A1D87
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3 | C2 | sing | 1.53Å | 1.50Å | |
| C1 | C2 | sing | 1.53Å | 1.50Å | |
| C2 | N1 | sing | 1.47Å | 1.48Å | |
| N1 | N8 | sing | 1.40Å | 1.38Å | Aromatic |
| N1 | C4 | sing | 1.34Å | 1.33Å | Aromatic |
| N8 | C25 | doub | 1.32Å | 1.36Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C5 | sing | 1.47Å | 1.42Å | Aromatic |
| C25 | C24 | sing | 1.41Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.41Å | 1.40Å | Aromatic |
| C24 | C23 | doub | 1.36Å | 1.38Å | Aromatic |
| C6 | C7 | doub | 1.36Å | 1.38Å | Aromatic |
| C23 | C7 | sing | 1.40Å | 1.39Å | Aromatic |
| C23 | CL1 | sing | 1.74Å | 1.75Å | |
| C7 | N2 | sing | 1.40Å | 1.40Å | |
| N2 | C8 | sing | 1.37Å | 1.37Å | |
| C9 | C8 | doub | 1.37Å | 1.40Å | |
| C9 | C10 | sing | 1.40Å | 1.42Å | |
| C8 | N7 | sing | 1.37Å | 1.37Å | |
| C10 | O1 | doub | 1.22Å | 1.23Å | |
| C10 | N3 | sing | 1.35Å | 1.40Å | |
| N7 | C16 | sing | 1.46Å | 1.47Å | |
| N7 | C15 | sing | 1.35Å | 1.38Å | |
| C16 | C17 | sing | 1.51Å | 1.51Å | |
| C17 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| F3 | C22 | sing | 1.35Å | 1.36Å | |
| C22 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | F1 | sing | 1.35Å | 1.35Å | |
| C19 | C20 | doub | 1.39Å | 1.37Å | Aromatic |
| N3 | C15 | sing | 1.34Å | 1.39Å | |
| N3 | C11 | sing | 1.46Å | 1.49Å | |
| C15 | O2 | doub | 1.22Å | 1.21Å | |
| C21 | C20 | sing | 1.38Å | 1.37Å | Aromatic |
| C20 | F2 | sing | 1.35Å | 1.34Å | |
| N6 | C12 | doub | 1.31Å | 1.33Å | Aromatic |
| N6 | N5 | sing | 1.40Å | 1.36Å | Aromatic |
| C11 | C12 | sing | 1.51Å | 1.48Å | |
| C14 | N5 | sing | 1.47Å | 1.47Å | |
| C12 | N4 | sing | 1.33Å | 1.34Å | Aromatic |
| N5 | C13 | sing | 1.34Å | 1.34Å | Aromatic |
| N4 | C13 | doub | 1.31Å | 1.32Å | Aromatic |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C14 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.08Å | 1.08Å | |
| C13 | H9 | sing | 1.08Å | 1.08Å | |
| N2 | H10 | sing | 0.97Å | 1.00Å | |
| C3 | H11 | sing | 1.09Å | 1.10Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C1 | H16 | sing | 1.09Å | 1.10Å | |
| C2 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C24 | H22 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | C2 | C1 | 116.0° | 109.5° |
| C3 | C2 | N1 | 110.5° | 109.5° |
| C2 | C3 | H11 | 109.5° | 109.4° |
| C2 | C3 | H12 | 109.4° | 109.4° |
| C2 | C3 | H13 | 109.5° | 109.5° |
| C3 | C2 | H17 | 106.5° | 109.5° |
