P8N
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C13 | doub | 1.22Å | 1.24Å | |
| O2 | N3 | sing | 1.42Å | 1.39Å | |
| C13 | C12 | sing | 1.46Å | 1.48Å | |
| C13 | N3 | sing | 1.35Å | 1.33Å | |
| C12 | C11 | doub | 1.35Å | 1.33Å | |
| C11 | C10 | sing | 1.47Å | 1.47Å | |
| C9 | C10 | doub | 1.40Å | 1.40Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C14 | sing | 1.40Å | 1.39Å | Aromatic |
| C8 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| CL | C20 | sing | 1.74Å | 1.74Å | |
| C14 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.51Å | 1.51Å | |
| C19 | C20 | doub | 1.38Å | 1.37Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | N2 | sing | 1.46Å | 1.46Å | |
| C20 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | C17 | doub | 1.39Å | 1.39Å | Aromatic |
| N2 | C5 | sing | 1.35Å | 1.33Å | |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C22 | sing | 1.39Å | 1.39Å | Aromatic |
| C17 | C16 | sing | 1.48Å | 1.48Å | |
| C5 | O | doub | 1.21Å | 1.23Å | |
| C5 | C4 | sing | 1.51Å | 1.52Å | |
| N4 | C16 | doub | 1.29Å | 1.28Å | |
| N4 | C3 | sing | 1.46Å | 1.47Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C16 | C23 | sing | 1.48Å | 1.50Å | |
| C3 | C2 | sing | 1.51Å | 1.51Å | |
| C25 | C24 | sing | 1.51Å | 1.50Å | |
| C23 | C24 | sing | 1.45Å | 1.45Å | Aromatic |
| C23 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | N1 | doub | 1.30Å | 1.31Å | Aromatic |
| C2 | N5 | sing | 1.36Å | 1.38Å | Aromatic |
| C24 | C26 | doub | 1.32Å | 1.36Å | Aromatic |
| N1 | N | sing | 1.29Å | 1.40Å | Aromatic |
| N5 | C28 | sing | 1.40Å | 1.41Å | |
| N5 | C1 | sing | 1.35Å | 1.38Å | Aromatic |
| C28 | S | sing | 1.71Å | 1.72Å | Aromatic |
| N | C1 | doub | 1.31Å | 1.31Å | Aromatic |
| C26 | C27 | sing | 1.51Å | 1.50Å | |
| C26 | S | sing | 1.75Å | 1.73Å | Aromatic |
| C1 | C | sing | 1.51Å | 1.49Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| N2 | H6 | sing | 0.97Å | 1.00Å | |
| C9 | H7 | sing | 1.08Å | 1.08Å | |
| C11 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| N3 | H10 | sing | 0.97Å | 1.00Å | |
| C14 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H12 | sing | 1.08Å | 1.08Å | |
| C19 | H13 | sing | 1.08Å | 1.08Å | |
| C18 | H14 | sing | 1.08Å | 1.08Å | |
| C21 | H15 | sing | 1.08Å | 1.08Å | |
| C22 | H16 | sing | 1.08Å | 1.08Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C | H23 | sing | 1.09Å | 1.10Å | |
| C | H24 | sing | 1.09Å | 1.10Å | |
| C | H25 | sing | 1.09Å | 1.10Å | |
| C3 | H26 | sing | 1.09Å | 1.10Å | |
| O2 | H27 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C13 | C12 | 123.1° | 120.0° |
