A1IEW
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C22 | C21 | sing | 1.53Å | 1.52Å | |
C21 | C23 | sing | 1.54Å | 1.55Å | |
C21 | C20 | sing | 1.54Å | 1.55Å | |
C23 | C19 | sing | 1.54Å | 1.55Å | |
C20 | C19 | sing | 1.54Å | 1.56Å | |
C16 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
C16 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
C15 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
C19 | C17 | sing | 1.51Å | 1.53Å | |
C19 | C24 | sing | 1.51Å | 1.52Å | |
C17 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
C14 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
C | C1 | sing | 1.53Å | 1.53Å | |
C18 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
C13 | N2 | sing | 1.40Å | 1.42Å | |
C24 | N6 | sing | 1.36Å | 1.39Å | Aromatic |
C24 | N4 | doub | 1.31Å | 1.31Å | Aromatic |
C26 | N6 | sing | 1.46Å | 1.46Å | |
O | C8 | doub | 1.22Å | 1.21Å | |
N6 | C25 | sing | 1.35Å | 1.35Å | Aromatic |
N2 | C8 | sing | 1.35Å | 1.37Å | |
N2 | N3 | sing | 1.40Å | 1.39Å | |
N4 | N5 | sing | 1.29Å | 1.39Å | Aromatic |
C1 | C2 | sing | 1.53Å | 1.52Å | |
C1 | C27 | sing | 1.53Å | 1.55Å | |
C8 | N1 | sing | 1.35Å | 1.38Å | |
C2 | C3 | sing | 1.53Å | 1.53Å | |
N3 | C9 | doub | 1.31Å | 1.33Å | |
C27 | N | sing | 1.47Å | 1.48Å | |
N1 | C9 | sing | 1.38Å | 1.38Å | |
N1 | C7 | sing | 1.38Å | 1.38Å | |
C25 | N5 | doub | 1.31Å | 1.30Å | Aromatic |
F2 | C12 | sing | 1.40Å | 1.32Å | |
C9 | C10 | sing | 1.42Å | 1.43Å | |
C7 | C6 | doub | 1.34Å | 1.35Å | |
C3 | C4 | sing | 1.53Å | 1.52Å | |
C10 | C12 | sing | 1.51Å | 1.47Å | |
C10 | C11 | doub | 1.36Å | 1.35Å | |
N | C4 | sing | 1.47Å | 1.47Å | |
N | C5 | sing | 1.47Å | 1.47Å | |
C12 | F | sing | 1.40Å | 1.32Å | |
C12 | F1 | sing | 1.40Å | 1.32Å | |
C6 | C11 | sing | 1.41Å | 1.43Å | |
C6 | C5 | sing | 1.51Å | 1.51Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H3 | sing | 1.09Å | 1.10Å | |
C3 | H4 | sing | 1.09Å | 1.10Å | |
C3 | H5 | sing | 1.09Å | 1.10Å | |
C7 | H6 | sing | 1.08Å | 1.08Å | |
C11 | H7 | sing | 1.08Å | 1.08Å | |
C14 | H8 | sing | 1.08Å | 1.08Å | |
C15 | H9 | sing | 1.08Å | 1.08Å | |
C16 | H10 | sing | 1.08Å | 1.08Å | |
C20 | H11 | sing | 1.09Å | 1.10Å | |
C20 | H12 | sing | 1.09Å | 1.10Å | |
C21 | H13 | sing | 1.09Å | 1.10Å | |
C22 | H14 | sing | 1.09Å | 1.10Å | |
C22 | H15 | sing | 1.09Å | 1.10Å | |
C22 | H16 | sing | 1.09Å | 1.10Å | |