| C1 | C2 | N1 | 110.0° | 109.5° |
| C2 | C1 | H14 | 109.5° | 109.4° |
| C2 | C1 | H15 | 109.5° | 109.5° |
| C2 | C1 | H16 | 109.4° | 109.5° |
| C1 | C2 | H17 | 106.6° | 109.4° |
| C2 | N1 | N8 | 122.5° | 125.0° |
| C2 | N1 | C4 | 123.7° | 125.0° |
| N1 | C2 | H17 | 106.8° | 109.5° |
| N8 | N1 | C4 | 113.7° | 110.0° |
| N1 | N8 | C25 | 102.7° | 109.0° |
| N1 | C4 | C5 | 107.6° | 107.9° |
| N1 | C4 | H1 | 126.2° | 126.1° |
| N8 | C25 | C5 | 111.7° | 106.7° |
| N8 | C25 | C24 | 129.0° | 134.6° |
| C4 | C5 | C25 | 104.3° | 106.5° |
| C4 | C5 | C6 | 134.4° | 134.7° |
| C5 | C4 | H1 | 126.2° | 126.0° |
| C5 | C25 | C24 | 119.3° | 118.7° |
| C25 | C5 | C6 | 121.3° | 118.8° |
| C25 | C24 | C23 | 118.5° | 119.7° |
| C25 | C24 | H22 | 120.8° | 120.1° |
| C5 | C6 | C7 | 117.7° | 119.6° |
| C5 | C6 | H5 | 121.2° | 120.2° |
| C24 | C23 | C7 | 121.1° | 121.7° |
| C24 | C23 | CL1 | 118.5° | 119.2° |
| C23 | C24 | H22 | 120.8° | 120.1° |
| C6 | C7 | C23 | 122.1° | 121.5° |
| C6 | C7 | N2 | 114.4° | 119.2° |
| C7 | C6 | H5 | 121.2° | 120.3° |
| C7 | C23 | CL1 | 120.4° | 119.1° |
| C23 | C7 | N2 | 123.5° | 119.2° |
| C7 | N2 | C8 | 121.5° | 120.0° |
| C7 | N2 | H10 | 119.2° | 120.0° |
| N2 | C8 | C9 | 121.4° | 120.3° |
| N2 | C8 | N7 | 119.0° | 120.3° |
| C8 | N2 | H10 | 119.3° | 120.0° |
| C8 | C9 | C10 | 120.3° | 119.1° |
| C9 | C8 | N7 | 119.6° | 119.4° |
| C8 | C9 | H8 | 119.8° | 120.5° |
| C9 | C10 | O1 | 124.7° | 120.2° |
| C9 | C10 | N3 | 116.9° | 119.6° |
| C10 | C9 | H8 | 119.8° | 120.4° |
| C8 | N7 | C16 | 120.8° | 119.9° |
| C8 | N7 | C15 | 122.5° | 120.4° |
| O1 | C10 | N3 | 118.5° | 120.2° |
| C10 | N3 | C15 | 123.5° | 120.6° |
| C10 | N3 | C11 | 118.0° | 119.7° |
| C16 | N7 | C15 | 116.7° | 119.8° |
| N7 | C16 | C17 | 111.2° | 109.5° |
| N7 | C16 | H18 | 109.0° | 109.5° |
| N7 | C16 | H19 | 109.1° | 109.5° |
| N7 | C15 | N3 | 117.2° | 121.0° |
| N7 | C15 | O2 | 121.3° | 119.5° |
| C16 | C17 | C18 | 122.5° | 120.0° |
| C16 | C17 | C22 | 119.7° | 120.0° |
| C17 | C16 | H18 | 109.1° | 109.5° |
| C17 | C16 | H19 | 109.0° | 109.5° |
| C18 | C17 | C22 | 117.8° | 120.1° |
| C17 | C18 | C19 | 119.7° | 120.0° |
| C17 | C18 | H20 | 120.2° | 120.0° |
| C17 | C22 | F3 | 117.5° | 120.0° |
| C17 | C22 | C21 | 123.6° | 120.0° |
| C18 | C19 | F1 | 120.7° | 120.0° |
| C18 | C19 | C20 | 120.9° | 120.0° |
| C19 | C18 | H20 | 120.2° | 120.0° |
| F3 | C22 | C21 | 118.9° | 120.0° |
| C22 | C21 | C20 | 116.7° | 120.0° |
