9WA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C17 | doub | 1.35Å | 1.38Å | Aromatic |
| C18 | C19 | sing | 1.40Å | 1.42Å | Aromatic |
| C17 | N1 | sing | 1.35Å | 1.37Å | Aromatic |
| C19 | N2 | doub | 1.31Å | 1.34Å | Aromatic |
| N1 | N2 | sing | 1.40Å | 1.34Å | Aromatic |
| N1 | C14 | sing | 1.40Å | 1.39Å | |
| C15 | C14 | doub | 1.39Å | 1.37Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.37Å | Aromatic |
| C14 | C13 | sing | 1.39Å | 1.37Å | Aromatic |
| C16 | C11 | doub | 1.38Å | 1.37Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.37Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | sing | 1.51Å | 1.49Å | |
| C10 | C9 | sing | 1.51Å | 1.49Å | |
| CL | C8 | sing | 1.74Å | 1.72Å | |
| C9 | C8 | doub | 1.37Å | 1.37Å | Aromatic |
| C9 | C1 | sing | 1.40Å | 1.37Å | Aromatic |
| C8 | C7 | sing | 1.41Å | 1.38Å | Aromatic |
| O | C1 | sing | 1.36Å | 1.38Å | |
| O | C | sing | 1.43Å | 1.42Å | |
| C1 | N | doub | 1.32Å | 1.33Å | Aromatic |
| C7 | C6 | doub | 1.40Å | 1.38Å | Aromatic |
| C7 | C2 | sing | 1.42Å | 1.38Å | Aromatic |
| C6 | C5 | sing | 1.36Å | 1.37Å | Aromatic |
| N | C2 | sing | 1.34Å | 1.33Å | Aromatic |
| C24 | N4 | sing | 1.47Å | 1.44Å | |
| C2 | C3 | doub | 1.40Å | 1.37Å | Aromatic |
| O1 | C20 | sing | 1.43Å | 1.42Å | |
| C5 | C20 | sing | 1.51Å | 1.49Å | |
| C5 | C4 | doub | 1.39Å | 1.37Å | Aromatic |
| C20 | C21 | sing | 1.51Å | 1.47Å | |
| C20 | C25 | sing | 1.51Å | 1.49Å | |
| C3 | C4 | sing | 1.36Å | 1.37Å | Aromatic |
| N4 | C21 | sing | 1.37Å | 1.36Å | Aromatic |
| N4 | C23 | sing | 1.35Å | 1.36Å | Aromatic |
| C26 | C25 | doub | 1.39Å | 1.37Å | Aromatic |
| C26 | C27 | sing | 1.39Å | 1.37Å | Aromatic |
| C21 | C22 | doub | 1.35Å | 1.38Å | Aromatic |
| C25 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C23 | N3 | doub | 1.31Å | 1.31Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.37Å | Aromatic |
| C29 | N5 | doub | 1.32Å | 1.33Å | Aromatic |
| C22 | N3 | sing | 1.34Å | 1.37Å | Aromatic |
| F1 | C30 | sing | 1.40Å | 1.36Å | |
| C28 | N5 | sing | 1.32Å | 1.33Å | Aromatic |
| C28 | C30 | sing | 1.51Å | 1.49Å | |
| C30 | F2 | sing | 1.40Å | 1.36Å | |
| C30 | F | sing | 1.40Å | 1.36Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| C | H'1 | sing | 1.09Å | 1.10Å | |