C27 | H17 | sing | 1.09Å | 1.10Å | |
C27 | H18 | sing | 1.09Å | 1.10Å | |
C5 | H19 | sing | 1.09Å | 1.10Å | |
C5 | H20 | sing | 1.09Å | 1.10Å | |
C4 | H22 | sing | 1.09Å | 1.10Å | |
C4 | H23 | sing | 1.09Å | 1.10Å | |
C | H24 | sing | 1.09Å | 1.10Å | |
C | H25 | sing | 1.09Å | 1.10Å | |
C | H26 | sing | 1.09Å | 1.10Å | |
C18 | H28 | sing | 1.08Å | 1.08Å | |
C23 | H29 | sing | 1.09Å | 1.10Å | |
C23 | H30 | sing | 1.09Å | 1.10Å | |
C26 | H31 | sing | 1.09Å | 1.10Å | |
C26 | H32 | sing | 1.09Å | 1.10Å | |
C26 | H33 | sing | 1.09Å | 1.10Å | |
C25 | H34 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C22 | C21 | C23 | 118.1° | 113.6° |
C22 | C21 | C20 | 117.0° | 113.6° |
C22 | C21 | H13 | 110.9° | 112.9° |
C21 | C22 | H14 | 109.5° | 109.5° |
C21 | C22 | H15 | 109.4° | 109.5° |
C21 | C22 | H16 | 109.5° | 109.5° |
C23 | C21 | C20 | 88.1° | 87.0° |
C21 | C23 | C19 | 86.4° | 87.0° |
C23 | C21 | H13 | 110.4° | 113.6° |
C21 | C23 | H29 | 114.9° | 113.6° |
C21 | C23 | H30 | 114.9° | 113.6° |
C21 | C20 | C19 | 86.2° | 87.1° |
C21 | C20 | H11 | 114.9° | 113.6° |
C21 | C20 | H12 | 114.9° | 113.7° |
C20 | C21 | H13 | 110.4° | 113.7° |
C23 | C19 | C20 | 87.9° | 87.1° |
C23 | C19 | C17 | 119.7° | 113.6° |
C23 | C19 | C24 | 116.5° | 113.6° |
C19 | C23 | H29 | 114.9° | 113.6° |
C19 | C23 | H30 | 114.9° | 113.7° |
C20 | C19 | C17 | 113.6° | 113.6° |
C20 | C19 | C24 | 112.3° | 113.6° |
C19 | C20 | H11 | 114.9° | 113.6° |
C19 | C20 | H12 | 114.9° | 113.6° |
C15 | C16 | C17 | 120.7° | 120.2° |
C16 | C15 | C14 | 120.2° | 120.0° |
C16 | C15 | H9 | 119.9° | 120.0° |
C15 | C16 | H10 | 119.7° | 119.9° |
C16 | C17 | C19 | 121.7° | 120.0° |
C16 | C17 | C18 | 119.1° | 120.0° |
C17 | C16 | H10 | 119.6° | 119.9° |
C15 | C14 | C13 | 119.3° | 120.0° |
C15 | C14 | H8 | 120.3° | 120.0° |
C14 | C15 | H9 | 119.9° | 120.0° |
C17 | C19 | C24 | 106.2° | 112.8° |
C19 | C17 | C18 | 119.2° | 120.0° |
C19 | C24 | N6 | 125.0° | 126.4° |
C19 | C24 | N4 | 127.2° | 126.4° |
C17 | C18 | C13 | 120.1° | 120.0° |
C17 | C18 | H28 | 120.0° | 120.0° |
C14 | C13 | C18 | 120.6° | 119.8° |
C14 | C13 | N2 | 120.3° | 120.1° |
C13 | C14 | H8 | 120.4° | 120.0° |
C | C1 | C2 | 111.9° | 109.5° |
C | C1 | C27 | 111.5° | 109.5° |
C | C1 | H1 | 108.2° | 109.5° |
C1 | C | H24 | 109.5° | 109.5° |
C1 | C | H25 | 109.5° | 109.5° |
C1 | C | H26 | 109.5° | 109.5° |
C18 | C13 | N2 | 119.1° | 120.1° |