| C22 | C21 | H21 | 121.7° | 120.0° |
| F1 | C19 | C20 | 118.3° | 120.0° |
| C19 | C20 | C21 | 121.1° | 120.0° |
| C19 | C20 | F2 | 117.4° | 120.0° |
| C15 | N3 | C11 | 118.4° | 119.8° |
| N3 | C15 | O2 | 121.5° | 119.5° |
| N3 | C11 | C12 | 114.8° | 109.5° |
| N3 | C11 | H6 | 108.1° | 109.5° |
| N3 | C11 | H7 | 108.1° | 109.4° |
| C21 | C20 | F2 | 121.4° | 120.0° |
| C20 | C21 | H21 | 121.6° | 120.0° |
| C12 | N6 | N5 | 102.8° | 106.8° |
| N6 | C12 | C11 | 124.7° | 125.5° |
| N6 | C12 | N4 | 113.9° | 108.9° |
| N6 | N5 | C14 | 122.3° | 126.8° |
| N6 | N5 | C13 | 109.2° | 106.4° |
| C11 | C12 | N4 | 121.4° | 125.6° |
| C12 | C11 | H6 | 108.1° | 109.5° |
| C12 | C11 | H7 | 108.1° | 109.5° |
| C14 | N5 | C13 | 128.4° | 126.8° |
| N5 | C14 | H2 | 109.5° | 109.5° |
| N5 | C14 | H3 | 109.5° | 109.5° |
| N5 | C14 | H4 | 109.5° | 109.5° |
| C12 | N4 | C13 | 104.0° | 109.8° |
| N5 | C13 | N4 | 110.0° | 108.1° |
| N5 | C13 | H9 | 125.0° | 126.0° |
| N4 | C13 | H9 | 125.0° | 125.9° |
| H2 | C14 | H3 | 109.5° | 109.5° |
| H2 | C14 | H4 | 109.4° | 109.4° |
| H3 | C14 | H4 | 109.5° | 109.5° |
| H6 | C11 | H7 | 109.4° | 109.4° |
| H11 | C3 | H12 | 109.5° | 109.5° |
| H11 | C3 | H13 | 109.5° | 109.5° |
| H12 | C3 | H13 | 109.5° | 109.5° |
| H14 | C1 | H15 | 109.5° | 109.5° |
| H14 | C1 | H16 | 109.5° | 109.4° |
| H15 | C1 | H16 | 109.4° | 109.5° |
| H18 | C16 | H19 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | C2 | C1 | N1 | 126.3° | 120.0° |
| C3 | C2 | C1 | H17 | 118.4° | 120.0° |
| C3 | C2 | N1 | H17 | 115.5° | 120.0° |
| C3 | C2 | N1 | N8 | 81.2° | 95.0° |
| C3 | C2 | N1 | C4 | 99.6° | 84.7° |
| C2 | C3 | H11 | H12 | 120.0° | 119.9° |
| C2 | C3 | H11 | H13 | 120.0° | 120.0° |
| C2 | C3 | H12 | H13 | 120.0° | 120.0° |
| C3 | C2 | C1 | H14 | 180.0° | 60.0° |
| C3 | C2 | C1 | H15 | 60.0° | 180.0° |
| C3 | C2 | C1 | H16 | 60.0° | 59.9° |
| C1 | C2 | N1 | H17 | 115.2° | 119.9° |
| C1 | C2 | N1 | N8 | 48.1° | 144.9° |
| C1 | C2 | N1 | C4 | 131.1° | 35.4° |
| C1 | C2 | C3 | H11 | 180.0° | 60.0° |
| C1 | C2 | C3 | H12 | 60.0° | 59.9° |
| C1 | C2 | C3 | H13 | 60.0° | 180.0° |
| C2 | C1 | H14 | H15 | 120.0° | 120.0° |
| C2 | C1 | H14 | H16 | 120.0° | 119.9° |
| C2 | C1 | H15 | H16 | 120.0° | 120.0° |
| C2 | N1 | N8 | C4 | 179.3° | 179.7° |
| C2 | N1 | N8 | C25 | 179.8° | 180.0° |
| C2 | N1 | C4 | C5 | 178.7° | 179.7° |
| C2 | N1 | C4 | H1 | 1.3° | 0.0° |
| N1 | C2 | C3 | H11 | 54.0° | 60.0° |
| N1 | C2 | C3 | H12 | 174.0° | 180.0° |
