A1JPD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | O2 | doub | 1.21Å | 1.23Å | |
| O1 | C12 | sing | 1.35Å | 1.33Å | |
| C11 | C12 | sing | 1.48Å | 1.51Å | |
| C11 | C10 | doub | 1.40Å | 1.40Å | Aromatic |
| C13 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | C8 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C7 | C8 | sing | 1.51Å | 1.54Å | |
| C6 | C7 | sing | 1.51Å | 1.53Å | |
| C6 | C15 | doub | 1.35Å | 1.39Å | Aromatic |
| N3 | C6 | sing | 1.35Å | 1.38Å | Aromatic |
| C15 | N4 | sing | 1.34Å | 1.35Å | Aromatic |
| N4 | N5 | doub | 1.29Å | 1.40Å | Aromatic |
| N5 | N3 | sing | 1.29Å | 1.39Å | Aromatic |
| C5 | N3 | sing | 1.47Å | 1.49Å | |
| C4 | C5 | sing | 1.53Å | 1.58Å | |
| C4 | O | sing | 1.44Å | 1.45Å | |
| C16 | C4 | sing | 1.54Å | 1.54Å | |
| O | C3 | sing | 1.44Å | 1.44Å | |
| O3 | C16 | sing | 1.43Å | 1.42Å | |
| C17 | C16 | sing | 1.55Å | 1.52Å | |
| O4 | C17 | sing | 1.43Å | 1.44Å | |
| C3 | C17 | sing | 1.55Å | 1.52Å | |
| N2 | C3 | sing | 1.47Å | 1.49Å | |
| N2 | C2 | sing | 1.47Å | 1.35Å | |
| C18 | N2 | sing | 1.37Å | 1.35Å | |
| C2 | N1 | sing | 1.47Å | 1.37Å | |
| N1 | C1 | doub | 1.28Å | 1.35Å | |
| C18 | C1 | sing | 1.48Å | 1.48Å | |
| N6 | C18 | doub | 1.31Å | 1.36Å | |
| C1 | C | sing | 1.52Å | 1.49Å | |
| C19 | N6 | sing | 1.33Å | 1.36Å | |
| N7 | C19 | doub | 1.29Å | 1.35Å | |
| C | N7 | sing | 1.47Å | 1.35Å | |
| N | C | sing | 1.47Å | 1.36Å | |
| N | H4 | sing | 1.01Å | 1.00Å | |
| N | H5 | sing | 1.01Å | 1.00Å | |
| C | H21 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C15 | H16 | sing | 1.08Å | 1.08Å | |
| C16 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C2 | H24 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H | sing | 1.09Å | 1.10Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.08Å | 1.08Å | |
| O1 | H13 | sing | 0.97Å | 0.95Å | |
| O3 | H17 | sing | 0.97Å | 0.95Å | |
| O4 | H18 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C12 | O1 | 118.5° | 120.0° |
| O2 | C12 | C11 | 123.2° | 120.1° |
| O1 | C12 | C11 | 118.2° | 120.0° |
| C12 | O1 | H13 | 109.5° | 117.0° |
| C12 | C11 | C10 | 122.3° | 120.1° |
| C12 | C11 | C13 | 118.9° | 120.2° |
| C10 | C11 | C13 | 118.8° | 119.7° |
| C11 | C10 | C9 | 120.0° | 119.9° |
| C11 | C10 | H12 | 120.0° | 120.1° |
