A1IHW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| RU1 | RU2 | sing | 2.44Å | 2.29Å | |
| RU2 | O6 | sing | 1.83Å | 2.03Å | |
| RU1 | O1 | sing | 1.83Å | 2.04Å | |
| RU2 | O2 | sing | 1.84Å | 2.04Å | |
| RU1 | O5 | sing | 1.82Å | 2.03Å | |
| RU1 | O3 | sing | 1.84Å | 2.06Å | |
| RU2 | O4 | sing | 1.82Å | 2.05Å | |
| RU2 | N2 | sing | 1.93Å | 2.04Å | |
| RU1 | N1 | sing | 1.93Å | 2.04Å | |
| N2 | C7 | sing | 1.46Å | 1.33Å | |
| N1 | C7 | sing | 1.44Å | 1.30Å | |
| O6 | C5 | sing | 1.38Å | 1.28Å | |
| O5 | C5 | sing | 1.43Å | 1.27Å | |
| C9 | C10 | sing | 1.38Å | 1.37Å | Aromatic |
| N2 | C15 | sing | 1.39Å | 1.40Å | |
| C1 | C2 | sing | 1.54Å | 1.49Å | |
| C20 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| N1 | C8 | sing | 1.41Å | 1.45Å | |
| C9 | C8 | doub | 1.39Å | 1.34Å | Aromatic |
| C5 | C6 | sing | 1.54Å | 1.52Å | |
| C8 | C13 | sing | 1.39Å | 1.43Å | Aromatic |
| C15 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.36Å | Aromatic |
| C10 | C11 | doub | 1.40Å | 1.38Å | Aromatic |
| N3 | C14 | trip | 1.14Å | 1.17Å | |
| C11 | C14 | sing | 1.43Å | 1.42Å | |
| C13 | C12 | doub | 1.38Å | 1.36Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.40Å | Aromatic |
| C17 | C18 | doub | 1.40Å | 1.37Å | Aromatic |
| C20 | C19 | doub | 1.38Å | 1.41Å | Aromatic |
| C18 | C19 | sing | 1.40Å | 1.38Å | Aromatic |
| N4 | C21 | trip | 1.14Å | 1.15Å | |
| C18 | C21 | sing | 1.43Å | 1.43Å | |
| C1 | H5 | sing | 1.10Å | 1.10Å | |
| C7 | H8 | sing | 1.10Å | 1.10Å | |
| C7 | H9 | sing | 1.10Å | 1.10Å | |
| C5 | H10 | sing | 1.12Å | 1.10Å | |
| C2 | H11 | sing | 1.09Å | 1.10Å | |
| C2 | H12 | sing | 1.09Å | 1.10Å | |
| C2 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.08Å | 1.08Å | |
| C9 | H15 | sing | 1.08Å | 1.08Å | |
| C10 | H16 | sing | 1.08Å | 1.08Å | |
| C6 | H17 | sing | 1.09Å | 1.10Å | |
| C6 | H18 | sing | 1.09Å | 1.10Å | |
| C6 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.08Å | 1.08Å | |
| C16 | H21 | sing | 1.08Å | 1.08Å | |
| C17 | H22 | sing | 1.08Å | 1.08Å | |
| C12 | H23 | sing | 1.08Å | 1.08Å | |
| C19 | H24 | sing | 1.08Å | 1.08Å | |
| O1 | C1 | sing | 1.45Å | 1.38Å | |
| O2 | C1 | sing | 1.40Å | 1.10Å | |
| O4 | H1 | sing | 0.97Å | 0.95Å | |
| O3 | H2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| RU1 | RU2 | O6 | 87.4° | 83.2° |
| RU2 | RU1 | O1 | 86.4° | 94.4° |
| RU1 | RU2 | O2 | 89.7° | 84.1° |
| RU2 | RU1 | O5 | 90.0° | 96.6° |
