 | C13 | 178.4° | 179.7° |
| C15 | N8 | C14 | C11 | 177.6° | 179.7° |
| C15 | N8 | C13 | O5 | 1.7° | 0.0° |
| C15 | N8 | C13 | N7 | 177.9° | 180.0° |
| C15 | N8 | C14 | H14 | 2.4° | 0.2° |
| N8 | C15 | H18 | H17 | 118.5° | 120.0° |
| C9 | C6 | O1 | H3 | 117.5° | 118.6° |
| C6 | C9 | O2 | C8 | 112.5° | 112.7° |
| C6 | C9 | O2 | H6 | 123.6° | 123.7° |
| C6 | C9 | C8 | H6 | 116.3° | 118.2° |
| C9 | C6 | O1 | C7 | 18.4° | 40.1° |
| C6 | C9 | C8 | C7 | 35.8° | 20.9° |
| C6 | C9 | C8 | O3 | 83.9° | 97.8° |
| C6 | C9 | C8 | H5 | 152.2° | 139.6° |
| C6 | C9 | O2 | H7 | 180.0° | 180.0° |
| O1 | C6 | C9 | O2 | 153.1° | 155.2° |
| O1 | C6 | C9 | C8 | 34.0° | 37.0° |
| C6 | O1 | C7 | C17 | 119.8° | 146.0° |
| C6 | O1 | C7 | C8 | 5.2° | 26.5° |
| C6 | O1 | C7 | H4 | 121.7° | 92.9° |
| O1 | C6 | C9 | H6 | 82.4° | 81.2° |
| C16 | O4 | C15 | H18 | 72.3° | 40.0° |
| C16 | O4 | C15 | H17 | 168.7° | 160.0° |
| O4 | C16 | H20 | H19 | 120.0° | 119.9° |
| O4 | C16 | H20 | H21 | 120.0° | 120.0° |
| O4 | C16 | H19 | H21 | 120.0° | 120.0° |
| O2 | C9 | C8 | H6 | 124.8° | 123.6° |
| O2 | C9 | C8 | C7 | 154.7° | 139.1° |
| O2 | C9 | C8 | O3 | 35.0° | 20.4° |
| O2 | C9 | C6 | H3 | 34.6° | 36.5° |
| O2 | C9 | C8 | H5 | 88.9° | 102.2° |
| C9 | C8 | C7 | O1 | 26.3° | 2.0° |
| C9 | C8 | C7 | C17 | 94.6° | 121.4° |
| C9 | C8 | C7 | O3 | 120.3° | 118.6° |
| C9 | C8 | C7 | H5 | 116.4° | 118.8° |
| C9 | C8 | O3 | H5 | 123.0° | 122.7° |
| C8 | C9 | C6 | H3 | 84.6° | 81.7° |
| C9 | C8 | C7 | H4 | 143.5° | 117.4° |
| C8 | C9 | O2 | H7 | 67.5° | 67.3° |
| C9 | C8 | O3 | H8 | 180.0° | 65.3° |
| O1 | C7 | C17 | C8 | 119.2° | 117.8° |
| O1 | C7 | C17 | H4 | 119.0° | 121.0° |
| O1 | C7 | C17 | C18 | 144.5° | 66.5° |
| O1 | C7 | C8 | H4 | 117.3° | 119.4° |
| O1 | C7 | C8 | O3 | 94.0° | 120.7° |
| C7 | O1 | C6 | H3 | 99.1° | 78.5° |
| O1 | C7 | C8 | H5 | 142.6° | 116.8° |
| O1 | C7 | C17 | H22 | 94.5° | 173.6° |
| O1 | C7 | C17 | H23 | 23.6° | 53.6° |
| C7 | C17 | C18 | H22 | 120.9° | 120.0° |
| C7 | C17 | C18 | H23 | 120.9° | 120.0° |
| C7 | C17 | C18 | N5 | 177.1° | 180.0° |
| C17 | C7 | C8 | H4 | 121.8° | 121.2° |
| C17 | C7 | C8 | O3 | 145.0° | 119.9° |
| C17 | C7 | C8 | H5 | 21.7° | 2.6° |
| C7 | C17 | H22 | H23 | 117.1° | 120.0° |
| C7 | C17 | C18 | H25 | 56.8° | 60.0° |
| C7 | C17 | C18 | H24 | 62.5° | 60.0° |
| C17 | C18 | N5 | H25 | 120.3° | 120.0° |
| C17 | C18 | N5 | H24 | 120.3° | 120.0° |
| C17 | C18 | N5 | C10 | 177.9° | 180.0° |
| C18 | C17 | C7 | C8 | 96.2° | 175.7° |
| C18 | C17 | C7 | H4 | 25.5° | 54.6° |
| C17 | C18 | N5 | H26 | 61.5° | 59.9° |
| C17 | C18 | N5 | H9 | 57.3° | 60.0° |
| C18 | C17 | H22 | H23 | 117.1° | 120.0° |
| C17 | C18 | H25 | H24 | 119.1° | 120.0° |
| C18 | N5 | C10 | H26 | 120.6° | 120.0° |
| C18 | N5 | C10 | H9 | 120.6° | 120.0° |
| C18 | N5 | C10 | C11 | 92.7° | 180.0° |
| C18 | N5 | H26 | H9 | 118.1° | 119.9° |
| C18 | N5 | C10 | H10 | 147.8° | 60.0° |
| C18 | N5 | C10 | H11 | 26.8° | 60.0° |
| N5 | C18 | C17 | H22 | 61.9° | 60.0° |