| C11 | C13 | C14 | 120.7° | 119.8° |
| C11 | C13 | H14 | 119.6° | 120.0° |
| C10 | C9 | C8 | 122.0° | 120.1° |
| C9 | C10 | H12 | 120.0° | 120.1° |
| C10 | C9 | H11 | 119.0° | 119.9° |
| C9 | C8 | C14 | 117.2° | 120.3° |
| C9 | C8 | C7 | 121.9° | 119.9° |
| C8 | C9 | H11 | 119.0° | 119.9° |
| C13 | C14 | C8 | 121.4° | 120.2° |
| C14 | C13 | H14 | 119.6° | 120.1° |
| C13 | C14 | H15 | 119.3° | 119.9° |
| C14 | C8 | C7 | 120.9° | 119.9° |
| C8 | C14 | H15 | 119.3° | 119.9° |
| C8 | C7 | C6 | 113.4° | 109.4° |
| C8 | C7 | H10 | 108.5° | 109.5° |
| C8 | C7 | H9 | 108.5° | 109.5° |
| C7 | C6 | C15 | 118.1° | 126.9° |
| C7 | C6 | N3 | 135.3° | 126.9° |
| C6 | C7 | H10 | 108.5° | 109.5° |
| C6 | C7 | H9 | 108.5° | 109.5° |
| C15 | C6 | N3 | 106.5° | 106.2° |
| C6 | C15 | N4 | 109.9° | 106.5° |
| C6 | C15 | H16 | 125.0° | 126.8° |
| C6 | N3 | N5 | 108.8° | 108.3° |
| C6 | N3 | C5 | 141.5° | 125.9° |
| C15 | N4 | N5 | 107.8° | 108.9° |
| N4 | C15 | H16 | 125.0° | 126.7° |
| N4 | N5 | N3 | 106.9° | 110.1° |
| N5 | N3 | C5 | 109.6° | 125.8° |
| N3 | C5 | C4 | 123.4° | 109.5° |
| N3 | C5 | H7 | 105.9° | 109.5° |
| N3 | C5 | H8 | 105.9° | 109.5° |
| C5 | C4 | O | 112.6° | 109.9° |
| C5 | C4 | C16 | 122.1° | 109.9° |
| C5 | C4 | H1 | 105.5° | 109.9° |
| C4 | C5 | H7 | 105.9° | 109.5° |
| C4 | C5 | H8 | 105.8° | 109.5° |
| O | C4 | C16 | 102.9° | 107.3° |
| C4 | O | C3 | 111.7° | 107.0° |
| O | C4 | H1 | 106.9° | 110.0° |
| C4 | C16 | O3 | 107.3° | 110.5° |
| C4 | C16 | C17 | 107.0° | 104.2° |
| C4 | C16 | H2 | 111.2° | 110.5° |
| C16 | C4 | H1 | 105.9° | 109.8° |
| O | C3 | C17 | 103.5° | 103.5° |
| O | C3 | N2 | 113.9° | 110.6° |
| O | C3 | H | 110.6° | 110.6° |
| O3 | C16 | C17 | 106.5° | 110.6° |
| O3 | C16 | H2 | 113.0° | 110.4° |
| C16 | O3 | H17 | 109.5° | 114.0° |
| C16 | C17 | O4 | 113.4° | 110.9° |
| C16 | C17 | C3 | 101.6° | 102.1° |
| C17 | C16 | H2 | 111.5° | 110.5° |
| C16 | C17 | H3 | 109.7° | 110.9° |
| O4 | C17 | C3 | 111.4° | 110.9° |
| O4 | C17 | H3 | 110.8° | 110.8° |
| C17 | O4 | H18 | 109.5° | 114.0° |
| C17 | C3 | N2 | 108.9° | 110.6° |
| C3 | C17 | H3 | 109.7° | 110.9° |
| C17 | C3 | H | 109.6° | 110.6° |
| C3 | N2 | C2 | 125.8° | 126.9° |
| C3 | N2 | C18 | 126.7° | 126.8° |
| N2 | C3 | H | 110.0° | 110.7° |
