P8T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL | C23 | sing | 1.74Å | 1.74Å | |
| C24 | C23 | doub | 1.39Å | 1.38Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C20 | doub | 1.40Å | 1.39Å | Aromatic |
| N2 | C5 | sing | 1.35Å | 1.35Å | |
| C22 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| O | C5 | doub | 1.21Å | 1.23Å | |
| C5 | C4 | sing | 1.51Å | 1.51Å | |
| C20 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | C19 | sing | 1.48Å | 1.48Å | |
| N5 | C19 | doub | 1.29Å | 1.28Å | |
| N5 | C3 | sing | 1.46Å | 1.47Å | |
| C19 | C26 | sing | 1.48Å | 1.52Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C3 | C2 | sing | 1.51Å | 1.51Å | |
| C28 | C27 | sing | 1.51Å | 1.50Å | |
| C26 | C27 | sing | 1.45Å | 1.45Å | Aromatic |
| C26 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | N1 | doub | 1.30Å | 1.32Å | Aromatic |
| C2 | N6 | sing | 1.36Å | 1.38Å | Aromatic |
| C27 | C29 | doub | 1.32Å | 1.36Å | Aromatic |
| N1 | N | sing | 1.29Å | 1.39Å | Aromatic |
| N6 | C31 | sing | 1.40Å | 1.40Å | |
| N6 | C1 | sing | 1.35Å | 1.38Å | Aromatic |
| C31 | S | sing | 1.71Å | 1.73Å | Aromatic |
| N | C1 | doub | 1.31Å | 1.31Å | Aromatic |
| C29 | C30 | sing | 1.51Å | 1.50Å | |
| C29 | S | sing | 1.75Å | 1.74Å | Aromatic |
| C1 | C | sing | 1.51Å | 1.48Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| N2 | H3 | sing | 0.97Å | 1.00Å | |
| C22 | H5 | sing | 1.08Å | 1.08Å | |
| C21 | H6 | sing | 1.08Å | 1.08Å | |
| C24 | H7 | sing | 1.08Å | 1.08Å | |
| C25 | H8 | sing | 1.08Å | 1.08Å | |
| C30 | H9 | sing | 1.09Å | 1.10Å | |
| C30 | H10 | sing | 1.09Å | 1.10Å | |
| C30 | H11 | sing | 1.09Å | 1.10Å | |
| C28 | H12 | sing | 1.09Å | 1.10Å | |
| C28 | H13 | sing | 1.09Å | 1.10Å | |
| C28 | H14 | sing | 1.09Å | 1.10Å | |
| C | H15 | sing | 1.09Å | 1.10Å | |
| C | H16 | sing | 1.09Å | 1.10Å | |
| C | H17 | sing | 1.09Å | 1.10Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| N2 | C6 | sing | 1.39Å | 36.52Å | |
| C6 | C7 | sing | 1.39Å | 0.00Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 0.00Å | Aromatic |
| C8 | C9 | sing | 1.40Å | 0.00Å | Aromatic |
| C9 | C10 | doub | 1.40Å | 0.00Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 0.00Å | Aromatic |
| C11 | C6 | doub | 1.39Å | 0.00Å | Aromatic |
| C9 | C12 | sing | 1.48Å | 0.00Å | |
| C12 | N3 | sing | 1.35Å | 0.00Å | |
| C12 | O1 | doub | 1.22Å | 0.00Å | |
