V52
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N3 | N2 | sing | 1.40Å | 1.36Å | Aromatic |
| N3 | C19 | doub | 1.32Å | 1.36Å | Aromatic |
| N2 | C21 | sing | 1.34Å | 1.32Å | Aromatic |
| C18 | C19 | sing | 1.41Å | 1.38Å | Aromatic |
| C18 | C17 | doub | 1.36Å | 1.38Å | Aromatic |
| C19 | C20 | sing | 1.47Å | 1.41Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.41Å | Aromatic |
| C20 | C15 | sing | 1.46Å | 1.41Å | Aromatic |
| C16 | C15 | doub | 1.38Å | 1.41Å | Aromatic |
| C16 | C22 | sing | 1.51Å | 1.51Å | |
| C15 | C9 | sing | 1.48Å | 1.49Å | |
| C8 | C9 | doub | 1.39Å | 1.37Å | Aromatic |
| C8 | C7 | sing | 1.40Å | 1.41Å | Aromatic |
| N4 | C7 | doub | 1.34Å | 1.37Å | Aromatic |
| N4 | C23 | sing | 1.31Å | 1.31Å | Aromatic |
| C9 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C7 | C6 | sing | 1.42Å | 1.43Å | Aromatic |
| C23 | N5 | doub | 1.32Å | 1.34Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.37Å | Aromatic |
| C10 | CL | sing | 1.74Å | 1.74Å | |
| N5 | C5 | sing | 1.32Å | 1.34Å | Aromatic |
| C6 | C5 | doub | 1.41Å | 1.44Å | Aromatic |
| C6 | C11 | sing | 1.40Å | 1.44Å | Aromatic |
| C5 | N1 | sing | 1.37Å | 1.44Å | |
| C11 | O1 | sing | 1.36Å | 1.37Å | |
| N1 | C4 | sing | 1.47Å | 1.47Å | |
| N1 | C13 | sing | 1.46Å | 1.47Å | |
| O1 | C12 | sing | 1.43Å | 1.44Å | |
| C4 | C3 | sing | 1.53Å | 1.51Å | |
| C12 | C13 | sing | 1.53Å | 1.50Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| C3 | N | sing | 1.47Å | 1.49Å | |
| C14 | N | sing | 1.47Å | 1.47Å | |
| N | C2 | sing | 1.35Å | 1.37Å | |
| C2 | C1 | sing | 1.51Å | 1.52Å | |
| C2 | O | doub | 1.21Å | 1.24Å | |
| C1 | C | sing | 1.53Å | 1.56Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.08Å | 1.08Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C4 | H15 | sing | 1.09Å | 1.10Å | |
| C4 | H16 | sing | 1.09Å | 1.10Å | |
| C | H17 | sing | 1.09Å | 1.10Å | |
| C | H18 | sing | 1.09Å | 1.10Å | |
| C | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.08Å | 1.08Å | |
| N2 | H21 | sing | 0.97Å | 1.00Å | |
| C18 | H22 | sing | 1.08Å | 1.08Å | |
| C17 | H23 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | N3 | C19 | 111.8° | 108.9° |
| N3 | N2 | C21 | 106.0° | 109.9° |
| N3 | N2 | H21 | 127.0° | 125.0° |
| N3 | C19 | C18 | 131.2° | 134.7° |
| N3 | C19 | C20 | 106.3° | 106.7° |
| N2 | C21 | C20 | 111.4° | 107.9° |
| N2 | C21 | H11 | 124.3° | 126.1° |
| C21 | N2 | H21 | 127.0° | 125.1° |