| C2 | N2 | C18 | 107.6° | 106.3° |
| N2 | C2 | N1 | 111.2° | 106.5° |
| N2 | C2 | H24 | 109.0° | 110.1° |
| N2 | C2 | H6 | 109.0° | 110.1° |
| N2 | C18 | C1 | 107.4° | 107.9° |
| N2 | C18 | N6 | 135.0° | 133.1° |
| C2 | N1 | C1 | 108.1° | 108.9° |
| N1 | C2 | H24 | 109.0° | 110.1° |
| N1 | C2 | H6 | 109.0° | 110.0° |
| N1 | C1 | C18 | 105.7° | 110.4° |
| N1 | C1 | C | 135.9° | 133.4° |
| C1 | C18 | N6 | 117.6° | 119.0° |
| C18 | C1 | C | 118.5° | 116.2° |
| C18 | N6 | C19 | 120.6° | 124.1° |
| C1 | C | N7 | 117.6° | 115.8° |
| C1 | C | N | 121.9° | 108.2° |
| C1 | C | H21 | 90.1° | 108.0° |
| N6 | C19 | N7 | 125.3° | 125.2° |
| N6 | C19 | H19 | 117.3° | 117.4° |
| C19 | N7 | C | 120.4° | 119.7° |
| N7 | C19 | H19 | 117.4° | 117.4° |
| N7 | C | N | 120.5° | 108.2° |
| N7 | C | H21 | 90.1° | 108.3° |
| C | N | H4 | 109.5° | 111.0° |
| C | N | H5 | 109.4° | 111.0° |
| N | C | H21 | 90.1° | 108.1° |
| H4 | N | H5 | 109.5° | 111.0° |
| H24 | C2 | H6 | 109.5° | 110.1° |
| H7 | C5 | H8 | 109.5° | 109.4° |
| H10 | C7 | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C12 | O1 | C11 | 179.1° | 180.0° |
| O2 | C12 | C11 | C10 | 0.6° | 0.0° |
| O2 | C12 | C11 | C13 | 179.1° | 180.0° |
| O2 | C12 | O1 | H13 | 0.0° | 0.1° |
| O1 | C12 | C11 | C10 | 179.7° | 180.0° |
| O1 | C12 | C11 | C13 | 0.1° | 0.0° |
| C12 | C11 | C10 | C13 | 179.8° | 180.0° |
| C12 | C11 | C10 | C9 | 179.4° | 180.0° |
| C12 | C11 | C13 | C14 | 179.5° | 180.0° |
| C12 | C11 | C10 | H12 | 0.6° | 0.3° |
| C12 | C11 | C13 | H14 | 0.5° | 0.0° |
| C11 | C12 | O1 | H13 | 179.0° | 180.0° |
| C11 | C10 | C9 | H12 | 180.0° | 179.8° |
| C11 | C10 | C9 | C8 | 0.1° | 0.0° |
| C10 | C11 | C13 | C14 | 0.3° | 0.1° |
| C10 | C11 | C13 | H14 | 179.7° | 180.0° |
| C11 | C10 | C9 | H11 | 179.9° | 179.7° |
| C13 | C11 | C10 | C9 | 0.3° | 0.0° |
| C11 | C13 | C14 | H14 | 180.0° | 179.9° |
| C11 | C13 | C14 | C8 | 0.0° | 0.1° |
| C13 | C11 | C10 | H12 | 179.7° | 179.8° |
| C11 | C13 | C14 | H15 | 180.0° | 180.0° |
| C10 | C9 | C8 | H11 | 180.0° | 179.7° |
| C10 | C9 | C8 | C14 | 0.2° | 0.0° |
| C10 | C9 | C8 | C7 | 178.7° | 180.0° |
| C9 | C8 | C14 | C13 | 0.3° | 0.1° |
| C9 | C8 | C14 | C7 | 179.0° | 180.0° |
| C9 | C8 | C7 | C6 | 160.4° | 95.1° |
| C8 | C9 | C10 | H12 | 179.9° | 179.7° |