| C | H'2 | sing | 1.09Å | 1.10Å | |
| C | H'3 | sing | 1.09Å | 1.10Å | |
| C10 | H103 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C18 | C19 | 104.2° | 108.0° |
| C18 | C17 | N1 | 106.1° | 107.7° |
| C17 | C18 | H18 | 127.9° | 126.0° |
| C18 | C17 | H17 | 127.0° | 126.2° |
| C18 | C19 | N2 | 112.5° | 108.2° |
| C19 | C18 | H18 | 127.9° | 126.0° |
| C18 | C19 | H19 | 123.8° | 125.9° |
| C17 | N1 | N2 | 113.7° | 107.9° |
| C17 | N1 | C14 | 125.9° | 126.1° |
| N1 | C17 | H17 | 126.9° | 126.1° |
| C19 | N2 | N1 | 103.5° | 108.2° |
| N2 | C19 | H19 | 123.8° | 125.9° |
| N2 | N1 | C14 | 120.4° | 126.0° |
| N1 | C14 | C15 | 120.5° | 120.1° |
| N1 | C14 | C13 | 119.8° | 120.0° |
| C14 | C15 | C16 | 120.0° | 119.9° |
| C15 | C14 | C13 | 119.7° | 119.9° |
| C14 | C15 | H15 | 120.0° | 120.0° |
| C15 | C16 | C11 | 120.4° | 120.1° |
| C15 | C16 | H16 | 119.8° | 119.9° |
| C16 | C15 | H15 | 120.0° | 120.1° |
| C14 | C13 | C12 | 120.3° | 119.9° |
| C14 | C13 | H13 | 119.8° | 120.1° |
| C16 | C11 | C12 | 119.7° | 120.1° |
| C16 | C11 | C10 | 119.0° | 119.9° |
| C11 | C16 | H16 | 119.8° | 120.0° |
| C13 | C12 | C11 | 119.9° | 120.1° |
| C13 | C12 | H12 | 120.0° | 120.0° |
| C12 | C13 | H13 | 119.8° | 120.0° |
| C12 | C11 | C10 | 121.3° | 120.0° |
| C11 | C12 | H12 | 120.0° | 119.9° |
| C11 | C10 | C9 | 114.6° | 109.5° |
| C11 | C10 | H103 | 108.2° | 109.5° |
| C11 | C10 | H102 | 108.2° | 109.5° |
| C10 | C9 | C8 | 122.6° | 120.0° |
| C10 | C9 | C1 | 120.7° | 120.1° |
| C9 | C10 | H103 | 108.2° | 109.5° |
| C9 | C10 | H102 | 108.2° | 109.4° |
| CL | C8 | C9 | 119.5° | 120.9° |
| CL | C8 | C7 | 119.8° | 120.9° |
| C8 | C9 | C1 | 116.7° | 119.9° |
| C9 | C8 | C7 | 120.8° | 118.2° |
| C9 | C1 | O | 117.1° | 119.1° |
| C9 | C1 | N | 124.0° | 121.6° |
| C8 | C7 | C6 | 121.4° | 121.3° |
| C8 | C7 | C2 | 118.1° | 119.1° |
| C1 | O | C | 107.6° | 116.9° |
| O | C1 | N | 118.9° | 119.2° |
| O | C | H'1 | 109.5° | 109.4° |
| O | C | H'2 | 109.5° | 109.5° |
| O | C | H'3 | 109.5° | 109.5° |
| C1 | N | C2 | 118.1° | 121.3° |
| C6 | C7 | C2 | 120.5° | 119.6° |
| C7 | C6 | C5 | 120.2° | 119.7° |
| C7 | C6 | H6 | 119.9° | 120.2° |
| C7 | C2 | N | 122.3° | 119.9° |
| C7 | C2 | C3 | 118.7° | 119.1° |
| C6 | C5 | C20 | 121.0° | 119.6° |