| C19 | C18 | C17 | 117.8° | 120.5° |
| C18 | C19 | C20 | 122.4° | 118.6° |
| C19 | C18 | H22 | 121.1° | 119.8° |
| C18 | C17 | C16 | 122.2° | 122.6° |
| C17 | C18 | H22 | 121.1° | 119.7° |
| C18 | C17 | H23 | 118.9° | 118.7° |
| C19 | C20 | C21 | 104.5° | 106.6° |
| C19 | C20 | C15 | 119.1° | 118.3° |
| C17 | C16 | C15 | 119.5° | 121.4° |
| C17 | C16 | C22 | 119.4° | 119.3° |
| C16 | C17 | H23 | 118.9° | 118.7° |
| C21 | C20 | C15 | 136.3° | 135.1° |
| C20 | C21 | H11 | 124.3° | 126.0° |
| C20 | C15 | C16 | 118.9° | 118.5° |
| C20 | C15 | C9 | 120.5° | 120.7° |
| C15 | C16 | C22 | 121.0° | 119.3° |
| C16 | C15 | C9 | 120.5° | 120.8° |
| C16 | C22 | H12 | 109.5° | 109.5° |
| C16 | C22 | H13 | 109.5° | 109.5° |
| C16 | C22 | H14 | 109.5° | 109.5° |
| C15 | C9 | C8 | 118.7° | 119.7° |
| C15 | C9 | C10 | 122.5° | 119.6° |
| C9 | C8 | C7 | 123.6° | 119.4° |
| C8 | C9 | C10 | 118.2° | 120.7° |
| C9 | C8 | H5 | 118.2° | 120.3° |
| C8 | C7 | N4 | 118.0° | 122.4° |
| C8 | C7 | C6 | 117.9° | 119.2° |
| C7 | C8 | H5 | 118.2° | 120.3° |
| C7 | N4 | C23 | 115.2° | 120.5° |
| N4 | C7 | C6 | 124.0° | 118.4° |
| N4 | C23 | N5 | 128.6° | 122.9° |
| N4 | C23 | H20 | 115.7° | 118.6° |
| C9 | C10 | C11 | 121.2° | 120.4° |
| C9 | C10 | CL | 120.5° | 119.8° |
| C7 | C6 | C5 | 112.2° | 117.7° |
| C7 | C6 | C11 | 117.8° | 120.2° |
| C23 | N5 | C5 | 115.9° | 121.2° |
| N5 | C23 | H20 | 115.7° | 118.5° |
| C11 | C10 | CL | 118.2° | 119.8° |
| C10 | C11 | C6 | 120.9° | 119.1° |
| C10 | C11 | O1 | 114.0° | 119.3° |
| N5 | C5 | C6 | 123.7° | 118.4° |
| N5 | C5 | N1 | 115.8° | 121.4° |
| C5 | C6 | C11 | 129.8° | 122.1° |
| C6 | C5 | N1 | 120.3° | 120.0° |
| C6 | C11 | O1 | 125.1° | 121.6° |
| C5 | N1 | C4 | 123.2° | 111.4° |
| C5 | N1 | C13 | 124.7° | 112.8° |
| C11 | O1 | C12 | 117.4° | 116.5° |
| C4 | N1 | C13 | 112.0° | 111.7° |
| N1 | C4 | C3 | 110.6° | 109.4° |
| N1 | C4 | H15 | 109.2° | 109.5° |
| N1 | C4 | H16 | 109.2° | 109.5° |
| N1 | C13 | C12 | 117.6° | 110.5° |
| N1 | C13 | C14 | 104.3° | 109.6° |
| N1 | C13 | H8 | 106.6° | 108.8° |
| O1 | C12 | C13 | 114.9° | 110.7° |
| O1 | C12 | H6 | 108.1° | 109.2° |
| O1 | C12 | H7 | 108.1° | 109.2° |
| C4 | C3 | N | 111.2° | 108.5° |
| C4 | C3 | H3 | 109.0° | 109.7° |
| C4 | C3 | H4 | 109.0° | 109.8° |
| C3 | C4 | H15 | 109.2° | 109.5° |
| C3 | C4 | H16 | 109.2° | 109.5° |
| C12 | C13 | C14 | 115.1° | 109.4° |
| C13 | C12 | H6 | 108.1° | 109.3° |
| C13 | C12 | H7 | 108.1° | 109.3° |