| RU2 | RU1 | O3 | 85.7° | 89.9° |
| RU1 | RU2 | O4 | 86.9° | 127.6° |
| RU1 | RU2 | N2 | 86.3° | 98.6° |
| RU2 | RU1 | N1 | 91.7° | 81.0° |
| O6 | RU2 | O2 | 176.8° | 167.2° |
| O6 | RU2 | O4 | 90.9° | 93.8° |
| O6 | RU2 | N2 | 84.7° | 93.2° |
| RU2 | O6 | C5 | 122.1° | 121.4° |
| O1 | RU1 | O5 | 176.2° | 168.3° |
| O1 | RU1 | O3 | 90.9° | 88.0° |
| O1 | RU1 | N1 | 89.3° | 94.3° |
| RU1 | O1 | C1 | 117.4° | 101.7° |
| O2 | RU2 | O4 | 90.4° | 93.6° |
| O2 | RU2 | N2 | 93.6° | 89.2° |
| RU2 | O2 | C1 | 121.5° | 117.9° |
| O5 | RU1 | O3 | 89.9° | 88.2° |
| O5 | RU1 | N1 | 89.7° | 91.2° |
| RU1 | O5 | C5 | 120.0° | 107.1° |
| O3 | RU1 | N1 | 177.3° | 170.8° |
| RU1 | O3 | H2 | 109.5° | 114.0° |
| O4 | RU2 | N2 | 172.1° | 133.8° |
| RU2 | O4 | H1 | 109.5° | 114.0° |
| RU2 | N2 | C7 | 122.7° | 105.3° |
| RU2 | N2 | C15 | 121.1° | 128.0° |
| RU1 | N1 | C7 | 115.7° | 115.9° |
| RU1 | N1 | C8 | 126.2° | 123.1° |
| N2 | C7 | N1 | 117.3° | 121.3° |
| C7 | N2 | C15 | 114.8° | 126.7° |
| N2 | C7 | H8 | 107.5° | 107.3° |
| N2 | C7 | H9 | 107.5° | 107.6° |
| C7 | N1 | C8 | 117.7° | 121.0° |
| N1 | C7 | H8 | 107.5° | 106.4° |
| N1 | C7 | H9 | 107.5° | 106.8° |
| O6 | C5 | O5 | 120.1° | 126.0° |
| O6 | C5 | C6 | 118.7° | 107.0° |
| O6 | C5 | H10 | 90.1° | 104.8° |
| O5 | C5 | C6 | 121.2° | 107.1° |
| O5 | C5 | H10 | 90.1° | 104.8° |
| C10 | C9 | C8 | 120.8° | 120.1° |
| C9 | C10 | C11 | 119.2° | 119.9° |
| C10 | C9 | H15 | 119.6° | 119.9° |
| C9 | C10 | H16 | 120.4° | 120.1° |
| N2 | C15 | C20 | 119.4° | 119.9° |
| N2 | C15 | C16 | 117.0° | 120.0° |
| C2 | C1 | H5 | 90.1° | 107.6° |
| C1 | C2 | H11 | 109.5° | 109.5° |
| C1 | C2 | H12 | 109.5° | 109.5° |
| C1 | C2 | H13 | 109.5° | 109.4° |
| C2 | C1 | O1 | 121.3° | 108.3° |
| C2 | C1 | O2 | 117.4° | 108.2° |
| C20 | C15 | C16 | 123.7° | 120.2° |
| C15 | C20 | C19 | 116.2° | 120.0° |
| C15 | C20 | H14 | 121.9° | 120.0° |
| N1 | C8 | C9 | 119.7° | 119.9° |
| N1 | C8 | C13 | 119.3° | 119.9° |
| C9 | C8 | C13 | 121.0° | 120.1° |
| C8 | C9 | H15 | 119.6° | 120.0° |
| C6 | C5 | H10 | 90.1° | 105.5° |
| C5 | C6 | H17 | 109.5° | 109.5° |
| C5 | C6 | H18 | 109.5° | 109.5° |
| C5 | C6 | H19 | 109.5° | 109.5° |
| C8 | C13 | C12 | 118.3° | 120.1° |
| C8 | C13 | H20 | 120.9° | 119.9° |
| C15 | C16 | C17 | 118.3° | 120.1° |
| C15 | C16 | H21 | 120.9° | 119.9° |
| C16 | C17 | C18 | 120.0° | 119.9° |
| C17 | C16 | H21 | 120.8° | 120.0° |
| C16 | C17 | H22 | 120.0° | 120.1° |