| C9 | C8 | C14 | H15 | 179.7° | 180.0° |
| C9 | C8 | C7 | H10 | 39.8° | 144.9° |
| C9 | C8 | C7 | H9 | 79.1° | 24.9° |
| C13 | C14 | C8 | H15 | 180.0° | 179.9° |
| C13 | C14 | C8 | C7 | 178.7° | 179.9° |
| C14 | C8 | C7 | C6 | 20.7° | 84.9° |
| C8 | C14 | C13 | H14 | 180.0° | 180.0° |
| C14 | C8 | C7 | H10 | 141.3° | 35.1° |
| C14 | C8 | C7 | H9 | 99.9° | 155.2° |
| C14 | C8 | C9 | H11 | 179.8° | 179.7° |
| C8 | C7 | C6 | H10 | 120.6° | 120.0° |
| C8 | C7 | C6 | H9 | 120.6° | 119.9° |
| C8 | C7 | C6 | C15 | 66.4° | 84.3° |
| C8 | C7 | C6 | N3 | 117.1° | 95.8° |
| C7 | C8 | C14 | H15 | 1.3° | 0.0° |
| C8 | C7 | H10 | H9 | 118.2° | 120.0° |
| C7 | C8 | C9 | H11 | 1.3° | 0.3° |
| C7 | C6 | C15 | N3 | 177.4° | 179.9° |
| C7 | C6 | C15 | N4 | 179.2° | 180.0° |
| C7 | C6 | N3 | N5 | 179.1° | 180.0° |
| C7 | C6 | N3 | C5 | 5.3° | 0.1° |
| C7 | C6 | C15 | H16 | 0.7° | 0.2° |
| C6 | C7 | H10 | H9 | 118.2° | 120.0° |
| C6 | C15 | N4 | H16 | 180.0° | 179.8° |
| C6 | C15 | N4 | N5 | 0.6° | 0.1° |
| C15 | C6 | N3 | N5 | 2.3° | 0.0° |
| C15 | C6 | N3 | C5 | 177.9° | 180.0° |
| C15 | C6 | C7 | H10 | 54.2° | 35.7° |
| C15 | C6 | C7 | H9 | 173.0° | 155.7° |
| N3 | C6 | C15 | N4 | 1.8° | 0.1° |
| C6 | N3 | N5 | N4 | 1.9° | 0.0° |
| C6 | N3 | N5 | C5 | 177.1° | 180.0° |
| C6 | N3 | C5 | C4 | 127.4° | 94.9° |
| N3 | C6 | C15 | H16 | 178.2° | 179.8° |
| C6 | N3 | C5 | H7 | 5.5° | 25.2° |
| C6 | N3 | C5 | H8 | 110.7° | 145.1° |
| N3 | C6 | C7 | H10 | 122.3° | 144.2° |
| N3 | C6 | C7 | H9 | 3.5° | 24.2° |
| C15 | N4 | N5 | N3 | 0.8° | 0.0° |
| N4 | N5 | N3 | C5 | 179.0° | 180.0° |
| N5 | N4 | C15 | H16 | 179.4° | 179.8° |
| N5 | N3 | C5 | C4 | 57.0° | 85.2° |
| N5 | N3 | C5 | H7 | 178.9° | 154.8° |
| N5 | N3 | C5 | H8 | 64.9° | 34.8° |
| N3 | C5 | C4 | H7 | 121.9° | 120.0° |
| N3 | C5 | C4 | H8 | 121.9° | 120.0° |
| N3 | C5 | C4 | O | 143.1° | 67.2° |
| N3 | C5 | C4 | C16 | 19.9° | 175.0° |
| N3 | C5 | C4 | H1 | 100.7° | 54.0° |
| N3 | C5 | H7 | H8 | 113.8° | 120.0° |
| C5 | C4 | O | C16 | 133.3° | 119.4° |
| C5 | C4 | O | H1 | 115.4° | 121.1° |
| C5 | C4 | C16 | H1 | 120.4° | 121.0° |
| C5 | C4 | O | C3 | 145.8° | 145.9° |
| C5 | C4 | C16 | O3 | 130.1° | 119.7° |
| C5 | C4 | C16 | C17 | 115.9° | 121.5° |
| C5 | C4 | C16 | H2 | 6.1° | 2.8° |
| C4 | C5 | H7 | H8 | 113.7° | 120.0° |