| C12 | C13 | H8 | 106.3° | 109.3° |
| C13 | C14 | N | 110.3° | 108.5° |
| C14 | C13 | H8 | 106.1° | 109.3° |
| C13 | C14 | H9 | 109.3° | 109.6° |
| C13 | C14 | H10 | 109.3° | 109.6° |
| C3 | N | C14 | 109.7° | 118.2° |
| C3 | N | C2 | 123.3° | 120.9° |
| N | C3 | H3 | 109.0° | 109.6° |
| N | C3 | H4 | 109.0° | 109.7° |
| C14 | N | C2 | 126.7° | 120.9° |
| N | C14 | H9 | 109.3° | 109.6° |
| N | C14 | H10 | 109.3° | 109.6° |
| N | C2 | C1 | 118.9° | 120.0° |
| N | C2 | O | 122.7° | 120.0° |
| C1 | C2 | O | 118.3° | 120.0° |
| C2 | C1 | C | 115.1° | 109.5° |
| C2 | C1 | H1 | 108.1° | 109.5° |
| C2 | C1 | H2 | 108.1° | 109.4° |
| C | C1 | H1 | 108.0° | 109.5° |
| C | C1 | H2 | 108.0° | 109.5° |
| C1 | C | H17 | 109.5° | 109.5° |
| C1 | C | H18 | 109.4° | 109.5° |
| C1 | C | H19 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H3 | C3 | H4 | 109.5° | 109.6° |
| H6 | C12 | H7 | 109.5° | 109.2° |
| H9 | C14 | H10 | 109.5° | 109.8° |
| H12 | C22 | H13 | 109.5° | 109.5° |
| H12 | C22 | H14 | 109.5° | 109.4° |
| H13 | C22 | H14 | 109.4° | 109.5° |
| H15 | C4 | H16 | 109.5° | 109.5° |
| H17 | C | H18 | 109.5° | 109.4° |
| H17 | C | H19 | 109.5° | 109.5° |
| H18 | C | H19 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N3 | N2 | C21 | H21 | 180.0° | 179.9° |
| N2 | N3 | C19 | C18 | 177.4° | 180.0° |
| N2 | N3 | C19 | C20 | 0.5° | 0.0° |
| N3 | N2 | C21 | C20 | 1.0° | 0.0° |
| N3 | N2 | C21 | H11 | 178.9° | 180.0° |
| C19 | N3 | N2 | C21 | 0.3° | 0.0° |
| N3 | C19 | C18 | C20 | 176.5° | 180.0° |
| N3 | C19 | C18 | C17 | 174.1° | 179.7° |
| N3 | C19 | C20 | C21 | 1.1° | 0.0° |
| N3 | C19 | C20 | C15 | 175.6° | 180.0° |
| C19 | N3 | N2 | H21 | 179.7° | 180.0° |
| N3 | C19 | C18 | H22 | 5.9° | 0.0° |
| N2 | C21 | C20 | C19 | 1.3° | 0.0° |
| N2 | C21 | C20 | H11 | 180.0° | 179.9° |
| N2 | C21 | C20 | C15 | 174.4° | 180.0° |
| C19 | C18 | C17 | H22 | 180.0° | 179.7° |
| C19 | C18 | C17 | C16 | 0.9° | 0.2° |
| C18 | C19 | C20 | C21 | 178.3° | 180.0° |
| C18 | C19 | C20 | C15 | 1.7° | 0.0° |
| C19 | C18 | C17 | H23 | 179.1° | 180.0° |
| C17 | C18 | C19 | C20 | 2.4° | 0.3° |
| C18 | C17 | C16 | H23 | 180.0° | 179.7° |
| C18 | C17 | C16 | C15 | 1.2° | 0.0° |
| C18 | C17 | C16 | C22 | 178.0° | 180.0° |
| C19 | C20 | C21 | C15 | 175.7° | 180.0° |
| C19 | C20 | C15 | C16 | 0.5° | 0.3° |
| C19 | C20 | C15 | C9 | 179.6° | 180.0° |
| C19 | C20 | C21 | H11 | 178.6° | 180.0° |
| C20 | C19 | C18 | H22 | 177.6° | 180.0° |