| N5 | C18 | C17 | H23 | 56.2° | 60.0° |
| N5 | C18 | H25 | H24 | 119.1° | 120.0° |
| N5 | C10 | C11 | C14 | 84.7° | 94.7° |
| N5 | C10 | C11 | H10 | 119.5° | 120.0° |
| N5 | C10 | C11 | H11 | 119.4° | 120.0° |
| N5 | C10 | C11 | C12 | 93.6° | 85.0° |
| C10 | N5 | H26 | H9 | 118.1° | 120.1° |
| N5 | C10 | H10 | H11 | 121.5° | 120.1° |
| C10 | N5 | C18 | H25 | 57.6° | 60.0° |
| C10 | N5 | C18 | H24 | 61.8° | 60.0° |
| N8 | C14 | C11 | H14 | 180.0° | 179.5° |
| N8 | C14 | C11 | C10 | 177.6° | 179.7° |
| N8 | C14 | C11 | C12 | 0.8° | 0.5° |
| C14 | N8 | C13 | O5 | 180.0° | 179.7° |
| C14 | N8 | C13 | N7 | 0.4° | 0.3° |
| C14 | N8 | C15 | H18 | 4.2° | 15.3° |
| C14 | N8 | C15 | H17 | 114.8° | 135.3° |
| C11 | C14 | N8 | C13 | 0.8° | 0.5° |
| C14 | C11 | C10 | C12 | 178.3° | 179.7° |
| C14 | C11 | C12 | N7 | 0.5° | 0.3° |
| C14 | C11 | C12 | N9 | 179.0° | 179.8° |
| C14 | C11 | C10 | H10 | 34.8° | 25.3° |
| C14 | C11 | C10 | H11 | 155.9° | 145.2° |
| N8 | C13 | O5 | N7 | 179.6° | 180.0° |
| N8 | C13 | N7 | C12 | 0.1° | 0.0° |
| C13 | N8 | C14 | H14 | 179.2° | 180.0° |
| C13 | N8 | C15 | H18 | 177.4° | 165.0° |
| C13 | N8 | C15 | H17 | 63.6° | 45.0° |
| C7 | C8 | O3 | H5 | 122.5° | 122.6° |
| C7 | C8 | C9 | H6 | 80.5° | 97.4° |
| C7 | C8 | O3 | H8 | 65.5° | 180.0° |
| C8 | C7 | C17 | H22 | 24.7° | 55.7° |
| C8 | C7 | C17 | H23 | 142.8° | 64.3° |
| C10 | C11 | C12 | N7 | 177.9° | 180.0° |
| C10 | C11 | C12 | N9 | 2.6° | 0.0° |
| C11 | C10 | N5 | H26 | 27.9° | 60.0° |
| C11 | C10 | N5 | H9 | 146.7° | 60.0° |
| C11 | C10 | H10 | H11 | 121.5° | 119.9° |
| C10 | C11 | C14 | H14 | 2.4° | 0.3° |
| O3 | C8 | C7 | H4 | 23.2° | 1.3° |
| O3 | C8 | C9 | H6 | 159.7° | 144.0° |
| C11 | C12 | N7 | C13 | 0.1° | 0.0° |
| C11 | C12 | N7 | N9 | 179.5° | 179.9° |
| C12 | C11 | C10 | H10 | 146.9° | 155.0° |
| C12 | C11 | C10 | H11 | 25.9° | 35.0° |
| C12 | C11 | C14 | H14 | 179.1° | 180.0° |
| C11 | C12 | N9 | H16 | 179.5° | 0.0° |
| C11 | C12 | N9 | H15 | 0.5° | 180.0° |
| O5 | C13 | N7 | C12 | 179.7° | 180.0° |
| C13 | N7 | C12 | N9 | 179.4° | 180.0° |
| N7 | C12 | N9 | H16 | 0.0° | 180.0° |
| N7 | C12 | N9 | H15 | 180.0° | 0.0° |
| C12 | N9 | H16 | H15 | 180.0° | 180.0° |
| H3 | C6 | C9 | H6 | 159.1° | 160.1° |
| H4 | C7 | C8 | H5 | 100.1° | 123.8° |
| H4 | C7 | C17 | H22 | 146.5° | 65.4° |
| H4 | C7 | C17 | H23 | 95.4° | 174.6° |
| H5 | C8 | C9 | H6 | 35.8° | 21.4° |
| H5 | C8 | O3 | H8 | 57.0° | 57.4° |
| H6 | C9 | O2 | H7 | 56.4° | 56.4° |
| H26 | N5 | C10 | H10 | 91.6° | 60.0° |
| H26 | N5 | C10 | H11 | 147.4° | 180.0° |
| H26 | N5 | C18 | H25 | 178.2° | 180.0° |
| H26 | N5 | C18 | H24 | 58.8° | 60.0° |
| H9 | N5 | C10 | H10 | 27.2° | 180.0° |
| H9 | N5 | C10 | H11 | 93.8° | 60.0° |
| H9 | N5 | C18 | H25 | 63.0° | 60.1° |
| H9 | N5 | C18 | H24 | 177.6° | 179.9° |
| H20 | C16 | H19 | H21 | 120.0° | 120.1° |
| H22 | C17 | C18 | H25 | 177.8° | 60.0° |
| H22 | C17 | C18 | H24 | 58.4° | 180.0° |
| H23 | C17 | C18 | H25 | 64.1° | 180.0° |
| H23 | C17 | C18 | H24 | 176.5° | 60.0° |