| C13 | C14 | sing | 1.39Å | 0.00Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 0.00Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 0.00Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 0.00Å | Aromatic |
| C17 | C18 | sing | 1.39Å | 0.00Å | Aromatic |
| C18 | C13 | doub | 1.40Å | 0.00Å | Aromatic |
| N3 | C18 | sing | 1.40Å | 0.00Å | |
| C13 | N4 | sing | 1.40Å | 0.00Å | |
| C7 | H4 | sing | 1.08Å | 0.00Å | |
| C8 | H19 | sing | 1.08Å | 0.00Å | |
| C10 | H20 | sing | 1.08Å | 0.00Å | |
| C11 | H21 | sing | 1.08Å | 0.00Å | |
| N3 | H22 | sing | 0.97Å | 0.00Å | |
| C14 | H23 | sing | 1.08Å | 0.00Å | |
| C15 | H24 | sing | 1.08Å | 0.00Å | |
| C16 | H25 | sing | 1.08Å | 0.00Å | |
| C17 | H26 | sing | 1.08Å | 0.00Å | |
| N4 | H27 | sing | 0.97Å | 0.00Å | |
| N4 | H28 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL | C23 | C24 | 119.4° | 119.9° |
| CL | C23 | C22 | 119.2° | 119.9° |
| C23 | C24 | C25 | 119.1° | 120.1° |
| C24 | C23 | C22 | 121.4° | 120.2° |
| C23 | C24 | H7 | 120.5° | 119.9° |
| C24 | C25 | C20 | 120.8° | 119.9° |
| C25 | C24 | H7 | 120.5° | 120.0° |
| C24 | C25 | H8 | 119.6° | 120.1° |
| C23 | C22 | C21 | 119.2° | 120.1° |
| C23 | C22 | H5 | 120.4° | 119.9° |
| C25 | C20 | C21 | 118.6° | 119.8° |
| C25 | C20 | C19 | 120.3° | 120.1° |
| C20 | C25 | H8 | 119.6° | 120.0° |
| N2 | C5 | O | 123.9° | 120.0° |
| N2 | C5 | C4 | 114.5° | 120.0° |
| C5 | N2 | H3 | 157.1° | 120.0° |
| C5 | N2 | C6 | 45.8° | 120.0° |
| C22 | C21 | C20 | 120.9° | 119.9° |
| C21 | C22 | H5 | 120.4° | 119.9° |
| C22 | C21 | H6 | 119.6° | 120.1° |
| O | C5 | C4 | 121.6° | 120.0° |
| C5 | C4 | C3 | 110.6° | 109.5° |
| C5 | C4 | H1 | 109.2° | 109.4° |
| C5 | C4 | H2 | 109.2° | 109.5° |
| C21 | C20 | C19 | 121.0° | 120.1° |
| C20 | C21 | H6 | 119.6° | 120.1° |
| C20 | C19 | N5 | 116.4° | 117.0° |
| C20 | C19 | C26 | 118.0° | 117.0° |
| C19 | N5 | C3 | 117.9° | 122.5° |
| N5 | C19 | C26 | 125.6° | 125.9° |
| N5 | C3 | C4 | 109.7° | 109.5° |
| N5 | C3 | C2 | 108.2° | 109.2° |
| N5 | C3 | H18 | 110.1° | 109.6° |
| C19 | C26 | C27 | 126.1° | 123.5° |
| C19 | C26 | C31 | 122.1° | 124.8° |
| C4 | C3 | C2 | 110.0° | 109.5° |
| C3 | C4 | H1 | 109.2° | 109.5° |
| C3 | C4 | H2 | 109.2° | 109.5° |
| C4 | C3 | H18 | 109.3° | 109.5° |
| C3 | C2 | N1 | 129.2° | 127.9° |
| C3 | C2 | N6 | 121.5° | 125.0° |
| C2 | C3 | H18 | 109.6° | 109.5° |
| C28 | C27 | C26 | 125.3° | 123.0° |
| C28 | C27 | C29 | 122.2° | 123.1° |
| C27 | C28 | H12 | 109.5° | 109.4° |
| C27 | C28 | H13 | 109.4° | 109.5° |
| C27 | C28 | H14 | 109.5° | 109.5° |