| O | C4 | C16 | H1 | 112.0° | 119.6° |
| O | C4 | C16 | O3 | 102.4° | 120.8° |
| O | C4 | C16 | C17 | 11.6° | 2.0° |
| C4 | O | C3 | C17 | 31.6° | 40.1° |
| C4 | O | C3 | N2 | 149.7° | 158.6° |
| O | C4 | C16 | H2 | 133.6° | 116.6° |
| C4 | O | C3 | H | 85.8° | 78.4° |
| O | C4 | C5 | H7 | 95.0° | 172.8° |
| O | C4 | C5 | H8 | 21.1° | 52.8° |
| C16 | C4 | O | C3 | 12.5° | 26.5° |
| C4 | C16 | O3 | C17 | 114.3° | 114.9° |
| C4 | C16 | O3 | H2 | 122.9° | 122.6° |
| C4 | C16 | C17 | H2 | 121.7° | 118.7° |
| C4 | C16 | C17 | O4 | 149.2° | 139.1° |
| C4 | C16 | C17 | C3 | 29.5° | 20.9° |
| C4 | C16 | C17 | H3 | 86.5° | 97.3° |
| C16 | C4 | C5 | H7 | 141.8° | 55.0° |
| C16 | C4 | C5 | H8 | 102.0° | 65.0° |
| C4 | C16 | O3 | H17 | 180.0° | 180.0° |
| O | C3 | C17 | C16 | 36.2° | 37.0° |
| O | C3 | C17 | O4 | 157.2° | 155.2° |
| O | C3 | C17 | N2 | 121.6° | 118.5° |
| O | C3 | C17 | H | 118.0° | 118.5° |
| O | C3 | N2 | H | 124.9° | 123.0° |
| O | C3 | N2 | C2 | 54.1° | 53.5° |
| O | C3 | N2 | C18 | 126.7° | 126.5° |
| O | C3 | C17 | H3 | 79.8° | 81.2° |
| C3 | O | C4 | H1 | 98.8° | 92.9° |
| O3 | C16 | C17 | H2 | 123.8° | 122.5° |
| O3 | C16 | C17 | O4 | 34.7° | 20.4° |
| O3 | C16 | C17 | C3 | 85.0° | 97.9° |
| O3 | C16 | C17 | H3 | 159.0° | 143.9° |
| O3 | C16 | C4 | H1 | 9.7° | 1.3° |
| C16 | C17 | O4 | C3 | 113.8° | 112.7° |
| C16 | C17 | O4 | H3 | 123.8° | 123.6° |
| C16 | C17 | C3 | H3 | 116.0° | 118.2° |
| C16 | C17 | C3 | N2 | 157.8° | 155.5° |
| C16 | C17 | C3 | H | 81.8° | 81.4° |
| C17 | C16 | C4 | H1 | 123.7° | 117.6° |
| C17 | C16 | O3 | H17 | 65.7° | 65.2° |
| C16 | C17 | O4 | H18 | 180.0° | 61.5° |
| O4 | C17 | C3 | H3 | 123.0° | 123.6° |
| O4 | C17 | C3 | N2 | 81.2° | 86.3° |
| O4 | C17 | C16 | H2 | 89.1° | 102.2° |
| O4 | C17 | C3 | H | 39.2° | 36.8° |
| C17 | C3 | N2 | H | 120.2° | 123.0° |
| C17 | C3 | N2 | C2 | 60.8° | 60.5° |
| C17 | C3 | N2 | C18 | 118.3° | 119.5° |
| C3 | C17 | C16 | H2 | 151.3° | 139.6° |
| C3 | C17 | O4 | H18 | 66.2° | 174.2° |
| C3 | N2 | C2 | C18 | 179.3° | 180.0° |
| C3 | N2 | C2 | N1 | 179.9° | 180.0° |
| C3 | N2 | C18 | C1 | 179.9° | 180.0° |
| C3 | N2 | C18 | N6 | 1.2° | 0.0° |
| N2 | C3 | C17 | H3 | 41.8° | 37.3° |
| C3 | N2 | C2 | H24 | 59.9° | 60.7° |
| C3 | N2 | C2 | H6 | 59.6° | 60.7° |