| C6 | C5 | C4 | 119.6° | 120.9° |
| C5 | C6 | H6 | 119.9° | 120.2° |
| N | C2 | C3 | 119.0° | 121.0° |
| C24 | N4 | C21 | 125.4° | 126.4° |
| C24 | N4 | C23 | 126.4° | 126.4° |
| N4 | C24 | H242 | 109.5° | 109.4° |
| N4 | C24 | H241 | 109.5° | 109.4° |
| N4 | C24 | H243 | 109.5° | 109.5° |
| C2 | C3 | C4 | 121.3° | 119.7° |
| C2 | C3 | H3 | 119.3° | 120.1° |
| O1 | C20 | C5 | 107.6° | 109.5° |
| O1 | C20 | C21 | 106.3° | 109.5° |
| O1 | C20 | C25 | 107.3° | 109.5° |
| C20 | O1 | H1 | 109.5° | 114.0° |
| C20 | C5 | C4 | 119.4° | 119.6° |
| C5 | C20 | C21 | 107.1° | 109.4° |
| C5 | C20 | C25 | 114.3° | 109.5° |
| C5 | C4 | C3 | 119.7° | 121.0° |
| C5 | C4 | H4 | 120.1° | 119.5° |
| C21 | C20 | C25 | 113.8° | 109.4° |
| C20 | C21 | N4 | 121.2° | 126.6° |
| C20 | C21 | C22 | 134.6° | 126.6° |
| C20 | C25 | C26 | 120.8° | 120.4° |
| C20 | C25 | C29 | 121.6° | 120.4° |
| C3 | C4 | H4 | 120.2° | 119.5° |
| C4 | C3 | H3 | 119.4° | 120.1° |
| C21 | N4 | C23 | 108.2° | 107.2° |
| N4 | C21 | C22 | 104.2° | 106.8° |
| N4 | C23 | N3 | 111.5° | 108.6° |
| N4 | C23 | H23 | 124.3° | 125.7° |
| C25 | C26 | C27 | 119.1° | 118.4° |
| C26 | C25 | C29 | 117.6° | 119.2° |
| C25 | C26 | H26 | 120.4° | 120.7° |
| C26 | C27 | C28 | 119.2° | 119.2° |
| C27 | C26 | H26 | 120.5° | 120.8° |
| C26 | C27 | H27 | 120.4° | 120.4° |
| C21 | C22 | N3 | 111.5° | 108.0° |
| C21 | C22 | H22 | 124.3° | 126.0° |
| C25 | C29 | N5 | 124.4° | 120.7° |
| C25 | C29 | H29 | 117.8° | 119.6° |
| C23 | N3 | C22 | 104.7° | 109.3° |
| N3 | C23 | H23 | 124.2° | 125.7° |
| C27 | C28 | N5 | 122.9° | 120.7° |
| C27 | C28 | C30 | 119.1° | 119.6° |
| C28 | C27 | H27 | 120.4° | 120.4° |
| C29 | N5 | C28 | 116.6° | 121.8° |
| N5 | C29 | H29 | 117.8° | 119.6° |
| N3 | C22 | H22 | 124.3° | 126.0° |
| F1 | C30 | C28 | 112.7° | 109.5° |
| F1 | C30 | F2 | 105.7° | 109.5° |
| F1 | C30 | F | 106.5° | 109.5° |
| N5 | C28 | C30 | 117.9° | 119.6° |
| C28 | C30 | F2 | 112.9° | 109.4° |
| C28 | C30 | F | 112.3° | 109.5° |
| F2 | C30 | F | 106.2° | 109.5° |
| H242 | C24 | H241 | 109.4° | 109.5° |
| H242 | C24 | H243 | 109.5° | 109.5° |
| H241 | C24 | H243 | 109.5° | 109.5° |
| H'1 | C | H'2 | 109.4° | 109.4° |
| H'1 | C | H'3 | 109.5° | 109.5° |
| H'2 | C | H'3 | 109.5° | 109.5° |