| C27 | C26 | C31 | 111.8° | 111.7° |
| C26 | C27 | C29 | 112.4° | 113.9° |
| C26 | C31 | N6 | 124.3° | 124.1° |
| C26 | C31 | S | 112.4° | 111.0° |
| N1 | C2 | N6 | 109.3° | 107.1° |
| C2 | N1 | N | 107.9° | 109.7° |
| C2 | N6 | C31 | 122.5° | 124.5° |
| C2 | N6 | C1 | 105.3° | 106.5° |
| C27 | C29 | C30 | 128.9° | 124.6° |
| C27 | C29 | S | 112.3° | 110.7° |
| N1 | N | C1 | 108.1° | 110.0° |
| C31 | N6 | C1 | 132.2° | 129.0° |
| N6 | C31 | S | 123.3° | 124.9° |
| N6 | C1 | N | 109.5° | 106.7° |
| N6 | C1 | C | 125.0° | 126.6° |
| C31 | S | C29 | 91.1° | 92.6° |
| N | C1 | C | 125.5° | 126.6° |
| C30 | C29 | S | 118.8° | 124.6° |
| C29 | C30 | H9 | 109.5° | 109.5° |
| C29 | C30 | H10 | 109.5° | 109.5° |
| C29 | C30 | H11 | 109.5° | 109.5° |
| C1 | C | H15 | 109.5° | 109.5° |
| C1 | C | H16 | 109.5° | 109.5° |
| C1 | C | H17 | 109.5° | 109.5° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H3 | N2 | C6 | 157.1° | 120.0° |
| H9 | C30 | H10 | 109.5° | 109.5° |
| H9 | C30 | H11 | 109.5° | 109.5° |
| H10 | C30 | H11 | 109.5° | 109.5° |
| H12 | C28 | H13 | 109.5° | 109.4° |
| H12 | C28 | H14 | 109.4° | 109.4° |
| H13 | C28 | H14 | 109.5° | 109.5° |
| H15 | C | H16 | 109.5° | 109.5° |
| H15 | C | H17 | 109.5° | 109.5° |
| H16 | C | H17 | 109.4° | 109.4° |
| N2 | C6 | C7 | 90.0° | 119.9° |
| N2 | C6 | C11 | 90.0° | 119.9° |
| C6 | C7 | C8 | 90.0° | 120.1° |
| C7 | C6 | C11 | 90.0° | 120.1° |
| C6 | C7 | H4 | 90.0° | 119.9° |
| C7 | C8 | C9 | 90.0° | 119.9° |
| C8 | C7 | H4 | 90.0° | 120.0° |
| C7 | C8 | H19 | 90.0° | 120.1° |
| C8 | C9 | C10 | 90.0° | 119.8° |
| C8 | C9 | C12 | 90.0° | 120.1° |
| C9 | C8 | H19 | 90.0° | 120.0° |
| C9 | C10 | C11 | 90.0° | 120.0° |
| C10 | C9 | C12 | 90.0° | 120.1° |
| C9 | C10 | H20 | 90.0° | 120.0° |
| C10 | C11 | C6 | 90.0° | 120.1° |
| C11 | C10 | H20 | 90.0° | 120.0° |
| C10 | C11 | H21 | 90.0° | 120.0° |
| C6 | C11 | H21 | 90.0° | 119.9° |
| C9 | C12 | N3 | 90.0° | 120.0° |
| C9 | C12 | O1 | 90.0° | 120.0° |
| N3 | C12 | O1 | 90.0° | 120.0° |
| C12 | N3 | C18 | 90.0° | 120.0° |
| C12 | N3 | H22 | 90.0° | 120.0° |
| C13 | C14 | C15 | 90.0° | 120.0° |
| C14 | C13 | C18 | 90.0° | 119.8° |
| C14 | C13 | N4 | 90.0° | 120.1° |
| C13 | C14 | H23 | 90.0° | 120.0° |
| C14 | C15 | C16 | 90.0° | 120.2° |
| C15 | C14 | H23 | 90.0° | 120.0° |
| C14 | C15 | H24 | 90.0° | 119.9° |
| C15 | C16 | C17 | 90.0° | 120.2° |
| C16 | C15 | H24 | 90.0° | 120.0° |
| C15 | C16 | H25 | 90.0° | 119.9° |
| C16 | C17 | C18 | 90.0° | 120.0° |