C13 | C18 | H28 | 119.9° | 120.0° |
C13 | N2 | C8 | 127.5° | 126.2° |
C13 | N2 | N3 | 120.2° | 126.2° |
N6 | C24 | N4 | 107.8° | 107.3° |
C24 | N6 | C26 | 127.3° | 127.0° |
C24 | N6 | C25 | 106.6° | 106.1° |
C24 | N4 | N5 | 107.8° | 109.7° |
C26 | N6 | C25 | 126.0° | 127.0° |
N6 | C26 | H31 | 109.5° | 109.5° |
N6 | C26 | H32 | 109.5° | 109.5° |
N6 | C26 | H33 | 109.4° | 109.5° |
O | C8 | N2 | 129.1° | 126.1° |
O | C8 | N1 | 127.2° | 126.0° |
N6 | C25 | N5 | 109.7° | 107.3° |
N6 | C25 | H34 | 125.2° | 126.4° |
C8 | N2 | N3 | 112.2° | 107.6° |
N2 | C8 | N1 | 103.8° | 107.9° |
N2 | N3 | C9 | 104.7° | 107.9° |
N4 | N5 | C25 | 108.1° | 109.6° |
C2 | C1 | C27 | 109.0° | 109.3° |
C1 | C2 | C3 | 111.8° | 109.2° |
C2 | C1 | H1 | 108.2° | 109.5° |
C1 | C2 | H2 | 108.9° | 109.5° |
C1 | C2 | H3 | 108.9° | 109.5° |
C1 | C27 | N | 112.8° | 109.5° |
C27 | C1 | H1 | 107.9° | 109.5° |
C1 | C27 | H17 | 108.6° | 109.4° |
C1 | C27 | H18 | 108.6° | 109.4° |
C8 | N1 | C9 | 108.9° | 108.3° |
C8 | N1 | C7 | 128.4° | 131.8° |
C2 | C3 | C4 | 110.5° | 109.3° |
C3 | C2 | H2 | 108.9° | 109.5° |
C3 | C2 | H3 | 108.9° | 109.5° |
C2 | C3 | H4 | 109.2° | 109.5° |
C2 | C3 | H5 | 109.2° | 109.5° |
N3 | C9 | N1 | 110.3° | 108.4° |
N3 | C9 | C10 | 131.3° | 132.0° |
C27 | N | C4 | 110.6° | 111.2° |
C27 | N | C5 | 115.0° | 111.0° |
N | C27 | H17 | 108.6° | 109.5° |
N | C27 | H18 | 108.6° | 109.5° |
C9 | N1 | C7 | 122.7° | 119.9° |
N1 | C9 | C10 | 118.4° | 119.6° |
N1 | C7 | C6 | 120.0° | 120.7° |
N1 | C7 | H6 | 120.0° | 119.6° |
N5 | C25 | H34 | 125.2° | 126.3° |
F2 | C12 | C10 | 112.2° | 109.5° |
F2 | C12 | F | 105.9° | 109.5° |
F2 | C12 | F1 | 106.8° | 109.5° |
C9 | C10 | C12 | 119.4° | 120.4° |
C9 | C10 | C11 | 117.6° | 119.3° |
C7 | C6 | C11 | 118.2° | 120.5° |
C7 | C6 | C5 | 121.8° | 119.7° |
C6 | C7 | H6 | 120.0° | 119.7° |
C3 | C4 | N | 111.8° | 109.5° |
C4 | C3 | H4 | 109.2° | 109.5° |
C4 | C3 | H5 | 109.2° | 109.5° |
C3 | C4 | H22 | 108.9° | 109.5° |
C3 | C4 | H23 | 108.9° | 109.5° |
C12 | C10 | C11 | 123.0° | 120.3° |
C10 | C12 | F | 112.6° | 109.5° |
C10 | C12 | F1 | 112.0° | 109.5° |
C10 | C11 | C6 | 123.2° | 119.9° |
C10 | C11 | H7 | 118.4° | 120.1° |
C4 | N | C5 | 111.3° | 111.0° |
N | C4 | H22 | 108.9° | 109.4° |
N | C4 | H23 | 108.8° | 109.4° |
N | C5 | C6 | 113.7° | 109.4° |
N | C5 | H19 | 108.4° | 109.5° |
N | C5 | H20 | 108.4° | 109.5° |
F | C12 | F1 | 107.0° | 109.5° |