| H103 | C10 | H102 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C18 | C19 | H18 | 180.0° | 179.7° |
| C18 | C17 | N1 | H17 | 180.0° | 180.0° |
| C17 | C18 | C19 | N2 | 0.1° | 0.0° |
| C18 | C17 | N1 | N2 | 0.0° | 0.0° |
| C18 | C17 | N1 | C14 | 177.9° | 179.9° |
| C17 | C18 | C19 | H19 | 180.0° | 180.0° |
| C19 | C18 | C17 | N1 | 0.0° | 0.0° |
| C18 | C19 | N2 | H19 | 180.0° | 180.0° |
| C18 | C19 | N2 | N1 | 0.1° | 0.0° |
| C19 | C18 | C17 | H17 | 179.9° | 180.0° |
| C17 | N1 | N2 | C19 | 0.0° | 0.0° |
| C17 | N1 | N2 | C14 | 178.0° | 179.9° |
| C17 | N1 | C14 | C15 | 2.3° | 180.0° |
| C17 | N1 | C14 | C13 | 177.9° | 0.0° |
| N1 | C17 | C18 | H18 | 180.0° | 179.7° |
| C19 | N2 | N1 | C14 | 178.0° | 179.9° |
| N2 | C19 | C18 | H18 | 179.9° | 179.7° |
| N2 | N1 | C14 | C15 | 175.5° | 0.1° |
| N2 | N1 | C14 | C13 | 4.4° | 179.9° |
| N1 | N2 | C19 | H19 | 180.0° | 180.0° |
| N2 | N1 | C17 | H17 | 180.0° | 180.0° |
| N1 | C14 | C15 | C13 | 179.9° | 180.0° |
| N1 | C14 | C15 | C16 | 179.7° | 179.9° |
| N1 | C14 | C13 | C12 | 179.7° | 179.6° |
| N1 | C14 | C15 | H15 | 0.3° | 0.0° |
| N1 | C14 | C13 | H13 | 0.3° | 0.3° |
| C14 | N1 | C17 | H17 | 2.1° | 0.1° |
| C14 | C15 | C16 | H15 | 180.0° | 179.9° |
| C14 | C15 | C16 | C11 | 0.2° | 0.1° |
| C15 | C14 | C13 | C12 | 0.1° | 0.3° |
| C14 | C15 | C16 | H16 | 179.8° | 179.7° |
| C15 | C14 | C13 | H13 | 179.9° | 179.7° |
| C16 | C15 | C14 | C13 | 0.1° | 0.1° |
| C15 | C16 | C11 | H16 | 180.0° | 179.6° |
| C15 | C16 | C11 | C12 | 0.2° | 0.3° |
| C15 | C16 | C11 | C10 | 179.8° | 179.7° |
| C14 | C13 | C12 | H13 | 180.0° | 179.9° |
| C14 | C13 | C12 | C11 | 0.2° | 0.6° |
| C14 | C13 | C12 | H12 | 179.8° | 180.0° |
| C13 | C14 | C15 | H15 | 179.9° | 179.9° |
| C16 | C11 | C12 | C13 | 0.2° | 0.6° |
| C16 | C11 | C12 | C10 | 179.5° | 180.0° |
| C16 | C11 | C10 | C9 | 127.3° | 89.9° |
| C16 | C11 | C12 | H12 | 179.7° | 180.0° |
| C11 | C16 | C15 | H15 | 179.8° | 179.9° |
| C16 | C11 | C10 | H103 | 6.6° | 150.0° |
| C16 | C11 | C10 | H102 | 111.9° | 30.0° |
| C13 | C12 | C11 | H12 | 180.0° | 179.4° |
| C13 | C12 | C11 | C10 | 179.8° | 179.4° |
| C12 | C11 | C10 | C9 | 53.1° | 90.1° |
| C12 | C11 | C16 | H16 | 179.7° | 180.0° |
| C11 | C12 | C13 | H13 | 179.8° | 179.5° |