| C10 | C11 | C14 | 118.3° | 120.0° |
| C10 | C11 | C12 | 121.2° | 119.8° |
| C11 | C10 | H16 | 120.4° | 120.0° |
| N3 | C14 | C11 | 177.0° | 180.0° |
| C14 | C11 | C12 | 120.5° | 120.1° |
| C13 | C12 | C11 | 119.6° | 120.0° |
| C12 | C13 | H20 | 120.8° | 120.0° |
| C13 | C12 | H23 | 120.2° | 120.1° |
| C11 | C12 | H23 | 120.2° | 120.0° |
| C17 | C18 | C19 | 122.1° | 119.9° |
| C17 | C18 | C21 | 120.2° | 120.1° |
| C18 | C17 | H22 | 120.0° | 120.0° |
| C20 | C19 | C18 | 119.8° | 119.9° |
| C19 | C20 | H14 | 121.9° | 120.0° |
| C20 | C19 | H24 | 120.1° | 120.0° |
| C19 | C18 | C21 | 117.7° | 120.0° |
| C18 | C19 | H24 | 120.1° | 120.1° |
| N4 | C21 | C18 | 176.0° | 179.9° |
| H5 | C1 | O1 | 90.1° | 107.3° |
| H5 | C1 | O2 | 90.0° | 107.1° |
| H8 | C7 | H9 | 109.5° | 106.7° |
| H11 | C2 | H12 | 109.5° | 109.5° |
| H11 | C2 | H13 | 109.4° | 109.5° |
| H12 | C2 | H13 | 109.4° | 109.5° |
| H17 | C6 | H18 | 109.5° | 109.5° |
| H17 | C6 | H19 | 109.4° | 109.4° |
| H18 | C6 | H19 | 109.5° | 109.4° |
| O1 | C1 | O2 | 121.3° | 117.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| RU1 | RU2 | O6 | O2 | 27.3° | 2.1° |
| RU1 | RU2 | O6 | O4 | 86.8° | 127.4° |
| RU1 | RU2 | O6 | N2 | 86.6° | 98.3° |
| RU2 | RU1 | O1 | O5 | 16.8° | 160.9° |
| RU2 | RU1 | O1 | O3 | 85.6° | 89.8° |
| RU2 | RU1 | O1 | N1 | 91.7° | 81.3° |
| RU1 | RU2 | O2 | O4 | 86.9° | 127.4° |
| RU1 | RU2 | O2 | N2 | 86.3° | 98.8° |
| RU2 | RU1 | O5 | O3 | 85.7° | 89.7° |
| RU2 | RU1 | O5 | N1 | 91.7° | 81.1° |
| RU2 | RU1 | O3 | N1 | 9.5° | 10.5° |
| RU1 | RU2 | O4 | N2 | 30.9° | 177.5° |
| RU1 | RU2 | N2 | C7 | 2.0° | 4.7° |
| RU2 | RU1 | N1 | C7 | 23.2° | 38.8° |
| RU1 | RU2 | O6 | C5 | 6.5° | 16.1° |
| RU2 | RU1 | O5 | C5 | 4.2° | 21.0° |
| RU1 | RU2 | N2 | C15 | 167.8° | 175.3° |
| RU2 | RU1 | N1 | C8 | 164.0° | 141.3° |
| RU2 | RU1 | O1 | C1 | 14.5° | 37.1° |
| RU1 | RU2 | O2 | C1 | 5.7° | 9.8° |
| RU1 | RU2 | O4 | H1 | 180.0° | 180.0° |
| RU2 | RU1 | O3 | H2 | 180.0° | 179.9° |
| O6 | RU2 | RU1 | O1 | 176.8° | 164.3° |
| O6 | RU2 | O2 | O4 | 114.2° | 125.3° |
| O6 | RU2 | O2 | N2 | 59.0° | 100.9° |
| O6 | RU2 | RU1 | O5 | 4.3° | 19.5° |
| O6 | RU2 | RU1 | O3 | 85.5° | 107.6° |
| O6 | RU2 | O4 | N2 | 56.5° | 98.1° |
| O6 | RU2 | RU1 | N1 | 94.0° | 70.7° |
| O6 | RU2 | N2 | C7 | 85.8° | 78.9° |
| RU2 | O6 | C5 | O5 | 4.9° | 4.7° |
| O6 | RU2 | N2 | C15 | 80.1° | 101.1° |
| RU2 | O6 | C5 | C6 | 174.7° | 131.8° |