C11 | C6 | C5 | 120.1° | 119.7° |
C6 | C11 | H7 | 118.4° | 120.1° |
C6 | C5 | H19 | 108.4° | 109.5° |
C6 | C5 | H20 | 108.4° | 109.5° |
H2 | C2 | H3 | 109.5° | 109.6° |
H4 | C3 | H5 | 109.5° | 109.5° |
H11 | C20 | H12 | 109.5° | 112.9° |
H14 | C22 | H15 | 109.5° | 109.4° |
H14 | C22 | H16 | 109.5° | 109.5° |
H15 | C22 | H16 | 109.5° | 109.5° |
H17 | C27 | H18 | 109.5° | 109.5° |
H19 | C5 | H20 | 109.5° | 109.5° |
H22 | C4 | H23 | 109.5° | 109.5° |
H24 | C | H25 | 109.5° | 109.4° |
H24 | C | H26 | 109.4° | 109.5° |
H25 | C | H26 | 109.5° | 109.5° |
H29 | C23 | H30 | 109.5° | 112.9° |
H31 | C26 | H32 | 109.5° | 109.4° |
H31 | C26 | H33 | 109.5° | 109.4° |
H32 | C26 | H33 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C22 | C21 | C23 | C20 | 119.8° | 114.5° |
C22 | C21 | C23 | H13 | 129.1° | 130.9° |
C22 | C21 | C20 | H13 | 128.1° | 131.0° |
C22 | C21 | C23 | C19 | 145.2° | 140.0° |
C22 | C21 | C20 | C19 | 146.1° | 140.0° |
C22 | C21 | C20 | H11 | 30.3° | 105.5° |
C22 | C21 | C20 | H12 | 98.2° | 25.3° |
C21 | C22 | H14 | H15 | 120.0° | 120.0° |
C21 | C22 | H14 | H16 | 120.0° | 120.1° |
C21 | C22 | H15 | H16 | 120.0° | 120.0° |
C22 | C21 | C23 | H29 | 99.0° | 25.5° |
C22 | C21 | C23 | H30 | 29.4° | 105.4° |
C23 | C21 | C20 | H13 | 111.1° | 114.5° |
C21 | C23 | C19 | H29 | 115.8° | 114.5° |
C21 | C23 | C19 | H30 | 115.8° | 114.5° |
C23 | C21 | C20 | C19 | 25.2° | 25.4° |
C21 | C23 | C19 | C17 | 90.8° | 89.2° |
C21 | C23 | C19 | C24 | 139.1° | 140.0° |
C23 | C21 | C20 | H11 | 90.5° | 139.9° |
C23 | C21 | C20 | H12 | 141.0° | 89.2° |
C23 | C21 | C22 | H14 | 180.0° | 60.0° |
C23 | C21 | C22 | H15 | 60.0° | 180.0° |
C23 | C21 | C22 | H16 | 60.0° | 60.0° |
C21 | C23 | H29 | H30 | 131.0° | 131.3° |
C21 | C20 | C19 | H11 | 115.8° | 114.5° |
C21 | C20 | C19 | H12 | 115.8° | 114.7° |
C21 | C20 | C19 | C17 | 96.4° | 89.1° |
C21 | C20 | C19 | C24 | 143.1° | 140.1° |
C21 | C20 | H11 | H12 | 131.1° | 131.3° |
C20 | C21 | C22 | H14 | 76.7° | 157.5° |
C20 | C21 | C22 | H15 | 43.2° | 82.6° |
C20 | C21 | C22 | H16 | 163.3° | 37.4° |
C20 | C21 | C23 | H29 | 141.2° | 89.1° |
C20 | C21 | C23 | H30 | 90.5° | 140.0° |
C23 | C19 | C20 | C17 | 121.7° | 114.6° |
C23 | C19 | C20 | C24 | 117.8° | 114.6° |
C23 | C19 | C17 | C16 | 16.8° | 17.5° |
C23 | C19 | C17 | C24 | 134.5° | 131.2° |
C23 | C19 | C17 | C18 | 163.5° | 162.7° |