| C17 | C16 | C15 | C20 | 1.9° | 0.3° |
| C17 | C16 | C15 | C22 | 176.8° | 180.0° |
| C17 | C16 | C15 | C9 | 178.2° | 180.0° |
| C17 | C16 | C22 | H12 | 88.4° | 90.0° |
| C17 | C16 | C22 | H13 | 151.5° | 30.0° |
| C17 | C16 | C22 | H14 | 31.6° | 150.0° |
| C16 | C17 | C18 | H22 | 179.1° | 180.0° |
| C21 | C20 | C15 | C16 | 174.8° | 179.7° |
| C21 | C20 | C15 | C9 | 5.1° | 0.0° |
| C20 | C21 | N2 | H21 | 179.0° | 180.0° |
| C20 | C15 | C16 | C9 | 179.9° | 179.7° |
| C20 | C15 | C16 | C22 | 178.6° | 179.8° |
| C20 | C15 | C9 | C8 | 73.4° | 90.3° |
| C20 | C15 | C9 | C10 | 97.8° | 89.8° |
| C15 | C20 | C21 | H11 | 5.6° | 0.1° |
| C16 | C15 | C9 | C8 | 106.5° | 90.0° |
| C16 | C15 | C9 | C10 | 82.3° | 90.0° |
| C15 | C16 | C22 | H12 | 88.4° | 90.0° |
| C15 | C16 | C22 | H13 | 31.7° | 150.0° |
| C15 | C16 | C22 | H14 | 151.6° | 29.9° |
| C15 | C16 | C17 | H23 | 178.8° | 179.7° |
| C22 | C16 | C15 | C9 | 1.5° | 0.0° |
| C16 | C22 | H12 | H13 | 120.0° | 120.0° |
| C16 | C22 | H12 | H14 | 120.0° | 120.0° |
| C16 | C22 | H13 | H14 | 120.0° | 120.0° |
| C22 | C16 | C17 | H23 | 2.0° | 0.3° |
| C15 | C9 | C8 | C10 | 171.5° | 179.9° |
| C15 | C9 | C8 | C7 | 166.5° | 176.3° |
| C15 | C9 | C10 | C11 | 166.7° | 177.2° |
| C15 | C9 | C10 | CL | 8.3° | 2.8° |
| C15 | C9 | C8 | H5 | 13.5° | 3.9° |
| C9 | C8 | C7 | H5 | 180.0° | 179.9° |
| C9 | C8 | C7 | N4 | 175.5° | 177.3° |
| C9 | C8 | C7 | C6 | 0.1° | 2.5° |
| C8 | C9 | C10 | C11 | 4.5° | 2.7° |
| C8 | C9 | C10 | CL | 179.5° | 177.3° |
| C8 | C7 | N4 | C6 | 175.1° | 179.8° |
| C8 | C7 | N4 | C23 | 175.1° | 175.4° |
| C7 | C8 | C9 | C10 | 5.0° | 3.7° |
| C8 | C7 | C6 | C5 | 179.8° | 169.6° |
| C8 | C7 | C6 | C11 | 5.2° | 9.7° |
| C7 | N4 | C23 | N5 | 4.3° | 1.5° |
| N4 | C7 | C6 | C5 | 5.1° | 10.7° |
| N4 | C7 | C6 | C11 | 169.9° | 170.1° |
| N4 | C7 | C8 | H5 | 4.5° | 2.6° |
| C7 | N4 | C23 | H20 | 175.7° | 178.4° |
| C23 | N4 | C7 | C6 | 0.0° | 4.9° |
| N4 | C23 | N5 | H20 | 180.0° | 179.9° |
| N4 | C23 | N5 | C5 | 2.5° | 1.7° |
| C9 | C10 | C11 | CL | 175.1° | 180.0° |
| C9 | C10 | C11 | C6 | 0.9° | 4.5° |
| C9 | C10 | C11 | O1 | 177.0° | 173.1° |
| C10 | C9 | C8 | H5 | 175.0° | 176.2° |
| C7 | C6 | C11 | C10 | 5.8° | 10.6° |
| C7 | C6 | C5 | N5 | 7.0° | 10.4° |
| C7 | C6 | C5 | C11 | 174.2° | 179.2° |
| C7 | C6 | C5 | N1 | 166.7° | 165.5° |
| C7 | C6 | C11 | O1 | 171.9° | 166.8° |
| C6 | C7 | C8 | H5 | 179.9° | 177.6° |
| C23 | N5 | C5 | C6 | 3.8° | 4.5° |
| C23 | N5 | C5 | N1 | 170.3° | 171.4° |