| RU2 | O6 | C5 | H10 | 95.1° | 116.4° |
| O6 | RU2 | O2 | C1 | 21.6° | 7.7° |
| O6 | RU2 | O4 | H1 | 92.6° | 95.7° |
| O1 | RU1 | RU2 | O2 | 4.7° | 16.1° |
| O1 | RU1 | O5 | O3 | 102.4° | 71.2° |
| O1 | RU1 | O5 | N1 | 74.9° | 118.0° |
| O1 | RU1 | O3 | N1 | 95.9° | 104.9° |
| O1 | RU1 | RU2 | O4 | 85.7° | 106.1° |
| O1 | RU1 | RU2 | N2 | 98.4° | 72.1° |
| O1 | RU1 | N1 | C7 | 109.6° | 55.0° |
| O1 | RU1 | O5 | C5 | 20.9° | 178.1° |
| RU1 | O1 | C1 | C2 | 156.1° | 179.2° |
| O1 | RU1 | N1 | C8 | 77.6° | 124.9° |
| RU1 | O1 | C1 | H5 | 113.8° | 64.9° |
| RU1 | O1 | C1 | O2 | 23.7° | 56.0° |
| O1 | RU1 | O3 | H2 | 93.7° | 85.6° |
| O2 | RU2 | RU1 | O5 | 174.2° | 160.1° |
| O2 | RU2 | RU1 | O3 | 95.9° | 71.9° |
| O2 | RU2 | O4 | N2 | 120.6° | 92.3° |
| O2 | RU2 | RU1 | N1 | 84.5° | 109.8° |
| O2 | RU2 | N2 | C7 | 91.4° | 88.5° |
| O2 | RU2 | O6 | C5 | 20.9° | 14.0° |
| O2 | RU2 | N2 | C15 | 102.7° | 91.4° |
| RU2 | O2 | C1 | C2 | 161.0° | 168.0° |
| RU2 | O2 | C1 | H5 | 108.9° | 76.2° |
| RU2 | O2 | C1 | O1 | 18.8° | 44.8° |
| O2 | RU2 | O4 | H1 | 90.3° | 94.7° |
| O5 | RU1 | O3 | N1 | 80.4° | 86.2° |
| O5 | RU1 | RU2 | O4 | 95.4° | 70.1° |
| O5 | RU1 | RU2 | N2 | 80.5° | 111.7° |
| O5 | RU1 | N1 | C7 | 66.8° | 135.3° |
| RU1 | O5 | C5 | O6 | 0.4° | 15.4° |
| O5 | RU1 | N1 | C8 | 106.1° | 44.8° |
| RU1 | O5 | C5 | C6 | 180.0° | 111.7° |
| RU1 | O5 | C5 | H10 | 89.8° | 136.6° |
| O5 | RU1 | O1 | C1 | 2.2° | 123.9° |
| O5 | RU1 | O3 | H2 | 90.0° | 83.3° |
| O3 | RU1 | RU2 | O4 | 5.5° | 18.0° |
| O3 | RU1 | RU2 | N2 | 170.4° | 160.2° |
| O3 | RU1 | N1 | C7 | 13.7° | 49.4° |
| O3 | RU1 | O5 | C5 | 81.5° | 110.7° |
| O3 | RU1 | N1 | C8 | 173.5° | 130.7° |
| O3 | RU1 | O1 | C1 | 100.1° | 52.7° |
| O4 | RU2 | RU1 | N1 | 174.9° | 160.3° |
| O4 | RU2 | N2 | C7 | 29.0° | 177.3° |
| O4 | RU2 | O6 | C5 | 93.3° | 111.3° |
| O4 | RU2 | N2 | C15 | 136.9° | 2.7° |
| O4 | RU2 | O2 | C1 | 92.6° | 117.7° |
| N2 | RU2 | RU1 | N1 | 9.1° | 21.5° |
| RU2 | N2 | C7 | C15 | 166.7° | 179.9° |
| RU2 | N2 | C7 | N1 | 20.1° | 24.2° |
| N2 | RU2 | O6 | C5 | 80.1° | 114.5° |
| RU2 | N2 | C15 | C20 | 108.0° | 180.0° |
| RU2 | N2 | C15 | C16 | 70.0° | 0.0° |
| RU2 | N2 | C7 | H8 | 141.2° | 98.1° |
| RU2 | N2 | C7 | H9 | 101.0° | 147.4° |
| N2 | RU2 | O2 | C1 | 80.6° | 108.5° |
| N2 | RU2 | O4 | H1 | 149.1° | 2.4° |
| RU1 | N1 | C7 | N2 | 29.3° | 50.8° |
| RU1 | N1 | C7 | C8 | 173.5° | 179.9° |
| N1 | RU1 | O5 | C5 | 95.9° | 60.1° |