| C17 | C16 | H25 | 90.0° | 119.9° |
| C16 | C17 | H26 | 90.0° | 120.0° |
| C17 | C18 | C13 | 90.0° | 119.7° |
| C17 | C18 | N3 | 90.0° | 120.1° |
| C18 | C17 | H26 | 90.0° | 119.9° |
| C13 | C18 | N3 | 90.0° | 120.1° |
| C18 | C13 | N4 | 90.0° | 120.1° |
| C18 | N3 | H22 | 90.0° | 120.0° |
| C13 | N4 | H27 | 90.0° | 120.0° |
| C13 | N4 | H28 | 90.0° | 120.0° |
| H27 | N4 | H28 | 90.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL | C23 | C24 | C22 | 179.6° | 179.7° |
| CL | C23 | C24 | C25 | 179.8° | 180.0° |
| CL | C23 | C22 | C21 | 179.7° | 180.0° |
| CL | C23 | C22 | H5 | 0.3° | 0.1° |
| CL | C23 | C24 | H7 | 0.2° | 0.0° |
| C23 | C24 | C25 | H7 | 180.0° | 180.0° |
| C23 | C24 | C25 | C20 | 0.1° | 0.0° |
| C24 | C23 | C22 | C21 | 0.1° | 0.3° |
| C24 | C23 | C22 | H5 | 179.9° | 179.8° |
| C23 | C24 | C25 | H8 | 179.9° | 180.0° |
| C25 | C24 | C23 | C22 | 0.2° | 0.3° |
| C24 | C25 | C20 | H8 | 180.0° | 180.0° |
| C24 | C25 | C20 | C21 | 0.4° | 0.3° |
| C24 | C25 | C20 | C19 | 177.0° | 180.0° |
| C23 | C22 | C21 | H5 | 180.0° | 179.9° |
| C23 | C22 | C21 | C20 | 0.2° | 0.0° |
| C23 | C22 | C21 | H6 | 179.8° | 180.0° |
| C22 | C23 | C24 | H7 | 179.8° | 179.7° |
| C25 | C20 | C21 | C22 | 0.4° | 0.2° |
| C25 | C20 | C21 | C19 | 177.3° | 179.8° |
| C25 | C20 | C19 | N5 | 27.0° | 32.9° |
| C25 | C20 | C19 | C26 | 155.1° | 147.2° |
| C25 | C20 | C21 | H6 | 179.6° | 179.8° |
| C20 | C25 | C24 | H7 | 180.0° | 180.0° |
| N2 | C5 | O | C4 | 179.3° | 179.9° |
| N2 | C5 | C4 | C3 | 131.4° | 179.9° |
| N2 | C5 | C4 | H1 | 108.4° | 60.0° |
| N2 | C5 | C4 | H2 | 11.2° | 59.9° |
| C5 | N2 | H3 | C6 | 180.0° | 179.9° |
| C5 | N2 | C6 | C7 | 90.0° | 146.3° |
| C5 | N2 | C6 | C11 | 90.0° | 34.0° |
| C22 | C21 | C20 | H6 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 176.9° | 180.0° |
| O | C5 | C4 | C3 | 48.0° | 0.1° |
| O | C5 | C4 | H1 | 72.2° | 120.1° |
| O | C5 | C4 | H2 | 168.2° | 119.9° |
| O | C5 | N2 | H3 | 148.7° | 175.1° |
| O | C5 | N2 | C6 | 31.3° | 5.0° |
| C5 | C4 | C3 | N5 | 44.5° | 65.0° |
| C5 | C4 | C3 | H1 | 120.2° | 120.0° |
| C5 | C4 | C3 | H2 | 120.2° | 120.0° |
| C5 | C4 | C3 | C2 | 163.3° | 175.3° |
| C5 | C4 | H1 | H2 | 119.5° | 120.0° |
| C4 | C5 | N2 | H3 | 31.9° | 4.8° |
| C5 | C4 | C3 | H18 | 76.4° | 55.2° |
| C4 | C5 | N2 | C6 | 148.1° | 175.1° |
| C21 | C20 | C19 | N5 | 150.3° | 146.9° |
| C21 | C20 | C19 | C26 | 27.6° | 33.1° |
| C20 | C21 | C22 | H5 | 179.8° | 180.0° |