C23 | C19 | C24 | N6 | 65.7° | 66.1° |
C23 | C19 | C24 | N4 | 114.6° | 113.9° |
C23 | C19 | C20 | H11 | 90.5° | 140.0° |
C23 | C19 | C20 | H12 | 141.1° | 89.2° |
C19 | C23 | C21 | H13 | 85.7° | 89.1° |
C19 | C23 | H29 | H30 | 131.1° | 131.3° |
C20 | C19 | C17 | C16 | 118.5° | 115.1° |
C20 | C19 | C17 | C24 | 123.9° | 131.2° |
C20 | C19 | C17 | C18 | 61.8° | 65.1° |
C20 | C19 | C24 | N6 | 164.9° | 163.6° |
C20 | C19 | C24 | N4 | 15.4° | 16.3° |
C19 | C20 | H11 | H12 | 131.1° | 131.2° |
C19 | C20 | C21 | H13 | 85.8° | 89.1° |
C20 | C19 | C23 | H29 | 141.1° | 89.1° |
C20 | C19 | C23 | H30 | 90.5° | 140.0° |
C15 | C16 | C17 | H10 | 180.0° | 180.0° |
C16 | C15 | C14 | H9 | 180.0° | 179.9° |
C15 | C16 | C17 | C19 | 179.8° | 180.0° |
C15 | C16 | C17 | C18 | 0.1° | 0.3° |
C16 | C15 | C14 | C13 | 0.9° | 0.0° |
C16 | C15 | C14 | H8 | 179.1° | 180.0° |
C17 | C16 | C15 | C14 | 0.1° | 0.0° |
C16 | C17 | C19 | C18 | 179.7° | 179.8° |
C16 | C17 | C19 | C24 | 117.7° | 113.7° |
C16 | C17 | C18 | C13 | 0.6° | 0.5° |
C17 | C16 | C15 | H9 | 179.9° | 180.0° |
C16 | C17 | C18 | H28 | 179.4° | 179.8° |
C15 | C14 | C13 | H8 | 180.0° | 180.0° |
C15 | C14 | C13 | C18 | 1.6° | 0.3° |
C15 | C14 | C13 | N2 | 179.1° | 179.9° |
C14 | C15 | C16 | H10 | 179.9° | 179.9° |
C19 | C17 | C18 | C13 | 179.2° | 179.7° |
C17 | C19 | C24 | N6 | 70.5° | 65.1° |
C17 | C19 | C24 | N4 | 109.3° | 114.9° |
C19 | C17 | C16 | H10 | 0.2° | 0.1° |
C17 | C19 | C20 | H11 | 147.8° | 25.4° |
C17 | C19 | C20 | H12 | 19.4° | 156.2° |
C19 | C17 | C18 | H28 | 0.9° | 0.0° |
C17 | C19 | C23 | H29 | 25.0° | 156.3° |
C17 | C19 | C23 | H30 | 153.4° | 25.4° |
C24 | C19 | C17 | C18 | 62.1° | 66.1° |
C19 | C24 | N6 | N4 | 179.8° | 180.0° |
C19 | C24 | N6 | C26 | 0.0° | 0.2° |
C19 | C24 | N6 | C25 | 179.8° | 180.0° |
C19 | C24 | N4 | N5 | 179.8° | 180.0° |
C24 | C19 | C20 | H11 | 27.3° | 105.4° |
C24 | C19 | C20 | H12 | 101.1° | 25.4° |
C24 | C19 | C23 | H29 | 105.0° | 25.5° |
C24 | C19 | C23 | H30 | 23.3° | 105.4° |
C17 | C18 | C13 | C14 | 1.4° | 0.5° |
C17 | C18 | C13 | H28 | 180.0° | 179.7° |
C17 | C18 | C13 | N2 | 179.0° | 179.7° |
C18 | C17 | C16 | H10 | 179.9° | 179.7° |
C14 | C13 | C18 | N2 | 177.6° | 179.8° |
C14 | C13 | N2 | C8 | 149.3° | 0.0° |
C14 | C13 | N2 | N3 | 27.6° | 179.8° |
C13 | C14 | C15 | H9 | 179.1° | 180.0° |
C14 | C13 | C18 | H28 | 178.6° | 179.8° |
C | C1 | C2 | C27 | 123.8° | 120.0° |