| RU1 | N1 | C8 | C9 | 117.0° | 12.9° |
| RU1 | N1 | C8 | C13 | 62.5° | 167.0° |
| RU1 | N1 | C7 | H8 | 150.4° | 71.9° |
| RU1 | N1 | C7 | H9 | 91.8° | 174.4° |
| N1 | RU1 | O1 | C1 | 77.2° | 118.4° |
| N1 | RU1 | O3 | H2 | 170.5° | 169.5° |
| N2 | C7 | N1 | H8 | 121.1° | 122.7° |
| N2 | C7 | N1 | H9 | 121.1° | 123.6° |
| C7 | N2 | C15 | C20 | 85.1° | 0.1° |
| N2 | C7 | N1 | C8 | 157.2° | 129.3° |
| C7 | N2 | C15 | C16 | 96.9° | 179.9° |
| N2 | C7 | H8 | H9 | 116.5° | 115.1° |
| N1 | C7 | N2 | C15 | 173.2° | 155.9° |
| C7 | N1 | C8 | C9 | 70.3° | 166.9° |
| C7 | N1 | C8 | C13 | 110.2° | 13.1° |
| N1 | C7 | H8 | H9 | 116.5° | 113.7° |
| O6 | C5 | O5 | C6 | 179.6° | 127.1° |
| O6 | C5 | O5 | H10 | 90.2° | 121.2° |
| O6 | C5 | C6 | H10 | 90.2° | 111.2° |
| O6 | C5 | C6 | H17 | 180.0° | 75.1° |
| O6 | C5 | C6 | H18 | 60.0° | 164.8° |
| O6 | C5 | C6 | H19 | 60.0° | 44.9° |
| O5 | C5 | C6 | H10 | 90.2° | 111.2° |
| O5 | C5 | C6 | H17 | 0.4° | 147.3° |
| O5 | C5 | C6 | H18 | 119.6° | 27.3° |
| O5 | C5 | C6 | H19 | 120.4° | 92.7° |
| C10 | C9 | C8 | N1 | 180.0° | 179.9° |
| C10 | C9 | C8 | H15 | 180.0° | 179.8° |
| C10 | C9 | C8 | C13 | 0.5° | 0.0° |
| C9 | C10 | C11 | H16 | 180.0° | 179.9° |
| C9 | C10 | C11 | C14 | 179.7° | 180.0° |
| C9 | C10 | C11 | C12 | 0.4° | 0.0° |
| N2 | C15 | C20 | C16 | 177.8° | 180.0° |
| N2 | C15 | C16 | C17 | 178.9° | 180.0° |
| N2 | C15 | C20 | C19 | 178.5° | 180.0° |
| C15 | N2 | C7 | H8 | 52.1° | 81.8° |
| C15 | N2 | C7 | H9 | 65.7° | 32.6° |
| N2 | C15 | C20 | H14 | 1.5° | 0.2° |
| N2 | C15 | C16 | H21 | 1.1° | 0.0° |
| C2 | C1 | H5 | O1 | 121.3° | 116.4° |
| C2 | C1 | H5 | O2 | 117.4° | 116.2° |
| C1 | C2 | H11 | H12 | 120.0° | 120.0° |
| C1 | C2 | H11 | H13 | 120.0° | 119.9° |
| C1 | C2 | H12 | H13 | 120.0° | 119.9° |
| C2 | C1 | O1 | O2 | 179.8° | 123.2° |
| C20 | C15 | C16 | C17 | 1.0° | 0.0° |
| C15 | C20 | C19 | H14 | 180.0° | 179.8° |
| C15 | C20 | C19 | C18 | 0.4° | 0.0° |
| C20 | C15 | C16 | H21 | 179.0° | 180.0° |
| C15 | C20 | C19 | H24 | 179.6° | 180.0° |
| N1 | C8 | C9 | C13 | 179.5° | 180.0° |
| N1 | C8 | C13 | C12 | 179.5° | 180.0° |
| C8 | N1 | C7 | H8 | 36.1° | 108.0° |
| C8 | N1 | C7 | H9 | 81.7° | 5.7° |
| N1 | C8 | C9 | H15 | 0.0° | 0.3° |
| N1 | C8 | C13 | H20 | 0.5° | 0.1° |
| C8 | C9 | C10 | C11 | 0.7° | 0.1° |
| C9 | C8 | C13 | C12 | 0.0° | 0.0° |
| C8 | C9 | C10 | H16 | 179.3° | 180.0° |
| C9 | C8 | C13 | H20 | 180.0° | 179.9° |