| C12 | C11 | C10 | H103 | 173.9° | 30.0° |
| C12 | C11 | C10 | H102 | 67.7° | 150.0° |
| C11 | C10 | C9 | H103 | 120.8° | 120.1° |
| C11 | C10 | C9 | H102 | 120.8° | 120.0° |
| C11 | C10 | C9 | C8 | 76.8° | 90.0° |
| C11 | C10 | C9 | C1 | 103.7° | 90.0° |
| C10 | C11 | C16 | H16 | 0.2° | 0.0° |
| C10 | C11 | C12 | H12 | 0.2° | 0.0° |
| C11 | C10 | H103 | H102 | 117.7° | 120.0° |
| C10 | C9 | C8 | CL | 0.4° | 0.1° |
| C10 | C9 | C8 | C1 | 179.5° | 179.9° |
| C10 | C9 | C8 | C7 | 179.8° | 180.0° |
| C10 | C9 | C1 | O | 0.1° | 0.0° |
| C10 | C9 | C1 | N | 179.7° | 179.6° |
| C9 | C10 | H103 | H102 | 117.6° | 119.9° |
| CL | C8 | C9 | C7 | 179.8° | 179.9° |
| CL | C8 | C9 | C1 | 179.9° | 180.0° |
| CL | C8 | C7 | C6 | 0.1° | 0.0° |
| CL | C8 | C7 | C2 | 180.0° | 179.7° |
| C8 | C9 | C1 | O | 179.6° | 180.0° |
| C8 | C9 | C1 | N | 0.2° | 0.3° |
| C9 | C8 | C7 | C6 | 179.9° | 180.0° |
| C9 | C8 | C7 | C2 | 0.2° | 0.4° |
| C8 | C9 | C10 | H103 | 44.0° | 30.0° |
| C8 | C9 | C10 | H102 | 162.4° | 150.0° |
| C1 | C9 | C8 | C7 | 0.3° | 0.1° |
| C9 | C1 | O | N | 179.8° | 179.7° |
| C9 | C1 | O | C | 163.4° | 180.0° |
| C9 | C1 | N | C2 | 0.1° | 0.3° |
| C1 | C9 | C10 | H103 | 135.5° | 149.9° |
| C1 | C9 | C10 | H102 | 17.0° | 29.9° |
| C8 | C7 | C6 | C2 | 179.9° | 179.7° |
| C8 | C7 | C6 | C5 | 179.8° | 180.0° |
| C8 | C7 | C2 | N | 0.0° | 0.4° |
| C8 | C7 | C2 | C3 | 179.9° | 180.0° |
| C8 | C7 | C6 | H6 | 0.2° | 0.0° |
| O | C1 | N | C2 | 179.9° | 180.0° |
| C1 | O | C | H'1 | 180.0° | 180.0° |
| C1 | O | C | H'2 | 60.0° | 60.1° |
| C1 | O | C | H'3 | 60.0° | 60.0° |
| C | O | C1 | N | 16.8° | 0.3° |
| O | C | H'1 | H'2 | 120.0° | 120.0° |
| O | C | H'1 | H'3 | 120.0° | 120.1° |
| O | C | H'2 | H'3 | 120.0° | 120.1° |
| C1 | N | C2 | C7 | 0.2° | 0.0° |
| C1 | N | C2 | C3 | 179.9° | 179.7° |
| C7 | C6 | C5 | H6 | 180.0° | 180.0° |
| C6 | C7 | C2 | N | 179.8° | 180.0° |
| C6 | C7 | C2 | C3 | 0.1° | 0.3° |
| C7 | C6 | C5 | C20 | 179.5° | 180.0° |
| C7 | C6 | C5 | C4 | 0.3° | 0.0° |
| C2 | C7 | C6 | C5 | 0.1° | 0.3° |
| C7 | C2 | N | C3 | 179.9° | 179.6° |
| C7 | C2 | C3 | C4 | 0.1° | 0.0° |
| C7 | C2 | C3 | H3 | 180.0° | 179.9° |
| C2 | C7 | C6 | H6 | 179.9° | 179.7° |
| C6 | C5 | C20 | O1 | 18.0° | 2.6° |