| N2 | C2 | N1 | H24 | 120.3° | 119.3° |
| N2 | C2 | N1 | H6 | 120.3° | 119.3° |
| N2 | C2 | N1 | C1 | 0.3° | 0.1° |
| C2 | N2 | C18 | C1 | 0.6° | 0.0° |
| C2 | N2 | C18 | N6 | 179.5° | 180.0° |
| N2 | C2 | H24 | H6 | 119.2° | 121.5° |
| C2 | N2 | C3 | H | 179.0° | 176.5° |
| C18 | N2 | C2 | N1 | 0.6° | 0.0° |
| N2 | C18 | C1 | N1 | 0.4° | 0.0° |
| N2 | C18 | C1 | N6 | 179.2° | 180.0° |
| N2 | C18 | C1 | C | 179.6° | 180.0° |
| N2 | C18 | N6 | C19 | 179.5° | 180.0° |
| C18 | N2 | C2 | H24 | 120.8° | 119.2° |
| C18 | N2 | C2 | H6 | 119.7° | 119.3° |
| C18 | N2 | C3 | H | 1.9° | 3.5° |
| C2 | N1 | C1 | C18 | 0.1° | 0.0° |
| C2 | N1 | C1 | C | 180.0° | 180.0° |
| N1 | C2 | H24 | H6 | 119.2° | 121.4° |
| N1 | C1 | C18 | C | 180.0° | 180.0° |
| N1 | C1 | C18 | N6 | 179.6° | 180.0° |
| N1 | C1 | C | N7 | 179.6° | 180.0° |
| N1 | C1 | C | N | 0.0° | 58.4° |
| N1 | C1 | C | H21 | 90.2° | 58.5° |
| C1 | N1 | C2 | H24 | 120.5° | 119.2° |
| C1 | N1 | C2 | H6 | 120.0° | 119.3° |
| C1 | C18 | N6 | C19 | 0.7° | 0.0° |
| C18 | C1 | C | N7 | 0.4° | 0.0° |
| C18 | C1 | C | N | 180.0° | 121.6° |
| C18 | C1 | C | H21 | 89.8° | 121.6° |
| N6 | C18 | C1 | C | 0.5° | 0.0° |
| C18 | N6 | C19 | N7 | 0.8° | 0.0° |
| C18 | N6 | C19 | H19 | 179.2° | 180.0° |
| C1 | C | N7 | C19 | 0.5° | 0.0° |
| C1 | C | N7 | N | 179.6° | 121.6° |
| C1 | C | N7 | H21 | 90.2° | 121.4° |
| C1 | C | N | H21 | 90.2° | 116.8° |
| C1 | C | N | H4 | 180.0° | 173.8° |
| C1 | C | N | H5 | 60.0° | 62.2° |
| N6 | C19 | N7 | H19 | 180.0° | 180.0° |
| N6 | C19 | N7 | C | 0.8° | 0.0° |
| C19 | N7 | C | N | 179.9° | 121.6° |
| C19 | N7 | C | H21 | 89.7° | 121.5° |
| N7 | C | N | H21 | 90.2° | 117.1° |
| N7 | C | N | H4 | 0.4° | 60.0° |
| N7 | C | N | H5 | 119.6° | 64.0° |
| C | N7 | C19 | H19 | 179.2° | 180.0° |
| C | N | H4 | H5 | 120.0° | 124.0° |
| H4 | N | C | H21 | 89.8° | 57.0° |
| H5 | N | C | H21 | 150.2° | 179.0° |
| H12 | C10 | C9 | H11 | 0.1° | 0.1° |
| H14 | C13 | C14 | H15 | 0.0° | 0.0° |
| H2 | C16 | C17 | H3 | 35.3° | 21.4° |
| H2 | C16 | C4 | H1 | 114.4° | 123.8° |
| H2 | C16 | O3 | H17 | 57.1° | 57.4° |
| H3 | C17 | C3 | H | 162.2° | 160.4° |
| H3 | C17 | O4 | H18 | 56.2° | 62.2° |
| H1 | C4 | C5 | H7 | 21.2° | 66.0° |
| H1 | C4 | C5 | H8 | 137.4° | 174.0° |