| N1 | C2 | C3 | H13 | 66.0° | 60.0° |
| N1 | C2 | C1 | H14 | 53.7° | 60.1° |
| N1 | C2 | C1 | H15 | 66.3° | 60.0° |
| N1 | C2 | C1 | H16 | 173.7° | 180.0° |
| N8 | N1 | C4 | C5 | 0.6° | 0.0° |
| N1 | N8 | C25 | C5 | 1.4° | 0.4° |
| N1 | N8 | C25 | C24 | 179.5° | 179.9° |
| N8 | N1 | C4 | H1 | 179.5° | 179.7° |
| N8 | N1 | C2 | H17 | 163.3° | 25.0° |
| C4 | N1 | N8 | C25 | 0.5° | 0.2° |
| N1 | C4 | C5 | H1 | 180.0° | 179.7° |
| N1 | C4 | C5 | C25 | 1.3° | 0.3° |
| N1 | C4 | C5 | C6 | 178.9° | 179.7° |
| C4 | N1 | C2 | H17 | 15.9° | 155.3° |
| N8 | C25 | C5 | C4 | 1.7° | 0.4° |
| N8 | C25 | C5 | C24 | 178.3° | 179.6° |
| N8 | C25 | C5 | C6 | 178.5° | 179.6° |
| N8 | C25 | C24 | C23 | 179.0° | 179.4° |
| N8 | C25 | C24 | H22 | 1.0° | 0.6° |
| C4 | C5 | C25 | C6 | 179.8° | 180.0° |
| C4 | C5 | C25 | C24 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 179.2° | 180.0° |
| C4 | C5 | C6 | H5 | 0.8° | 0.0° |
| C5 | C25 | C24 | C23 | 1.0° | 0.0° |
| C25 | C5 | C6 | C7 | 0.6° | 0.0° |
| C25 | C5 | C4 | H1 | 178.7° | 180.0° |
| C25 | C5 | C6 | H5 | 179.4° | 180.0° |
| C5 | C25 | C24 | H22 | 179.0° | 180.0° |
| C24 | C25 | C5 | C6 | 0.1° | 0.0° |
| C25 | C24 | C23 | H22 | 180.0° | 180.0° |
| C25 | C24 | C23 | C7 | 1.1° | 0.0° |
| C25 | C24 | C23 | CL1 | 179.8° | 180.0° |
| C5 | C6 | C7 | H5 | 180.0° | 180.0° |
| C5 | C6 | C7 | C23 | 0.5° | 0.0° |
| C5 | C6 | C7 | N2 | 178.0° | 180.0° |
| C6 | C5 | C4 | H1 | 1.1° | 0.0° |
| C24 | C23 | C7 | C6 | 0.4° | 0.0° |
| C24 | C23 | C7 | CL1 | 179.1° | 180.0° |
| C24 | C23 | C7 | N2 | 176.9° | 180.0° |
| C6 | C7 | C23 | N2 | 177.3° | 180.0° |
| C6 | C7 | C23 | CL1 | 179.5° | 180.0° |
| C6 | C7 | N2 | C8 | 112.1° | 6.5° |
| C6 | C7 | N2 | H10 | 67.9° | 173.5° |
| C23 | C7 | N2 | C8 | 65.4° | 173.5° |
| C23 | C7 | C6 | H5 | 179.5° | 180.0° |
| C23 | C7 | N2 | H10 | 114.6° | 6.4° |
| C7 | C23 | C24 | H22 | 178.9° | 180.0° |
| CL1 | C23 | C7 | N2 | 2.2° | 0.0° |
| CL1 | C23 | C24 | H22 | 0.3° | 0.0° |
| C7 | N2 | C8 | H10 | 180.0° | 180.0° |
| C7 | N2 | C8 | C9 | 6.1° | 117.1° |
| C7 | N2 | C8 | N7 | 174.9° | 63.2° |
| N2 | C7 | C6 | H5 | 2.0° | 0.0° |
| N2 | C8 | C9 | N7 | 179.1° | 179.7° |
| N2 | C8 | C9 | C10 | 178.8° | 179.7° |
| N2 | C8 | N7 | C16 | 0.5° | 0.3° |
| N2 | C8 | N7 | C15 | 178.4° | 179.7° |
| N2 | C8 | C9 | H8 | 1.2° | 0.3° |
| C8 | C9 | C10 | H8 | 180.0° | 180.0° |
| C8 | C9 | C10 | O1 | 179.0° | 180.0° |
| C8 | C9 | C10 | N3 | 0.2° | 0.0° |