| C6 | C5 | C20 | C4 | 179.1° | 180.0° |
| C6 | C5 | C20 | C21 | 132.0° | 122.6° |
| C6 | C5 | C20 | C25 | 101.0° | 117.5° |
| C6 | C5 | C4 | C3 | 0.5° | 0.3° |
| C6 | C5 | C4 | H4 | 179.6° | 180.0° |
| N | C2 | C3 | C4 | 180.0° | 179.6° |
| N | C2 | C3 | H3 | 0.0° | 0.3° |
| C24 | N4 | C21 | C20 | 0.4° | 0.0° |
| C24 | N4 | C21 | C23 | 180.0° | 179.8° |
| C24 | N4 | C21 | C22 | 179.7° | 180.0° |
| C24 | N4 | C23 | N3 | 179.9° | 179.9° |
| C24 | N4 | C23 | H23 | 0.1° | 0.3° |
| N4 | C24 | H242 | H241 | 120.0° | 119.9° |
| N4 | C24 | H242 | H243 | 120.0° | 120.0° |
| N4 | C24 | H241 | H243 | 120.0° | 120.0° |
| C2 | C3 | C4 | C5 | 0.3° | 0.3° |
| C2 | C3 | C4 | H3 | 180.0° | 179.9° |
| C2 | C3 | C4 | H4 | 179.7° | 180.0° |
| O1 | C20 | C5 | C21 | 113.9° | 120.0° |
| O1 | C20 | C5 | C25 | 119.0° | 120.1° |
| O1 | C20 | C5 | C4 | 161.1° | 177.5° |
| O1 | C20 | C21 | C25 | 117.9° | 120.0° |
| O1 | C20 | C21 | N4 | 43.4° | 6.1° |
| O1 | C20 | C25 | C26 | 105.3° | 4.6° |
| O1 | C20 | C21 | C22 | 137.4° | 173.9° |
| O1 | C20 | C25 | C29 | 74.2° | 175.5° |
| C5 | C20 | C21 | C25 | 127.3° | 120.0° |
| C20 | C5 | C4 | C3 | 179.6° | 179.6° |
| C5 | C20 | C21 | N4 | 71.4° | 113.9° |
| C5 | C20 | C25 | C26 | 13.9° | 115.4° |
| C5 | C20 | C21 | C22 | 107.8° | 66.1° |
| C5 | C20 | C25 | C29 | 166.6° | 64.5° |
| C20 | C5 | C4 | H4 | 0.4° | 0.0° |
| C20 | C5 | C6 | H6 | 0.5° | 0.0° |
| C5 | C20 | O1 | H1 | 180.0° | 60.0° |
| C4 | C5 | C20 | C21 | 47.2° | 57.5° |
| C4 | C5 | C20 | C25 | 79.9° | 62.5° |
| C5 | C4 | C3 | H4 | 180.0° | 179.6° |
| C5 | C4 | C3 | H3 | 179.7° | 179.8° |
| C4 | C5 | C6 | H6 | 179.7° | 180.0° |
| C20 | C21 | N4 | C22 | 179.4° | 180.0° |
| C20 | C21 | N4 | C23 | 179.6° | 179.8° |
| C21 | C20 | C25 | C26 | 137.4° | 124.6° |
| C21 | C20 | C25 | C29 | 43.1° | 55.5° |
| C20 | C21 | C22 | N3 | 179.6° | 180.0° |
| C20 | C21 | C22 | H22 | 0.4° | 0.3° |
| C21 | C20 | O1 | H1 | 65.5° | 180.0° |
| C25 | C20 | C21 | N4 | 161.3° | 126.1° |
| C20 | C25 | C26 | C29 | 179.5° | 179.9° |
| C20 | C25 | C26 | C27 | 179.8° | 180.0° |
| C25 | C20 | C21 | C22 | 19.6° | 53.8° |
| C20 | C25 | C29 | N5 | 179.9° | 180.0° |
| C20 | C25 | C26 | H26 | 0.2° | 0.2° |
| C20 | C25 | C29 | H29 | 0.1° | 0.0° |
| C25 | C20 | O1 | H1 | 56.6° | 60.0° |