C | C1 | C2 | H1 | 119.1° | 120.1° |
C | C1 | C27 | H1 | 118.7° | 120.1° |
C | C1 | C2 | C3 | 177.0° | 177.6° |
C | C1 | C27 | N | 179.3° | 179.1° |
C | C1 | C2 | H2 | 62.7° | 62.5° |
C | C1 | C2 | H3 | 56.6° | 57.7° |
C | C1 | C27 | H17 | 58.9° | 59.1° |
C | C1 | C27 | H18 | 60.2° | 60.8° |
C1 | C | H24 | H25 | 120.0° | 120.0° |
C1 | C | H24 | H26 | 120.0° | 120.0° |
C1 | C | H25 | H26 | 120.0° | 120.0° |
C18 | C13 | N2 | C8 | 28.3° | 179.8° |
C18 | C13 | N2 | N3 | 154.8° | 0.0° |
C18 | C13 | C14 | H8 | 178.5° | 179.7° |
C13 | N2 | C8 | O | 2.5° | 0.1° |
C13 | N2 | C8 | N3 | 177.1° | 179.8° |
C13 | N2 | C8 | N1 | 178.2° | 180.0° |
C13 | N2 | N3 | C9 | 178.3° | 179.9° |
N2 | C13 | C14 | H8 | 0.9° | 0.1° |
N2 | C13 | C18 | H28 | 1.0° | 0.0° |
C24 | N6 | C26 | C25 | 179.7° | 179.7° |
N6 | C24 | N4 | N5 | 0.0° | 0.0° |
C24 | N6 | C25 | N5 | 0.0° | 0.0° |
C24 | N6 | C26 | H31 | 180.0° | 95.1° |
C24 | N6 | C26 | H32 | 60.0° | 24.9° |
C24 | N6 | C26 | H33 | 60.0° | 144.9° |
C24 | N6 | C25 | H34 | 180.0° | 179.9° |
N4 | C24 | N6 | C26 | 179.7° | 179.7° |
N4 | C24 | N6 | C25 | 0.0° | 0.0° |
C24 | N4 | N5 | C25 | 0.0° | 0.0° |
C26 | N6 | C25 | N5 | 179.8° | 179.7° |
N6 | C26 | H31 | H32 | 120.0° | 120.0° |
N6 | C26 | H31 | H33 | 120.0° | 120.0° |
N6 | C26 | H32 | H33 | 120.0° | 120.0° |
C26 | N6 | C25 | H34 | 0.3° | 0.3° |
O | C8 | N2 | N1 | 179.3° | 179.9° |
O | C8 | N2 | N3 | 179.6° | 179.8° |
O | C8 | N1 | C9 | 179.9° | 179.9° |
O | C8 | N1 | C7 | 0.4° | 0.0° |
N6 | C25 | N5 | N4 | 0.0° | 0.0° |
N6 | C25 | N5 | H34 | 180.0° | 180.0° |
C25 | N6 | C26 | H31 | 0.3° | 85.1° |
C25 | N6 | C26 | H32 | 119.7° | 154.9° |
C25 | N6 | C26 | H33 | 120.3° | 34.8° |
C8 | N2 | N3 | C9 | 1.0° | 0.3° |
N2 | C8 | N1 | C9 | 0.8° | 0.0° |
N2 | C8 | N1 | C7 | 179.6° | 179.9° |
N3 | N2 | C8 | N1 | 1.1° | 0.2° |
N2 | N3 | C9 | N1 | 0.4° | 0.3° |
N2 | N3 | C9 | C10 | 179.4° | 179.9° |
N4 | N5 | C25 | H34 | 180.0° | 180.0° |
C2 | C1 | C27 | H1 | 117.3° | 119.9° |
C1 | C2 | C3 | H2 | 120.3° | 119.9° |
C1 | C2 | C3 | H3 | 120.4° | 119.9° |
C2 | C1 | C27 | N | 55.3° | 59.2° |
C1 | C2 | C3 | C4 | 54.5° | 57.6° |
C1 | C2 | H2 | H3 | 119.0° | 120.1° |
C1 | C2 | C3 | H4 | 65.7° | 62.3° |
C1 | C2 | C3 | H5 | 174.6° | 177.6° |
C2 | C1 | C27 | H17 | 65.2° | 60.9° |
C2 | C1 | C27 | H18 | 175.8° | 179.2° |
C2 | C1 | C | H24 | 180.0° | 60.0° |
C2 | C1 | C | H25 | 60.0° | 179.9° |