| C10 | C11 | C6 | C5 | 179.7° | 168.6° |
| C10 | C11 | C6 | O1 | 177.6° | 177.5° |
| C10 | C11 | O1 | C12 | 143.8° | 135.7° |
| CL | C10 | C11 | C6 | 174.2° | 175.6° |
| CL | C10 | C11 | O1 | 7.9° | 6.9° |
| N5 | C5 | C6 | N1 | 173.8° | 176.0° |
| N5 | C5 | C6 | C11 | 167.2° | 170.3° |
| N5 | C5 | N1 | C4 | 39.9° | 21.8° |
| N5 | C5 | N1 | C13 | 136.6° | 104.7° |
| C5 | N5 | C23 | H20 | 177.5° | 178.2° |
| C5 | C6 | C11 | O1 | 2.1° | 13.9° |
| C6 | C5 | N1 | C4 | 134.4° | 154.1° |
| C6 | C5 | N1 | C13 | 49.2° | 79.4° |
| C11 | C6 | C5 | N1 | 19.0° | 13.7° |
| C6 | C11 | O1 | C12 | 34.0° | 41.8° |
| C5 | N1 | C4 | C13 | 176.9° | 127.1° |
| C5 | N1 | C4 | C3 | 118.4° | 64.4° |
| C5 | N1 | C13 | C12 | 15.8° | 56.7° |
| C5 | N1 | C13 | C14 | 113.1° | 63.9° |
| C5 | N1 | C13 | H8 | 134.8° | 176.7° |
| C5 | N1 | C4 | H15 | 121.4° | 55.5° |
| C5 | N1 | C4 | H16 | 1.8° | 175.6° |
| C11 | O1 | C12 | C13 | 80.1° | 87.7° |
| C11 | O1 | C12 | H6 | 40.7° | 152.0° |
| C11 | O1 | C12 | H7 | 159.1° | 32.6° |
| N1 | C4 | C3 | H15 | 120.1° | 120.0° |
| N1 | C4 | C3 | H16 | 120.2° | 120.0° |
| C4 | N1 | C13 | C12 | 167.4° | 176.9° |
| C4 | N1 | C13 | C14 | 63.7° | 62.5° |
| N1 | C4 | C3 | N | 51.2° | 53.7° |
| N1 | C4 | C3 | H3 | 171.4° | 173.4° |
| N1 | C4 | C3 | H4 | 69.0° | 66.1° |
| C4 | N1 | C13 | H8 | 48.3° | 56.9° |
| N1 | C4 | H15 | H16 | 119.5° | 120.1° |
| N1 | C13 | C12 | O1 | 55.9° | 30.6° |
| C13 | N1 | C4 | C3 | 58.5° | 62.7° |
| N1 | C13 | C12 | C14 | 123.6° | 120.7° |
| N1 | C13 | C12 | H8 | 119.2° | 119.7° |
| N1 | C13 | C14 | H8 | 112.4° | 119.1° |
| N1 | C13 | C14 | N | 65.5° | 53.4° |
| N1 | C13 | C12 | H6 | 64.9° | 150.9° |
| N1 | C13 | C12 | H7 | 176.7° | 89.7° |
| N1 | C13 | C14 | H9 | 54.6° | 66.3° |
| N1 | C13 | C14 | H10 | 174.4° | 173.1° |
| C13 | N1 | C4 | H15 | 61.7° | 177.4° |
| C13 | N1 | C4 | H16 | 178.7° | 57.3° |
| O1 | C12 | C13 | H6 | 120.8° | 120.3° |
| O1 | C12 | C13 | H7 | 120.8° | 120.3° |
| O1 | C12 | C13 | C14 | 179.5° | 151.3° |
| O1 | C12 | H6 | H7 | 117.6° | 119.4° |
| O1 | C12 | C13 | H8 | 63.4° | 89.1° |
| C4 | C3 | N | H3 | 120.2° | 119.7° |
| C4 | C3 | N | H4 | 120.2° | 119.9° |
| C4 | C3 | N | C14 | 53.5° | 51.5° |
| C4 | C3 | N | C2 | 132.2° | 128.6° |
| C4 | C3 | H3 | H4 | 119.2° | 120.6° |
| C3 | C4 | H15 | H16 | 119.5° | 120.0° |
| C12 | C13 | C14 | H8 | 117.2° | 119.6° |
| C12 | C13 | C14 | N | 164.1° | 174.7° |
| C13 | C12 | H6 | H7 | 117.5° | 119.5° |