| C21 | C20 | C25 | H8 | 179.6° | 179.7° |
| C20 | C19 | N5 | C26 | 177.7° | 179.9° |
| C20 | C19 | N5 | C3 | 180.0° | 175.4° |
| C20 | C19 | C26 | C27 | 44.3° | 37.4° |
| C20 | C19 | C26 | C31 | 133.5° | 142.3° |
| C19 | C20 | C21 | H6 | 3.1° | 0.0° |
| C19 | C20 | C25 | H8 | 3.0° | 0.0° |
| C19 | N5 | C3 | C4 | 170.7° | 57.6° |
| C19 | N5 | C3 | C2 | 69.3° | 62.4° |
| N5 | C19 | C26 | C27 | 138.1° | 142.7° |
| N5 | C19 | C26 | C31 | 44.1° | 37.7° |
| C19 | N5 | C3 | H18 | 50.4° | 177.7° |
| C3 | N5 | C19 | C26 | 2.3° | 4.7° |
| N5 | C3 | C4 | C2 | 118.8° | 119.7° |
| N5 | C3 | C4 | H18 | 120.8° | 120.2° |
| N5 | C3 | C2 | H18 | 120.1° | 120.0° |
| N5 | C3 | C2 | N1 | 110.7° | 120.0° |
| N5 | C3 | C2 | N6 | 66.5° | 59.6° |
| N5 | C3 | C4 | H1 | 164.6° | 175.1° |
| N5 | C3 | C4 | H2 | 75.7° | 55.0° |
| C19 | C26 | C27 | C28 | 7.8° | 1.8° |
| C19 | C26 | C27 | C31 | 178.0° | 179.7° |
| C19 | C26 | C27 | C29 | 176.1° | 178.3° |
| C19 | C26 | C31 | N6 | 4.0° | 3.8° |
| C19 | C26 | C31 | S | 176.9° | 177.8° |
| C4 | C3 | C2 | H18 | 120.2° | 120.1° |
| C4 | C3 | C2 | N1 | 9.1° | 120.1° |
| C4 | C3 | C2 | N6 | 173.7° | 60.3° |
| C3 | C4 | H1 | H2 | 119.5° | 120.0° |
| C3 | C2 | N1 | N6 | 177.4° | 179.6° |
| C3 | C2 | N1 | N | 176.7° | 179.1° |
| C3 | C2 | N6 | C31 | 4.0° | 1.2° |
| C3 | C2 | N6 | C1 | 177.0° | 179.0° |
| C2 | C3 | C4 | H1 | 76.5° | 55.4° |
| C2 | C3 | C4 | H2 | 43.1° | 64.7° |
| C28 | C27 | C26 | C29 | 176.2° | 179.9° |
| C28 | C27 | C26 | C31 | 174.3° | 178.5° |
| C28 | C27 | C29 | C30 | 6.9° | 0.3° |
| C28 | C27 | C29 | S | 174.5° | 179.7° |
| C27 | C28 | H12 | H13 | 120.0° | 120.0° |
| C27 | C28 | H12 | H14 | 120.0° | 120.0° |
| C27 | C28 | H13 | H14 | 120.0° | 120.1° |
| C27 | C26 | C31 | N6 | 177.9° | 176.5° |
| C27 | C26 | C31 | S | 1.2° | 1.9° |
| C26 | C27 | C29 | C30 | 176.8° | 179.8° |
| C26 | C27 | C29 | S | 1.8° | 0.2° |
| C26 | C27 | C28 | H12 | 87.8° | 89.5° |
| C26 | C27 | C28 | H13 | 152.2° | 150.6° |
| C26 | C27 | C28 | H14 | 32.2° | 30.5° |
| C26 | C31 | N6 | C2 | 39.0° | 33.8° |
| C31 | C26 | C27 | C29 | 1.9° | 1.4° |
| C26 | C31 | N6 | S | 179.0° | 178.2° |
| C26 | C31 | N6 | C1 | 142.3° | 146.5° |
| C26 | C31 | S | C29 | 0.2° | 1.5° |
| N1 | C2 | N6 | C31 | 178.3° | 179.2° |
| N1 | C2 | N6 | C1 | 0.7° | 0.6° |
| C2 | N1 | N | C1 | 0.4° | 0.2° |
| N1 | C2 | C3 | H18 | 129.3° | 0.0° |
| N6 | C2 | N1 | N | 0.7° | 0.5° |
| C2 | N6 | C31 | C1 | 178.7° | 179.7° |
| C2 | N6 | C31 | S | 140.0° | 144.5° |