| O1 | C13 | N3 | 123.0° | 120.0° |
| O2 | N3 | C13 | 119.6° | 120.0° |
| O2 | N3 | H10 | 120.2° | 120.0° |
| N3 | O2 | H27 | 109.5° | 114.0° |
| C12 | C13 | N3 | 113.9° | 120.0° |
| C13 | C12 | C11 | 120.2° | 120.0° |
| C13 | C12 | H9 | 119.9° | 120.0° |
| C13 | N3 | H10 | 120.2° | 120.0° |
| C12 | C11 | C10 | 128.4° | 120.0° |
| C12 | C11 | H8 | 115.8° | 120.1° |
| C11 | C12 | H9 | 119.9° | 120.0° |
| C11 | C10 | C9 | 122.9° | 120.2° |
| C11 | C10 | C14 | 119.6° | 120.2° |
| C10 | C11 | H8 | 115.8° | 120.0° |
| C10 | C9 | C8 | 121.0° | 119.9° |
| C9 | C10 | C14 | 117.5° | 119.6° |
| C10 | C9 | H7 | 119.5° | 120.1° |
| C9 | C8 | C7 | 121.0° | 120.2° |
| C9 | C8 | H5 | 119.5° | 120.0° |
| C8 | C9 | H7 | 119.5° | 120.1° |
| C10 | C14 | C15 | 121.2° | 119.9° |
| C10 | C14 | H11 | 119.4° | 120.1° |
| C8 | C7 | C15 | 118.2° | 120.3° |
| C8 | C7 | C6 | 121.3° | 119.8° |
| C7 | C8 | H5 | 119.5° | 119.9° |
| CL | C20 | C19 | 119.4° | 119.9° |
| CL | C20 | C21 | 119.3° | 119.9° |
| C14 | C15 | C7 | 121.0° | 120.2° |
| C15 | C14 | H11 | 119.4° | 120.0° |
| C14 | C15 | H12 | 119.5° | 120.0° |
| C15 | C7 | C6 | 120.5° | 119.8° |
| C7 | C15 | H12 | 119.5° | 119.9° |
| C7 | C6 | N2 | 113.8° | 109.5° |
| C7 | C6 | H3 | 108.4° | 109.4° |
| C7 | C6 | H4 | 108.4° | 109.5° |
| C20 | C19 | C18 | 119.3° | 120.2° |
| C19 | C20 | C21 | 121.3° | 120.2° |
| C20 | C19 | H13 | 120.4° | 119.9° |
| C19 | C18 | C17 | 120.8° | 119.9° |
| C18 | C19 | H13 | 120.3° | 119.9° |
| C19 | C18 | H14 | 119.6° | 120.1° |
| C6 | N2 | C5 | 122.1° | 120.0° |
| N2 | C6 | H3 | 108.4° | 109.5° |
| N2 | C6 | H4 | 108.4° | 109.5° |
| C6 | N2 | H6 | 118.9° | 120.0° |
| C20 | C21 | C22 | 119.2° | 120.1° |
| C20 | C21 | H15 | 120.4° | 119.9° |
| C18 | C17 | C22 | 118.6° | 119.8° |
| C18 | C17 | C16 | 119.9° | 120.1° |
| C17 | C18 | H14 | 119.6° | 120.1° |
| N2 | C5 | O | 122.8° | 120.0° |
| N2 | C5 | C4 | 116.2° | 120.0° |
| C5 | N2 | H6 | 119.0° | 120.0° |
| C21 | C22 | C17 | 120.8° | 119.9° |
| C22 | C21 | H15 | 120.4° | 119.9° |
| C21 | C22 | H16 | 119.6° | 120.0° |
| C22 | C17 | C16 | 121.5° | 120.1° |
| C17 | C22 | H16 | 119.6° | 120.1° |
| C17 | C16 | N4 | 116.6° | 117.0° |
| C17 | C16 | C23 | 118.1° | 117.0° |
| O | C5 | C4 | 121.0° | 120.0° |
| C5 | C4 | C3 | 107.1° | 109.5° |
| C5 | C4 | H1 | 110.1° | 109.4° |
| C5 | C4 | H2 | 110.1° | 109.5° |
| C16 | N4 | C3 | 117.8° | 122.5° |
| N4 | C16 | C23 | 125.1° | 126.0° |
| N4 | C3 | C4 | 109.8° | 109.5° |
| N4 | C3 | C2 | 108.1° | 109.1° |
| N4 | C3 | H26 | 109.4° | 109.6° |
| C4 | C3 | C2 | 112.2° | 109.5° |
| C3 | C4 | H1 | 110.1° | 109.5° |
| C3 | C4 | H2 | 110.1° | 109.5° |