| C5 | C6 | H17 | H18 | 120.0° | 120.1° |
| C5 | C6 | H17 | H19 | 120.0° | 120.0° |
| C5 | C6 | H18 | H19 | 120.0° | 120.0° |
| C8 | C13 | C12 | H20 | 180.0° | 179.9° |
| C8 | C13 | C12 | C11 | 0.3° | 0.1° |
| C13 | C8 | C9 | H15 | 179.5° | 179.7° |
| C8 | C13 | C12 | H23 | 179.7° | 180.0° |
| C15 | C16 | C17 | H21 | 180.0° | 179.9° |
| C15 | C16 | C17 | C18 | 0.3° | 0.0° |
| C16 | C15 | C20 | C19 | 0.6° | 0.0° |
| C16 | C15 | C20 | H14 | 179.3° | 179.7° |
| C15 | C16 | C17 | H22 | 179.7° | 180.0° |
| C16 | C17 | C18 | H22 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 0.8° | 0.0° |
| C16 | C17 | C18 | C21 | 179.9° | 180.0° |
| C10 | C11 | C14 | N3 | 2.9° | 165.1° |
| C10 | C11 | C14 | C12 | 179.9° | 180.0° |
| C10 | C11 | C12 | C13 | 0.1° | 0.1° |
| C11 | C10 | C9 | H15 | 179.3° | 179.7° |
| C10 | C11 | C12 | H23 | 179.9° | 180.0° |
| N3 | C14 | C11 | C12 | 177.0° | 14.8° |
| C14 | C11 | C12 | C13 | 179.9° | 180.0° |
| C14 | C11 | C10 | H16 | 0.4° | 0.1° |
| C14 | C11 | C12 | H23 | 0.2° | 0.0° |
| C13 | C12 | C11 | H23 | 180.0° | 179.9° |
| C12 | C11 | C10 | H16 | 179.6° | 179.9° |
| C11 | C12 | C13 | H20 | 179.7° | 180.0° |
| C17 | C18 | C19 | C20 | 1.1° | 0.0° |
| C17 | C18 | C19 | C21 | 179.1° | 180.0° |
| C17 | C18 | C21 | N4 | 3.8° | 12.5° |
| C18 | C17 | C16 | H21 | 179.7° | 180.0° |
| C17 | C18 | C19 | H24 | 178.8° | 180.0° |
| C20 | C19 | C18 | H24 | 180.0° | 180.0° |
| C20 | C19 | C18 | C21 | 179.7° | 180.0° |
| C19 | C18 | C21 | N4 | 177.1° | 167.5° |
| C18 | C19 | C20 | H14 | 179.6° | 179.8° |
| C19 | C18 | C17 | H22 | 179.2° | 180.0° |
| C21 | C18 | C17 | H22 | 0.1° | 0.0° |
| C21 | C18 | C19 | H24 | 0.3° | 0.0° |
| H5 | C1 | C2 | H11 | 89.9° | 55.7° |
| H5 | C1 | C2 | H12 | 150.1° | 64.3° |
| H5 | C1 | C2 | H13 | 30.1° | 175.7° |
| H5 | C1 | O1 | O2 | 90.1° | 120.9° |
| H10 | C5 | C6 | H17 | 89.8° | 36.1° |
| H10 | C5 | C6 | H18 | 150.2° | 84.0° |
| H10 | C5 | C6 | H19 | 30.2° | 156.1° |
| H11 | C2 | H12 | H13 | 119.9° | 120.1° |
| H11 | C2 | C1 | O1 | 180.0° | 60.0° |
| H11 | C2 | C1 | O2 | 0.2° | 171.2° |
| H12 | C2 | C1 | O1 | 60.0° | 180.0° |
| H12 | C2 | C1 | O2 | 119.8° | 51.2° |
| H13 | C2 | C1 | O1 | 60.0° | 60.0° |
| H13 | C2 | C1 | O2 | 120.2° | 68.8° |
| H14 | C20 | C19 | H24 | 0.4° | 0.2° |
| H15 | C9 | C10 | H16 | 0.7° | 0.2° |
| H17 | C6 | H18 | H19 | 120.0° | 119.9° |
| H20 | C13 | C12 | H23 | 0.3° | 0.1° |
| H21 | C16 | C17 | H22 | 0.3° | 0.1° |