| C12 | C13 | C14 | H9 | 75.7° | 55.0° |
| C12 | C13 | C14 | H10 | 44.0° | 65.6° |
| C13 | C14 | N | C3 | 62.0° | 51.2° |
| C13 | C14 | N | H9 | 120.1° | 119.7° |
| C13 | C14 | N | H10 | 120.1° | 119.7° |
| C13 | C14 | N | C2 | 123.9° | 128.8° |
| C14 | C13 | C12 | H6 | 58.7° | 88.4° |
| C14 | C13 | C12 | H7 | 59.7° | 31.0° |
| C13 | C14 | H9 | H10 | 119.6° | 120.5° |
| C3 | N | C14 | C2 | 174.1° | 180.0° |
| C3 | N | C2 | C1 | 8.0° | 0.0° |
| C3 | N | C2 | O | 168.3° | 180.0° |
| N | C3 | H3 | H4 | 119.2° | 120.4° |
| C3 | N | C14 | H9 | 58.1° | 68.5° |
| C3 | N | C14 | H10 | 177.8° | 170.9° |
| N | C3 | C4 | H15 | 69.0° | 173.7° |
| N | C3 | C4 | H16 | 171.4° | 66.3° |
| C14 | N | C2 | C1 | 178.7° | 180.0° |
| C14 | N | C2 | O | 5.0° | 0.0° |
| C14 | N | C3 | H3 | 173.7° | 171.2° |
| C14 | N | C3 | H4 | 66.8° | 68.4° |
| N | C14 | C13 | H8 | 46.9° | 65.7° |
| N | C14 | H9 | H10 | 119.6° | 120.5° |
| N | C2 | C1 | O | 176.5° | 180.0° |
| N | C2 | C1 | C | 124.4° | 180.0° |
| N | C2 | C1 | H1 | 114.8° | 60.0° |
| N | C2 | C1 | H2 | 3.6° | 60.0° |
| C2 | N | C3 | H3 | 12.0° | 8.8° |
| C2 | N | C3 | H4 | 107.6° | 111.5° |
| C2 | N | C14 | H9 | 116.0° | 111.5° |
| C2 | N | C14 | H10 | 3.7° | 9.1° |
| C2 | C1 | C | H1 | 120.8° | 120.0° |
| C2 | C1 | C | H2 | 120.8° | 120.0° |
| C2 | C1 | H1 | H2 | 117.5° | 120.0° |
| C2 | C1 | C | H17 | 180.0° | 60.0° |
| C2 | C1 | C | H18 | 60.0° | 60.0° |
| C2 | C1 | C | H19 | 60.0° | 179.9° |
| O | C2 | C1 | C | 52.1° | 0.0° |
| O | C2 | C1 | H1 | 68.7° | 120.0° |
| O | C2 | C1 | H2 | 172.9° | 120.0° |
| C | C1 | H1 | H2 | 117.4° | 120.0° |
| C1 | C | H17 | H18 | 120.0° | 120.0° |
| C1 | C | H17 | H19 | 120.0° | 120.0° |
| C1 | C | H18 | H19 | 120.0° | 120.0° |
| H1 | C1 | C | H17 | 59.2° | 180.0° |
| H1 | C1 | C | H18 | 179.2° | 60.0° |
| H1 | C1 | C | H19 | 60.8° | 59.9° |
| H2 | C1 | C | H17 | 59.2° | 60.0° |
| H2 | C1 | C | H18 | 60.8° | 180.0° |
| H2 | C1 | C | H19 | 179.2° | 60.1° |
| H3 | C3 | C4 | H15 | 51.3° | 66.6° |
| H3 | C3 | C4 | H16 | 68.4° | 53.4° |
| H4 | C3 | C4 | H15 | 170.8° | 53.9° |
| H4 | C3 | C4 | H16 | 51.1° | 173.9° |
| H6 | C12 | C13 | H8 | 175.8° | 31.2° |
| H7 | C12 | C13 | H8 | 57.4° | 150.6° |
| H8 | C13 | C14 | H9 | 167.0° | 174.6° |
| H8 | C13 | C14 | H10 | 73.2° | 54.0° |
| H11 | C21 | N2 | H21 | 1.1° | 0.1° |
| H12 | C22 | H13 | H14 | 120.0° | 120.0° |
| H17 | C | H18 | H19 | 120.0° | 120.0° |
| H22 | C18 | C17 | H23 | 0.9° | 0.3° |