| C21 | N4 | C23 | N3 | 0.1° | 0.4° |
| N4 | C21 | C22 | N3 | 0.4° | 0.0° |
| N4 | C21 | C22 | H22 | 179.6° | 179.7° |
| C21 | N4 | C23 | H23 | 179.9° | 180.0° |
| C21 | N4 | C24 | H242 | 180.0° | 90.0° |
| C21 | N4 | C24 | H241 | 60.0° | 150.0° |
| C21 | N4 | C24 | H243 | 60.0° | 30.0° |
| C23 | N4 | C21 | C22 | 0.3° | 0.2° |
| N4 | C23 | N3 | H23 | 180.0° | 179.6° |
| N4 | C23 | N3 | C22 | 0.1° | 0.4° |
| C23 | N4 | C24 | H242 | 0.0° | 90.3° |
| C23 | N4 | C24 | H241 | 120.0° | 29.7° |
| C23 | N4 | C24 | H243 | 120.0° | 149.7° |
| C25 | C26 | C27 | H26 | 180.0° | 179.8° |
| C25 | C26 | C27 | C28 | 0.1° | 0.0° |
| C26 | C25 | C29 | N5 | 0.4° | 0.1° |
| C25 | C26 | C27 | H27 | 179.9° | 179.9° |
| C26 | C25 | C29 | H29 | 179.6° | 179.9° |
| C27 | C26 | C25 | C29 | 0.3° | 0.1° |
| C26 | C27 | C28 | H27 | 180.0° | 179.9° |
| C26 | C27 | C28 | N5 | 0.1° | 0.0° |
| C26 | C27 | C28 | C30 | 180.0° | 180.0° |
| C21 | C22 | N3 | C23 | 0.3° | 0.3° |
| C21 | C22 | N3 | H22 | 180.0° | 179.7° |
| C25 | C29 | N5 | H29 | 180.0° | 180.0° |
| C25 | C29 | N5 | C28 | 0.3° | 0.0° |
| C29 | C25 | C26 | H26 | 179.7° | 179.7° |
| C23 | N3 | C22 | H22 | 179.7° | 179.9° |
| C27 | C28 | N5 | C29 | 0.0° | 0.0° |
| C27 | C28 | C30 | F1 | 82.6° | 30.0° |
| C27 | C28 | N5 | C30 | 179.9° | 180.0° |
| C27 | C28 | C30 | F2 | 37.0° | 90.0° |
| C27 | C28 | C30 | F | 157.1° | 150.0° |
| C28 | C27 | C26 | H26 | 179.9° | 179.8° |
| C29 | N5 | C28 | C30 | 179.9° | 180.0° |
| C22 | N3 | C23 | H23 | 179.9° | 180.0° |
| F1 | C30 | C28 | N5 | 97.3° | 150.0° |
| F1 | C30 | C28 | F2 | 119.7° | 120.0° |
| F1 | C30 | C28 | F | 120.3° | 120.1° |
| F1 | C30 | F2 | F | 112.9° | 120.0° |
| N5 | C28 | C30 | F2 | 143.1° | 90.0° |
| N5 | C28 | C30 | F | 23.0° | 29.9° |
| N5 | C28 | C27 | H27 | 179.9° | 179.9° |
| C28 | N5 | C29 | H29 | 179.7° | 180.0° |
| C28 | C30 | F2 | F | 123.5° | 120.0° |
| C30 | C28 | C27 | H27 | 0.0° | 0.0° |
| H4 | C4 | C3 | H3 | 0.3° | 0.1° |
| H16 | C16 | C15 | H15 | 0.2° | 0.4° |
| H12 | C12 | C13 | H13 | 0.2° | 0.1° |
| H26 | C26 | C27 | H27 | 0.0° | 0.3° |
| H18 | C18 | C19 | H19 | 0.0° | 0.3° |
| H18 | C18 | C17 | H17 | 0.1° | 0.3° |
| H242 | C24 | H241 | H243 | 120.0° | 120.1° |
| H'1 | C | H'2 | H'3 | 120.0° | 120.0° |