C2 | C1 | C | H26 | 60.0° | 60.0° |
C27 | C1 | C2 | C3 | 53.2° | 57.6° |
C1 | C27 | N | H17 | 120.5° | 120.0° |
C1 | C27 | N | H18 | 120.5° | 120.0° |
C1 | C27 | N | C4 | 57.9° | 61.7° |
C1 | C27 | N | C5 | 174.9° | 174.2° |
C27 | C1 | C2 | H2 | 173.5° | 177.5° |
C27 | C1 | C2 | H3 | 67.2° | 62.3° |
C1 | C27 | H17 | H18 | 118.5° | 119.9° |
C27 | C1 | C | H24 | 57.7° | 179.8° |
C27 | C1 | C | H25 | 62.4° | 60.2° |
C27 | C1 | C | H26 | 177.6° | 59.8° |
C8 | N1 | C9 | N3 | 0.3° | 0.2° |
C8 | N1 | C9 | C7 | 179.6° | 179.9° |
C8 | N1 | C9 | C10 | 179.9° | 179.9° |
C8 | N1 | C7 | C6 | 179.6° | 180.0° |
C8 | N1 | C7 | H6 | 0.4° | 0.2° |
C2 | C3 | C4 | H4 | 120.1° | 119.9° |
C2 | C3 | C4 | H5 | 120.1° | 119.9° |
C2 | C3 | C4 | N | 56.2° | 59.2° |
C3 | C2 | C1 | H1 | 64.0° | 62.3° |
C3 | C2 | H2 | H3 | 118.9° | 120.2° |
C2 | C3 | H4 | H5 | 119.6° | 120.1° |
C2 | C3 | C4 | H22 | 176.6° | 179.2° |
C2 | C3 | C4 | H23 | 64.1° | 60.8° |
N3 | C9 | N1 | C10 | 179.9° | 179.9° |
N3 | C9 | N1 | C7 | 179.8° | 179.8° |
N3 | C9 | C10 | C12 | 0.3° | 0.2° |
N3 | C9 | C10 | C11 | 180.0° | 179.9° |
C27 | N | C4 | C3 | 57.9° | 61.7° |
C27 | N | C4 | C5 | 129.2° | 124.1° |
C27 | N | C5 | C6 | 49.6° | 170.0° |
N | C27 | C1 | H1 | 62.0° | 60.8° |
N | C27 | H17 | H18 | 118.5° | 120.0° |
C27 | N | C5 | H19 | 71.0° | 50.0° |
C27 | N | C5 | H20 | 170.2° | 70.0° |
C27 | N | C4 | H22 | 178.2° | 178.2° |
C27 | N | C4 | H23 | 62.5° | 58.3° |
C9 | N1 | C7 | C6 | 0.1° | 0.1° |
N1 | C9 | C10 | C12 | 179.9° | 180.0° |
N1 | C9 | C10 | C11 | 0.2° | 0.2° |
C9 | N1 | C7 | H6 | 179.9° | 179.7° |
C7 | N1 | C9 | C10 | 0.3° | 0.1° |
N1 | C7 | C6 | H6 | 180.0° | 179.8° |
N1 | C7 | C6 | C11 | 0.2° | 0.3° |
N1 | C7 | C6 | C5 | 179.7° | 179.8° |
F2 | C12 | C10 | C9 | 62.5° | 60.0° |
F2 | C12 | C10 | F | 119.4° | 120.0° |
F2 | C12 | C10 | F1 | 120.0° | 120.0° |
F2 | C12 | C10 | C11 | 117.2° | 119.7° |
F2 | C12 | F | F1 | 113.6° | 120.0° |
C9 | C10 | C12 | C11 | 179.7° | 179.7° |
C9 | C10 | C12 | F | 56.8° | 180.0° |
C9 | C10 | C12 | F1 | 177.4° | 60.0° |
C9 | C10 | C11 | C6 | 0.1° | 0.6° |
C9 | C10 | C11 | H7 | 179.9° | 180.0° |
C7 | C6 | C11 | C10 | 0.3° | 0.6° |
C7 | C6 | C5 | N | 93.4° | 95.0° |
C7 | C6 | C11 | C5 | 179.9° | 179.9° |
C7 | C6 | C11 | H7 | 179.7° | 180.0° |
C7 | C6 | C5 | H19 | 27.2° | 145.0° |
C7 | C6 | C5 | H20 | 145.9° | 25.0° |
C3 | C4 | N | H22 | 120.3° | 120.0° |