| C9 | C8 | N7 | C16 | 179.5° | 180.0° |
| C9 | C8 | N7 | C15 | 2.5° | 0.0° |
| C9 | C8 | N2 | H10 | 173.9° | 62.9° |
| C10 | C9 | C8 | N7 | 2.1° | 0.0° |
| C9 | C10 | O1 | N3 | 179.2° | 180.0° |
| C9 | C10 | N3 | C15 | 1.4° | 0.1° |
| C9 | C10 | N3 | C11 | 173.8° | 180.0° |
| C8 | N7 | C16 | C15 | 178.0° | 180.0° |
| C8 | N7 | C16 | C17 | 92.4° | 95.4° |
| C8 | N7 | C15 | N3 | 0.9° | 0.0° |
| C8 | N7 | C15 | O2 | 179.7° | 180.0° |
| N7 | C8 | C9 | H8 | 177.8° | 180.0° |
| N7 | C8 | N2 | H10 | 5.1° | 116.8° |
| C8 | N7 | C16 | H18 | 147.4° | 144.6° |
| C8 | N7 | C16 | H19 | 27.9° | 24.6° |
| O1 | C10 | N3 | C15 | 179.3° | 180.0° |
| O1 | C10 | N3 | C11 | 5.5° | 0.0° |
| O1 | C10 | C9 | H8 | 1.0° | 0.0° |
| C10 | N3 | C15 | N7 | 1.1° | 0.1° |
| C10 | N3 | C15 | C11 | 175.2° | 180.0° |
| C10 | N3 | C15 | O2 | 177.7° | 180.0° |
| C10 | N3 | C11 | C12 | 101.5° | 90.1° |
| C10 | N3 | C11 | H6 | 137.6° | 30.0° |
| C10 | N3 | C11 | H7 | 19.3° | 150.0° |
| N3 | C10 | C9 | H8 | 179.8° | 180.0° |
| N7 | C16 | C17 | H18 | 120.3° | 120.1° |
| N7 | C16 | C17 | H19 | 120.3° | 120.0° |
| N7 | C16 | C17 | C18 | 8.9° | 98.0° |
| N7 | C16 | C17 | C22 | 173.4° | 82.3° |
| C16 | N7 | C15 | N3 | 178.9° | 180.0° |
| C16 | N7 | C15 | O2 | 2.3° | 0.0° |
| N7 | C16 | H18 | H19 | 119.2° | 120.0° |
| C15 | N7 | C16 | C17 | 85.7° | 84.6° |
| N7 | C15 | N3 | O2 | 178.8° | 180.0° |
| N7 | C15 | N3 | C11 | 174.0° | 180.0° |
| C15 | N7 | C16 | H18 | 34.6° | 35.5° |
| C15 | N7 | C16 | H19 | 154.1° | 155.4° |
| C16 | C17 | C18 | C22 | 177.8° | 179.7° |
| C16 | C17 | C18 | C19 | 179.3° | 180.0° |
| C16 | C17 | C22 | F3 | 0.7° | 0.0° |
| C16 | C17 | C22 | C21 | 179.1° | 179.7° |
| C17 | C16 | H18 | H19 | 119.2° | 120.0° |
| C16 | C17 | C18 | H20 | 0.7° | 0.0° |
| C17 | C18 | C19 | H20 | 180.0° | 180.0° |
| C18 | C17 | C22 | F3 | 178.6° | 179.7° |
| C18 | C17 | C22 | C21 | 3.1° | 0.6° |
| C17 | C18 | C19 | F1 | 179.8° | 180.0° |
| C17 | C18 | C19 | C20 | 3.1° | 0.0° |
| C18 | C17 | C16 | H18 | 129.2° | 22.0° |
| C18 | C17 | C16 | H19 | 111.4° | 142.0° |
| C22 | C17 | C18 | C19 | 2.9° | 0.3° |
| C17 | C22 | F3 | C21 | 178.4° | 179.7° |
| C17 | C22 | C21 | C20 | 3.2° | 0.6° |
| C22 | C17 | C16 | H18 | 53.1° | 157.7° |
| C22 | C17 | C16 | H19 | 66.4° | 37.7° |
| C22 | C17 | C18 | H20 | 177.1° | 179.7° |
| C17 | C22 | C21 | H21 | 176.8° | 179.7° |
| C18 | C19 | F1 | C20 | 177.2° | 180.0° |
| C18 | C19 | C20 | C21 | 3.3° | 0.0° |