| C2 | N6 | C1 | N | 0.4° | 0.5° |
| C2 | N6 | C1 | C | 179.0° | 179.5° |
| N6 | C2 | C3 | H18 | 53.6° | 179.6° |
| C27 | C29 | S | C31 | 0.9° | 0.7° |
| C27 | C29 | C30 | S | 178.5° | 180.0° |
| C27 | C29 | C30 | H9 | 178.5° | 180.0° |
| C27 | C29 | C30 | H10 | 58.5° | 60.0° |
| C27 | C29 | C30 | H11 | 61.5° | 60.0° |
| C29 | C27 | C28 | H12 | 88.0° | 90.6° |
| C29 | C27 | C28 | H13 | 32.0° | 29.3° |
| C29 | C27 | C28 | H14 | 152.0° | 149.4° |
| N1 | N | C1 | N6 | 0.0° | 0.2° |
| N1 | N | C1 | C | 179.4° | 179.8° |
| C31 | N6 | C1 | N | 178.4° | 179.2° |
| N6 | C31 | S | C29 | 178.9° | 176.9° |
| C31 | N6 | C1 | C | 2.2° | 0.8° |
| C1 | N6 | C31 | S | 38.7° | 35.3° |
| N6 | C1 | N | C | 179.4° | 180.0° |
| N6 | C1 | C | H15 | 179.3° | 90.0° |
| N6 | C1 | C | H16 | 59.3° | 150.0° |
| N6 | C1 | C | H17 | 60.7° | 30.0° |
| C31 | S | C29 | C30 | 177.8° | 179.3° |
| N | C1 | C | H15 | 0.0° | 90.0° |
| N | C1 | C | H16 | 120.0° | 30.0° |
| N | C1 | C | H17 | 120.0° | 150.0° |
| C29 | C30 | H9 | H10 | 120.0° | 120.0° |
| C29 | C30 | H9 | H11 | 120.0° | 120.0° |
| C29 | C30 | H10 | H11 | 120.0° | 120.0° |
| S | C29 | C30 | H9 | 0.0° | 0.0° |
| S | C29 | C30 | H10 | 120.0° | 120.0° |
| S | C29 | C30 | H11 | 120.0° | 120.0° |
| C1 | C | H15 | H16 | 120.0° | 120.0° |
| C1 | C | H15 | H17 | 120.0° | 120.0° |
| C1 | C | H16 | H17 | 120.0° | 120.0° |
| H1 | C4 | C3 | H18 | 43.8° | 64.7° |
| H2 | C4 | C3 | H18 | 163.5° | 175.2° |
| H3 | N2 | C6 | C7 | 90.0° | 33.8° |
| H3 | N2 | C6 | C11 | 90.0° | 145.8° |
| H5 | C22 | C21 | H6 | 0.2° | 0.1° |
| H7 | C24 | C25 | H8 | 0.0° | 0.0° |
| H9 | C30 | H10 | H11 | 120.0° | 120.0° |
| H12 | C28 | H13 | H14 | 120.0° | 120.0° |
| H15 | C | H16 | H17 | 120.0° | 120.0° |
| N2 | C6 | C7 | C11 | 90.0° | 179.7° |
| N2 | C6 | C7 | C8 | 90.0° | 180.0° |
| N2 | C6 | C11 | C10 | 90.0° | 179.7° |
| N2 | C6 | C7 | H4 | 90.0° | 0.1° |
| N2 | C6 | C11 | H21 | 90.0° | 0.3° |
| C6 | C7 | C8 | H4 | 90.0° | 179.9° |
| C6 | C7 | C8 | C9 | 90.0° | 0.0° |
| C7 | C6 | C11 | C10 | 90.0° | 0.6° |
| C6 | C7 | C8 | H19 | 90.0° | 180.0° |
| C7 | C6 | C11 | H21 | 90.0° | 180.0° |
| C7 | C8 | C9 | H19 | 90.0° | 180.0° |
| C7 | C8 | C9 | C10 | 90.0° | 0.1° |
| C8 | C7 | C6 | C11 | 90.0° | 0.3° |
| C7 | C8 | C9 | C12 | 90.0° | 180.0° |
| C8 | C9 | C10 | C12 | 90.0° | 180.0° |
| C8 | C9 | C10 | C11 | 90.0° | 0.2° |
| C8 | C9 | C12 | N3 | 90.0° | 179.9° |
| C8 | C9 | C12 | O1 | 90.0° | 0.0° |
| C9 | C8 | C7 | H4 | 90.0° | 179.9° |