C3 | C4 | N | H23 | 120.4° | 120.0° |
C3 | C4 | N | C5 | 173.0° | 174.2° |
C4 | C3 | C2 | H2 | 174.8° | 177.5° |
C4 | C3 | C2 | H3 | 65.9° | 62.3° |
C4 | C3 | H4 | H5 | 119.5° | 120.1° |
C3 | C4 | H22 | H23 | 118.9° | 120.0° |
C10 | C12 | F | F1 | 123.4° | 120.0° |
C12 | C10 | C11 | C6 | 179.6° | 179.7° |
C12 | C10 | C11 | H7 | 0.4° | 0.3° |
C11 | C10 | C12 | F | 123.5° | 0.3° |
C11 | C10 | C12 | F1 | 2.9° | 120.3° |
C10 | C11 | C6 | H7 | 180.0° | 179.4° |
C10 | C11 | C6 | C5 | 179.6° | 179.4° |
C4 | N | C5 | C6 | 77.2° | 65.8° |
N | C4 | C3 | H4 | 63.9° | 60.8° |
N | C4 | C3 | H5 | 176.4° | 179.1° |
C4 | N | C27 | H17 | 62.6° | 58.3° |
C4 | N | C27 | H18 | 178.4° | 178.3° |
C4 | N | C5 | H19 | 162.1° | 174.2° |
C4 | N | C5 | H20 | 43.4° | 54.2° |
N | C4 | H22 | H23 | 118.9° | 119.9° |
N | C5 | C6 | C11 | 86.5° | 85.1° |
N | C5 | C6 | H19 | 120.6° | 120.0° |
N | C5 | C6 | H20 | 120.6° | 120.0° |
C5 | N | C27 | H17 | 64.6° | 65.8° |
C5 | N | C27 | H18 | 54.4° | 54.2° |
N | C5 | H19 | H20 | 118.1° | 120.0° |
C5 | N | C4 | H22 | 52.6° | 54.2° |
C5 | N | C4 | H23 | 66.7° | 65.8° |
C11 | C6 | C7 | H6 | 179.8° | 179.9° |
C11 | C6 | C5 | H19 | 152.9° | 34.9° |
C11 | C6 | C5 | H20 | 34.2° | 154.9° |
C5 | C6 | C7 | H6 | 0.3° | 0.0° |
C5 | C6 | C11 | H7 | 0.4° | 0.1° |
C6 | C5 | H19 | H20 | 118.0° | 120.0° |
H1 | C1 | C2 | H2 | 56.4° | 57.6° |
H1 | C1 | C2 | H3 | 175.7° | 177.8° |
H1 | C1 | C27 | H17 | 177.5° | 179.2° |
H1 | C1 | C27 | H18 | 58.5° | 59.3° |
H1 | C1 | C | H24 | 60.9° | 60.1° |
H1 | C1 | C | H25 | 179.1° | 59.9° |
H1 | C1 | C | H26 | 59.1° | 179.9° |
H2 | C2 | C3 | H4 | 54.7° | 57.6° |
H2 | C2 | C3 | H5 | 65.1° | 62.5° |
H3 | C2 | C3 | H4 | 174.0° | 177.8° |
H3 | C2 | C3 | H5 | 54.3° | 57.7° |
H4 | C3 | C4 | H22 | 56.4° | 59.3° |
H4 | C3 | C4 | H23 | 175.7° | 179.2° |
H5 | C3 | C4 | H22 | 63.3° | 60.9° |
H5 | C3 | C4 | H23 | 56.0° | 59.1° |
H8 | C14 | C15 | H9 | 0.9° | 0.0° |
H9 | C15 | C16 | H10 | 0.1° | 0.0° |
H11 | C20 | C21 | H13 | 158.4° | 25.4° |
H12 | C20 | C21 | H13 | 30.0° | 156.3° |
H13 | C21 | C22 | H14 | 51.2° | 71.2° |
H13 | C21 | C22 | H15 | 171.2° | 48.8° |
H13 | C21 | C22 | H16 | 68.8° | 168.8° |
H13 | C21 | C23 | H29 | 30.1° | 156.3° |
H13 | C21 | C23 | H30 | 158.4° | 25.4° |
H14 | C22 | H15 | H16 | 120.0° | 120.0° |
H24 | C | H25 | H26 | 120.0° | 120.0° |
H31 | C26 | H32 | H33 | 120.0° | 119.9° |