| C4 | C3 | H26 | 108.5° | 109.5° |
| C16 | C23 | C24 | 127.0° | 123.5° |
| C16 | C23 | C28 | 121.3° | 124.8° |
| C3 | C2 | N1 | 130.8° | 127.8° |
| C3 | C2 | N5 | 119.6° | 125.1° |
| C2 | C3 | H26 | 108.8° | 109.5° |
| C25 | C24 | C23 | 125.0° | 123.0° |
| C25 | C24 | C26 | 122.7° | 123.0° |
| C24 | C25 | H20 | 109.5° | 109.5° |
| C24 | C25 | H21 | 109.5° | 109.4° |
| C24 | C25 | H22 | 109.5° | 109.5° |
| C24 | C23 | C28 | 111.8° | 111.7° |
| C23 | C24 | C26 | 112.2° | 114.0° |
| C23 | C28 | N5 | 125.7° | 124.1° |
| C23 | C28 | S | 112.0° | 111.0° |
| N1 | C2 | N5 | 109.6° | 107.1° |
| C2 | N1 | N | 107.5° | 109.7° |
| C2 | N5 | C28 | 122.8° | 124.5° |
| C2 | N5 | C1 | 105.3° | 106.5° |
| C24 | C26 | C27 | 129.0° | 124.7° |
| C24 | C26 | S | 112.2° | 110.7° |
| N1 | N | C1 | 108.1° | 110.0° |
| C28 | N5 | C1 | 131.9° | 129.0° |
| N5 | C28 | S | 122.2° | 124.9° |
| N5 | C1 | N | 109.5° | 106.7° |
| N5 | C1 | C | 124.9° | 126.6° |
| C28 | S | C26 | 91.7° | 92.6° |
| N | C1 | C | 125.5° | 126.6° |
| C27 | C26 | S | 118.8° | 124.7° |
| C26 | C27 | H17 | 109.5° | 109.5° |
| C26 | C27 | H18 | 109.5° | 109.4° |
| C26 | C27 | H19 | 109.5° | 109.5° |
| C1 | C | H23 | 109.5° | 109.5° |
| C1 | C | H24 | 109.5° | 109.5° |
| C1 | C | H25 | 109.5° | 109.5° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H3 | C6 | H4 | 109.5° | 109.5° |
| H17 | C27 | H18 | 109.5° | 109.5° |
| H17 | C27 | H19 | 109.5° | 109.5° |
| H18 | C27 | H19 | 109.4° | 109.5° |
| H20 | C25 | H21 | 109.5° | 109.5° |
| H20 | C25 | H22 | 109.4° | 109.5° |
| H21 | C25 | H22 | 109.5° | 109.5° |
| H23 | C | H24 | 109.5° | 109.4° |
| H23 | C | H25 | 109.5° | 109.4° |
| H24 | C | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C13 | N3 | O2 | 38.6° | 0.0° |
| O1 | C13 | C12 | N3 | 177.0° | 180.0° |
| O1 | C13 | C12 | C11 | 176.0° | 0.1° |
| O1 | C13 | C12 | H9 | 4.0° | 180.0° |
| O1 | C13 | N3 | H10 | 141.4° | 179.9° |
| O2 | N3 | C13 | C12 | 138.3° | 180.0° |
| O2 | N3 | C13 | H10 | 180.0° | 179.9° |
| C13 | C12 | C11 | H9 | 180.0° | 179.9° |
| C13 | C12 | C11 | C10 | 173.1° | 180.0° |
| C13 | C12 | C11 | H8 | 6.9° | 0.0° |
| C12 | C13 | N3 | H10 | 41.6° | 0.0° |
| N3 | C13 | C12 | C11 | 7.0° | 180.0° |
| N3 | C13 | C12 | H9 | 172.9° | 0.0° |
| C13 | N3 | O2 | H27 | 16.8° | 179.9° |
| C12 | C11 | C10 | H8 | 180.0° | 180.0° |
| C12 | C11 | C10 | C9 | 2.9° | 180.0° |
| C12 | C11 | C10 | C14 | 176.1° | 0.0° |
| C11 | C10 | C9 | C14 | 179.0° | 180.0° |
| C11 | C10 | C9 | C8 | 177.5° | 179.9° |
| C11 | C10 | C14 | C15 | 176.9° | 179.9° |
| C11 | C10 | C9 | H7 | 2.5° | 0.0° |
| C10 | C11 | C12 | H9 | 6.9° | 0.1° |
| C11 | C10 | C14 | H11 | 3.1° | 0.0° |