| C18 | C19 | C20 | F2 | 179.3° | 180.0° |
| F3 | C22 | C21 | C20 | 178.5° | 179.7° |
| F3 | C22 | C21 | H21 | 1.5° | 0.0° |
| C22 | C21 | C20 | C19 | 3.2° | 0.3° |
| C22 | C21 | C20 | H21 | 180.0° | 179.7° |
| C22 | C21 | C20 | F2 | 179.6° | 179.7° |
| F1 | C19 | C20 | C21 | 179.6° | 180.0° |
| F1 | C19 | C20 | F2 | 2.2° | 0.0° |
| F1 | C19 | C18 | H20 | 0.2° | 0.0° |
| C19 | C20 | C21 | F2 | 177.3° | 180.0° |
| C20 | C19 | C18 | H20 | 176.9° | 180.0° |
| C19 | C20 | C21 | H21 | 176.8° | 180.0° |
| C15 | N3 | C11 | C12 | 83.0° | 90.0° |
| C15 | N3 | C11 | H6 | 37.8° | 149.9° |
| C15 | N3 | C11 | H7 | 156.2° | 30.0° |
| C11 | N3 | C15 | O2 | 7.1° | 0.0° |
| N3 | C11 | C12 | N6 | 2.1° | 90.3° |
| N3 | C11 | C12 | H6 | 120.8° | 120.1° |
| N3 | C11 | C12 | H7 | 120.8° | 120.0° |
| N3 | C11 | C12 | N4 | 175.7° | 89.9° |
| N3 | C11 | H6 | H7 | 117.6° | 119.9° |
| F2 | C20 | C21 | H21 | 0.4° | 0.0° |
| N6 | C12 | C11 | N4 | 177.7° | 179.8° |
| C12 | N6 | N5 | C14 | 179.6° | 180.0° |
| C12 | N6 | N5 | C13 | 3.0° | 0.2° |
| N6 | C12 | N4 | C13 | 1.0° | 0.2° |
| N6 | C12 | C11 | H6 | 122.9° | 29.8° |
| N6 | C12 | C11 | H7 | 118.7° | 149.7° |
| N5 | N6 | C12 | C11 | 179.6° | 180.0° |
| N6 | N5 | C14 | C13 | 176.8° | 179.8° |
| N5 | N6 | C12 | N4 | 2.5° | 0.2° |
| N6 | N5 | C13 | N4 | 2.6° | 0.1° |
| N6 | N5 | C14 | H2 | 0.0° | 89.8° |
| N6 | N5 | C14 | H3 | 120.0° | 30.2° |
| N6 | N5 | C14 | H4 | 120.0° | 150.2° |
| N6 | N5 | C13 | H9 | 177.4° | 179.9° |
| C11 | C12 | N4 | C13 | 178.9° | 180.0° |
| C12 | C11 | H6 | H7 | 117.6° | 120.0° |
| C14 | N5 | C13 | N4 | 179.8° | 179.9° |
| N5 | C14 | H2 | H3 | 120.0° | 120.1° |
| N5 | C14 | H2 | H4 | 120.0° | 120.0° |
| N5 | C14 | H3 | H4 | 120.0° | 120.0° |
| C14 | N5 | C13 | H9 | 0.2° | 0.1° |
| C12 | N4 | C13 | N5 | 1.1° | 0.0° |
| N4 | C12 | C11 | H6 | 54.9° | 150.0° |
| N4 | C12 | C11 | H7 | 63.5° | 30.0° |
| C12 | N4 | C13 | H9 | 179.0° | 180.0° |
| N5 | C13 | N4 | H9 | 180.0° | 180.0° |
| C13 | N5 | C14 | H2 | 176.9° | 89.9° |
| C13 | N5 | C14 | H3 | 56.8° | 150.0° |
| C13 | N5 | C14 | H4 | 63.2° | 30.0° |
| H2 | C14 | H3 | H4 | 120.0° | 119.9° |
| H11 | C3 | H12 | H13 | 120.0° | 120.1° |
| H11 | C3 | C2 | H17 | 61.6° | 180.0° |
| H12 | C3 | C2 | H17 | 58.4° | 60.0° |
| H13 | C3 | C2 | H17 | 178.4° | 60.0° |
| H14 | C1 | H15 | H16 | 120.0° | 120.0° |
| H14 | C1 | C2 | H17 | 61.6° | 180.0° |
| H15 | C1 | C2 | H17 | 178.4° | 60.0° |
| H16 | C1 | C2 | H17 | 58.4° | 60.1° |