| C8 | C9 | C10 | H20 | 90.0° | 179.9° |
| C9 | C10 | C11 | H20 | 90.0° | 179.7° |
| C9 | C10 | C11 | C6 | 90.0° | 0.6° |
| C10 | C9 | C12 | N3 | 90.0° | 0.1° |
| C10 | C9 | C12 | O1 | 90.0° | 180.0° |
| C10 | C9 | C8 | H19 | 90.0° | 180.0° |
| C9 | C10 | C11 | H21 | 90.0° | 179.9° |
| C10 | C11 | C6 | H21 | 90.0° | 179.4° |
| C11 | C10 | C9 | C12 | 90.0° | 179.7° |
| C11 | C6 | C7 | H4 | 90.0° | 179.8° |
| C6 | C11 | C10 | H20 | 90.0° | 179.7° |
| C9 | C12 | N3 | O1 | 90.0° | 180.0° |
| C9 | C12 | N3 | C18 | 90.0° | 175.6° |
| C12 | C9 | C8 | H19 | 90.0° | 0.0° |
| C12 | C9 | C10 | H20 | 90.0° | 0.0° |
| C9 | C12 | N3 | H22 | 90.0° | 4.5° |
| C12 | N3 | C18 | C17 | 90.0° | 28.3° |
| C12 | N3 | C18 | C13 | 90.0° | 151.2° |
| C12 | N3 | C18 | H22 | 90.0° | 179.9° |
| O1 | C12 | N3 | C18 | 90.0° | 4.4° |
| O1 | C12 | N3 | H22 | 90.0° | 175.6° |
| C13 | C14 | C15 | H23 | 90.0° | 179.9° |
| C13 | C14 | C15 | C16 | 90.0° | 0.1° |
| C14 | C13 | C18 | C17 | 90.0° | 0.5° |
| C14 | C13 | C18 | N4 | 90.0° | 179.7° |
| C14 | C13 | C18 | N3 | 90.0° | 180.0° |
| C13 | C14 | C15 | H24 | 90.0° | 180.0° |
| C14 | C13 | N4 | H27 | 90.0° | 0.0° |
| C14 | C13 | N4 | H28 | 90.0° | 180.0° |
| C14 | C15 | C16 | H24 | 90.0° | 179.9° |
| C14 | C15 | C16 | C17 | 90.0° | 0.0° |
| C15 | C14 | C13 | C18 | 90.0° | 0.2° |
| C15 | C14 | C13 | N4 | 90.0° | 179.9° |
| C14 | C15 | C16 | H25 | 90.0° | 179.9° |
| C15 | C16 | C17 | H25 | 90.0° | 180.0° |
| C15 | C16 | C17 | C18 | 90.0° | 0.3° |
| C16 | C15 | C14 | H23 | 90.0° | 180.0° |
| C15 | C16 | C17 | H26 | 90.0° | 180.0° |
| C16 | C17 | C18 | H26 | 90.0° | 179.8° |
| C16 | C17 | C18 | C13 | 90.0° | 0.5° |
| C16 | C17 | C18 | N3 | 90.0° | 180.0° |
| C17 | C16 | C15 | H24 | 90.0° | 179.9° |
| C17 | C18 | C13 | N3 | 90.0° | 179.5° |
| C17 | C18 | C13 | N4 | 90.0° | 179.8° |
| C17 | C18 | N3 | H22 | 90.0° | 151.7° |
| C18 | C17 | C16 | H25 | 90.0° | 179.8° |
| C13 | C18 | N3 | H22 | 90.0° | 28.8° |
| C18 | C13 | C14 | H23 | 90.0° | 179.7° |
| C13 | C18 | C17 | H26 | 90.0° | 179.7° |
| C18 | C13 | N4 | H27 | 90.0° | 179.8° |
| C18 | C13 | N4 | H28 | 90.0° | 0.3° |
| N3 | C18 | C13 | N4 | 90.0° | 0.2° |
| N3 | C18 | C17 | H26 | 90.0° | 0.2° |
| N4 | C13 | C14 | H23 | 90.0° | 0.0° |
| C13 | N4 | H27 | H28 | 90.0° | 180.0° |
| H4 | C7 | C8 | H19 | 90.0° | 0.0° |
| H20 | C10 | C11 | H21 | 90.0° | 0.4° |
| H23 | C14 | C15 | H24 | 90.0° | 0.1° |
| H24 | C15 | C16 | H25 | 90.0° | 0.1° |
| H25 | C16 | C17 | H26 | 90.0° | 0.0° |