| C10 | C9 | C8 | H7 | 180.0° | 179.9° |
| C10 | C9 | C8 | C7 | 0.1° | 0.1° |
| C9 | C10 | C14 | C15 | 2.2° | 0.1° |
| C10 | C9 | C8 | H5 | 179.9° | 180.0° |
| C9 | C10 | C11 | H8 | 177.1° | 0.0° |
| C9 | C10 | C14 | H11 | 177.9° | 180.0° |
| C8 | C9 | C10 | C14 | 1.6° | 0.1° |
| C9 | C8 | C7 | H5 | 180.0° | 179.9° |
| C9 | C8 | C7 | C15 | 1.2° | 0.1° |
| C9 | C8 | C7 | C6 | 178.1° | 179.8° |
| C10 | C14 | C15 | H11 | 180.0° | 179.9° |
| C10 | C14 | C15 | C7 | 1.1° | 0.1° |
| C14 | C10 | C9 | H7 | 178.5° | 180.0° |
| C14 | C10 | C11 | H8 | 3.9° | 180.0° |
| C10 | C14 | C15 | H12 | 178.9° | 179.7° |
| C8 | C7 | C15 | C14 | 0.6° | 0.1° |
| C8 | C7 | C15 | C6 | 179.3° | 179.7° |
| C8 | C7 | C6 | N2 | 68.4° | 89.7° |
| C8 | C7 | C6 | H3 | 170.9° | 30.3° |
| C8 | C7 | C6 | H4 | 52.2° | 150.3° |
| C7 | C8 | C9 | H7 | 179.9° | 180.0° |
| C8 | C7 | C15 | H12 | 179.4° | 179.7° |
| CL | C20 | C19 | C21 | 179.2° | 179.7° |
| CL | C20 | C19 | C18 | 179.4° | 180.0° |
| CL | C20 | C21 | C22 | 179.8° | 179.9° |
| CL | C20 | C19 | H13 | 0.6° | 0.1° |
| CL | C20 | C21 | H15 | 0.2° | 0.0° |
| C14 | C15 | C7 | H12 | 180.0° | 179.8° |
| C14 | C15 | C7 | C6 | 178.7° | 179.8° |
| C15 | C7 | C6 | N2 | 110.8° | 90.0° |
| C15 | C7 | C6 | H3 | 9.8° | 150.0° |
| C15 | C7 | C6 | H4 | 128.6° | 30.0° |
| C15 | C7 | C8 | H5 | 178.8° | 180.0° |
| C7 | C15 | C14 | H11 | 178.9° | 180.0° |
| C7 | C6 | N2 | H3 | 120.6° | 120.0° |
| C7 | C6 | N2 | H4 | 120.6° | 120.0° |
| C7 | C6 | N2 | C5 | 78.3° | 180.0° |
| C7 | C6 | H3 | H4 | 118.1° | 120.0° |
| C6 | C7 | C8 | H5 | 1.9° | 0.3° |
| C7 | C6 | N2 | H6 | 101.7° | 0.1° |
| C6 | C7 | C15 | H12 | 1.3° | 0.0° |
| C20 | C19 | C18 | H13 | 180.0° | 179.9° |
| C20 | C19 | C18 | C17 | 0.9° | 0.0° |
| C19 | C20 | C21 | C22 | 1.0° | 0.2° |
| C20 | C19 | C18 | H14 | 179.1° | 179.9° |
| C19 | C20 | C21 | H15 | 179.0° | 179.7° |
| C18 | C19 | C20 | C21 | 0.2° | 0.2° |
| C19 | C18 | C17 | H14 | 180.0° | 179.9° |
| C19 | C18 | C17 | C22 | 1.2° | 0.3° |
| C19 | C18 | C17 | C16 | 176.1° | 180.0° |
| C6 | N2 | C5 | H6 | 180.0° | 179.9° |
| C6 | N2 | C5 | O | 2.6° | 0.0° |
| C6 | N2 | C5 | C4 | 175.7° | 180.0° |
| N2 | C6 | H3 | H4 | 118.0° | 120.1° |
| C20 | C21 | C22 | H15 | 180.0° | 179.9° |
| C20 | C21 | C22 | C17 | 0.7° | 0.1° |
| C21 | C20 | C19 | H13 | 179.8° | 179.8° |
| C20 | C21 | C22 | H16 | 179.4° | 179.9° |
| C18 | C17 | C22 | C21 | 0.4° | 0.4° |
| C18 | C17 | C22 | C16 | 177.3° | 179.7° |
| C18 | C17 | C16 | N4 | 26.3° | 147.4° |
| C18 | C17 | C16 | C23 | 157.7° | 32.6° |
| C17 | C18 | C19 | H13 | 179.1° | 179.9° |
| C18 | C17 | C22 | H16 | 179.5° | 179.7° |
| N2 | C5 | O | C4 | 178.2° | 180.0° |
| N2 | C5 | C4 | C3 | 134.8° | 180.0° |
| N2 | C5 | C4 | H1 | 105.6° | 60.0° |
| N2 | C5 | C4 | H2 | 15.2° | 59.9° |
| C5 | N2 | C6 | H3 | 42.4° | 60.1° |
| C5 | N2 | C6 | H4 | 161.1° | 60.0° |
| C21 | C22 | C17 | H16 | 180.0° | 179.9° |
| C21 | C22 | C17 | C16 | 176.9° | 179.9° |
| C22 | C17 | C16 | N4 | 151.0° | 32.3° |
| C22 | C17 | C16 | C23 | 25.0° | 147.7° |
| C22 | C17 | C18 | H14 | 178.8° | 179.8° |
| C17 | C22 | C21 | H15 | 179.3° | 180.0° |
| C17 | C16 | N4 | C23 | 175.7° | 180.0° |
| C17 | C16 | N4 | C3 | 178.9° | 175.3° |
| C17 | C16 | C23 | C24 | 45.6° | 37.3° |
| C17 | C16 | C23 | C28 | 132.1° | 142.2° |
| C16 | C17 | C18 | H14 | 3.9° | 0.1° |
| C16 | C17 | C22 | H16 | 3.1° | 0.0° |
| O | C5 | C4 | C3 | 43.6° | 0.0° |
| O | C5 | C4 | H1 | 76.1° | 120.0° |
| O | C5 | C4 | H2 | 163.2° | 120.0° |
| O | C5 | N2 | H6 | 177.4° | 180.0° |
| C5 | C4 | C3 | N4 | 63.2° | 65.0° |
| C5 | C4 | C3 | H1 | 119.6° | 120.0° |
| C5 | C4 | C3 | H2 | 119.6° | 120.0° |
| C5 | C4 | C3 | C2 | 176.5° | 175.3° |
| C5 | C4 | H1 | H2 | 121.1° | 120.0° |
| C4 | C5 | N2 | H6 | 4.3° | 0.1° |
| C5 | C4 | C3 | H26 | 56.3° | 55.2° |
| C16 | N4 | C3 | C4 | 163.9° | 57.5° |
| C16 | N4 | C3 | C2 | 73.4° | 62.4° |
| N4 | C16 | C23 | C24 | 138.7° | 142.7° |
| N4 | C16 | C23 | C28 | 43.5° | 37.8° |
| C16 | N4 | C3 | H26 | 44.9° | 177.7° |
| N4 | C3 | C4 | C2 | 120.2° | 119.6° |
| N4 | C3 | C4 | H26 | 119.5° | 120.2° |
| C3 | N4 | C16 | C23 | 5.4° | 4.7° |
| N4 | C3 | C2 | H26 | 118.7° | 120.0° |
| N4 | C3 | C2 | N1 | 111.8° | 119.9° |
| N4 | C3 | C2 | N5 | 66.4° | 59.6° |
| N4 | C3 | C4 | H1 | 177.2° | 175.0° |
| N4 | C3 | C4 | H2 | 56.4° | 55.0° |
| C4 | C3 | C2 | H26 | 120.1° | 120.2° |
| C4 | C3 | C2 | N1 | 9.5° | 120.2° |
| C4 | C3 | C2 | N5 | 172.4° | 60.3° |
| C3 | C4 | H1 | H2 | 121.1° | 120.0° |
| C16 | C23 | C24 | C25 | 8.3° | 1.8° |
| C16 | C23 | C24 | C28 | 177.9° | 179.6° |
| C16 | C23 | C24 | C26 | 175.7° | 178.3° |
| C16 | C23 | C28 | N5 | 6.7° | 3.9° |
| C16 | C23 | C28 | S | 176.4° | 177.8° |
| C3 | C2 | N1 | N5 | 178.3° | 179.6° |
| C3 | C2 | N1 | N | 178.2° | 179.1° |
| C3 | C2 | N5 | C28 | 4.2° | 1.2° |
| C3 | C2 | N5 | C1 | 178.0° | 179.0° |
| C2 | C3 | C4 | H1 | 56.9° | 55.4° |
| C2 | C3 | C4 | H2 | 63.8° | 64.6° |
| C25 | C24 | C23 | C26 | 176.0° | 179.9° |
| C25 | C24 | C23 | C28 | 173.8° | 178.6° |
| C25 | C24 | C26 | C27 | 7.2° | 0.3° |
| C25 | C24 | C26 | S | 174.3° | 179.8° |
| C24 | C25 | H20 | H21 | 120.0° | 120.0° |
| C24 | C25 | H20 | H22 | 120.0° | 120.0° |
| C24 | C25 | H21 | H22 | 120.0° | 120.0° |
| C24 | C23 | C28 | N5 | 175.2° | 176.5° |
| C24 | C23 | C28 | S | 1.6° | 1.8° |
| C23 | C24 | C26 | C27 | 176.7° | 179.8° |
| C23 | C24 | C26 | S | 1.8° | 0.2° |
| C23 | C24 | C25 | H20 | 87.7° | 94.6° |
| C23 | C24 | C25 | H21 | 152.3° | 145.4° |
| C23 | C24 | C25 | H22 | 32.3° | 25.4° |
| C23 | C28 | N5 | C2 | 37.5° | 33.7° |
| C28 | C23 | C24 | C26 | 2.2° | 1.3° |
| C23 | C28 | N5 | S | 176.5° | 178.1° |
| C23 | C28 | N5 | C1 | 145.4° | 146.6° |
| C23 | C28 | S | C26 | 0.5° | 1.5° |
| N1 | C2 | N5 | C28 | 177.3° | 179.2° |
| N1 | C2 | N5 | C1 | 0.4° | 0.6° |
| C2 | N1 | N | C1 | 0.3° | 0.1° |
| N1 | C2 | C3 | H26 | 129.5° | 0.0° |
| N5 | C2 | N1 | N | 0.1° | 0.5° |
| C2 | N5 | C28 | C1 | 177.1° | 179.8° |
| C2 | N5 | C28 | S | 139.1° | 144.4° |
| C2 | N5 | C1 | N | 0.7° | 0.5° |
| C2 | N5 | C1 | C | 178.4° | 179.6° |
| N5 | C2 | C3 | H26 | 52.3° | 179.5° |
| C24 | C26 | S | C28 | 0.8° | 0.7° |
| C24 | C26 | C27 | S | 178.4° | 180.0° |
| C24 | C26 | C27 | H17 | 178.4° | 180.0° |
| C24 | C26 | C27 | H18 | 58.3° | 60.1° |
| C24 | C26 | C27 | H19 | 61.6° | 60.0° |
| C26 | C24 | C25 | H20 | 87.9° | 85.5° |
| C26 | C24 | C25 | H21 | 32.1° | 34.6° |
| C26 | C24 | C25 | H22 | 152.1° | 154.5° |
| N1 | N | C1 | N5 | 0.6° | 0.3° |
| N1 | N | C1 | C | 178.5° | 179.8° |
| C28 | N5 | C1 | N | 176.8° | 179.3° |
| N5 | C28 | S | C26 | 176.4° | 176.8° |
| C28 | N5 | C1 | C | 4.1° | 0.6° |
| C1 | N5 | C28 | S | 38.0° | 35.4° |
| N5 | C1 | N | C | 179.1° | 179.9° |
| N5 | C1 | C | H23 | 179.0° | 90.0° |
| N5 | C1 | C | H24 | 58.9° | 150.0° |
| N5 | C1 | C | H25 | 61.0° | 29.9° |
| C28 | S | C26 | C27 | 177.9° | 179.3° |
| N | C1 | C | H23 | 0.0° | 90.1° |
| N | C1 | C | H24 | 120.0° | 29.9° |
| N | C1 | C | H25 | 120.0° | 150.0° |
| C26 | C27 | H17 | H18 | 120.0° | 119.9° |
| C26 | C27 | H17 | H19 | 120.0° | 120.0° |
| C26 | C27 | H18 | H19 | 120.0° | 120.0° |
| S | C26 | C27 | H17 | 0.0° | 0.0° |
| S | C26 | C27 | H18 | 120.0° | 120.0° |
| S | C26 | C27 | H19 | 120.0° | 120.0° |
| C1 | C | H23 | H24 | 120.0° | 120.0° |
| C1 | C | H23 | H25 | 120.0° | 120.0° |
| C1 | C | H24 | H25 | 120.0° | 120.1° |
| H1 | C4 | C3 | H26 | 63.3° | 64.8° |
| H2 | C4 | C3 | H26 | 175.9° | 175.2° |
| H3 | C6 | N2 | H6 | 137.6° | 120.0° |
| H4 | C6 | N2 | H6 | 18.9° | 120.0° |
| H5 | C8 | C9 | H7 | 0.1° | 0.1° |
| H8 | C11 | C12 | H9 | 173.1° | 179.9° |
| H10 | N3 | O2 | H27 | 163.2° | 0.0° |
| H11 | C14 | C15 | H12 | 1.1° | 0.2° |
| H13 | C19 | C18 | H14 | 0.9° | 0.0° |
| H15 | C21 | C22 | H16 | 0.6° | 0.1° |
| H17 | C27 | H18 | H19 | 120.0° | 120.0° |
| H20 | C25 | H21 | H22 | 119.9° | 120.1° |
| H23 | C | H24 | H25 | 120.0° | 120.0° |
