WCP
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1 | C8 | doub | 1.22Å | 1.23Å | |
C8 | C7 | sing | 1.41Å | 1.45Å | |
C8 | N1 | sing | 1.35Å | 1.42Å | |
C7 | C6 | doub | 1.36Å | 1.34Å | |
C24 | C23 | doub | 1.39Å | 1.38Å | Aromatic |
C24 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
C23 | C22 | sing | 1.39Å | 1.39Å | Aromatic |
C17 | C18 | sing | 1.51Å | 1.50Å | |
C17 | N3 | sing | 1.47Å | 1.53Å | |
C18 | N4 | doub | 1.32Å | 1.35Å | Aromatic |
C15 | C16 | sing | 1.53Å | 1.53Å | |
C15 | C14 | sing | 1.53Å | 1.57Å | |
N1 | C10 | sing | 1.47Å | 1.46Å | |
N1 | C1 | sing | 1.36Å | 1.40Å | |
C6 | C5 | sing | 1.47Å | 1.47Å | |
C10 | C9 | sing | 1.54Å | 1.63Å | |
N3 | C14 | sing | 1.47Å | 1.54Å | |
C16 | C12 | sing | 1.53Å | 1.53Å | |
C22 | O4 | sing | 1.36Å | 1.37Å | |
C22 | C19 | doub | 1.40Å | 1.44Å | Aromatic |
O4 | C21 | sing | 1.43Å | 1.44Å | |
N4 | C19 | sing | 1.32Å | 1.34Å | Aromatic |
C14 | C25 | sing | 1.53Å | 1.56Å | |
C14 | C13 | sing | 1.53Å | 1.61Å | |
C1 | C5 | doub | 1.40Å | 1.41Å | Aromatic |
C1 | C2 | sing | 1.38Å | 1.43Å | Aromatic |
C19 | N5 | sing | 1.40Å | 1.38Å | |
C5 | N2 | sing | 1.33Å | 1.35Å | Aromatic |
C25 | C26 | sing | 1.53Å | 1.53Å | |
C21 | C20 | sing | 1.51Å | 1.57Å | |
C9 | O5 | sing | 1.43Å | 1.43Å | |
C9 | C2 | sing | 1.51Å | 1.51Å | |
C9 | C11 | sing | 1.53Å | 1.59Å | |
C12 | C26 | sing | 1.53Å | 1.52Å | |
C12 | C11 | sing | 1.53Å | 1.61Å | |
C12 | O2 | sing | 1.43Å | 1.47Å | |
C13 | O2 | sing | 1.43Å | 1.45Å | |
N5 | C20 | sing | 1.35Å | 1.35Å | |
C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
C20 | O3 | doub | 1.21Å | 1.23Å | |
N2 | C4 | doub | 1.32Å | 1.34Å | Aromatic |
C3 | C4 | sing | 1.40Å | 1.44Å | Aromatic |
C3 | F | sing | 1.35Å | 1.36Å | |
C4 | H1 | sing | 1.08Å | 1.08Å | |
C6 | H2 | sing | 1.08Å | 1.08Å | |
C7 | H3 | sing | 1.08Å | 1.08Å | |
C11 | H4 | sing | 1.09Å | 1.10Å | |
C11 | H5 | sing | 1.09Å | 1.10Å | |
C15 | H6 | sing | 1.09Å | 1.10Å | |
C15 | H7 | sing | 1.09Å | 1.10Å | |
C21 | H8 | sing | 1.09Å | 1.10Å | |
C21 | H9 | sing | 1.09Å | 1.10Å | |
N5 | H10 | sing | 0.97Å | 1.00Å | |
C23 | H11 | sing | 1.08Å | 1.08Å | |
C24 | H12 | sing | 1.08Å | 1.08Å | |
C17 | H13 | sing | 1.09Å | 1.10Å | |
C17 | H14 | sing | 1.09Å | 1.10Å | |
N3 | H15 | sing | 1.01Å | 1.00Å | |
C13 | H17 | sing | 1.09Å | 1.10Å | |
C13 | H18 | sing | 1.09Å | 1.10Å | |
C16 | H19 | sing | 1.09Å | 1.10Å | |
C16 | H20 | sing | 1.09Å | 1.10Å | |
C25 | H21 | sing | 1.09Å | 1.10Å | |
C25 | H22 | sing | 1.09Å | 1.10Å | |
C26 | H23 | sing | 1.09Å | 1.10Å | |
C26 | H24 | sing | 1.09Å | 1.10Å | |
O5 | H25 | sing | 0.97Å | 0.95Å | |
C10 | H26 | sing | 1.09Å | 1.10Å | |
C10 | H27 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | C8 | C7 | 125.6° | 119.4° |
O1 | C8 | N1 | 117.9° | 119.4° |
C7 | C8 | N1 | 116.5° | 121.1° |
C8 | C7 | C6 | 123.1° | 121.6° |
C8 | C7 | H3 | 118.5° | 119.2° |
C8 | N1 | C10 | 129.9° | 132.9° |
C8 | N1 | C1 | 120.9° | 118.8° |
C7 | C6 | C5 | 120.8° | 117.7° |
C7 | C6 | H2 | 119.6° | 121.2° |
C6 | C7 | H3 | 118.5° | 119.2° |
C23 | C24 | C18 | 119.0° | 119.4° |
C24 | C23 | C22 | 119.5° | 118.3° |
C24 | C23 | H11 | 120.2° | 120.9° |
C23 | C24 | H12 | 120.5° | 120.3° |
C24 | C18 | C17 | 121.5° | 119.5° |
C24 | C18 | N4 | 122.6° | 121.0° |
C18 | C24 | H12 | 120.5° | 120.3° |
C23 | C22 | O4 | 117.2° | 120.9° |
C23 | C22 | C19 | 118.7° | 119.3° |
C22 | C23 | H11 | 120.3° | 120.9° |
C18 | C17 | N3 | 106.1° | 109.5° |
C17 | C18 | N4 | 115.9° | 119.5° |
C18 | C17 | H13 | 110.3° | 109.5° |
C18 | C17 | H14 | 110.3° | 109.5° |
C17 | N3 | C14 | 120.6° | 111.0° |
N3 | C17 | H13 | 110.3° | 109.5° |
N3 | C17 | H14 | 110.3° | 109.4° |
C17 | N3 | H15 | 106.6° | 111.0° |
C18 | N4 | C19 | 119.5° | 121.6° |
C16 | C15 | C14 | 107.1° | 108.8° |
C15 | C16 | C12 | 112.6° | 109.0° |
C16 | C15 | H6 | 110.0° | 109.6° |
C16 | C15 | H7 | 110.1° | 109.6° |
C15 | C16 | H19 | 108.7° | 109.5° |
C15 | C16 | H20 | 108.7° | 109.5° |
C15 | C14 | N3 | 112.7° | 110.4° |
C15 | C14 | C25 | 109.4° | 108.9° |
C15 | C14 | C13 | 108.8° | 108.7° |
C14 | C15 | H6 | 110.1° | 109.6° |
C14 | C15 | H7 | 110.0° | 109.6° |
C10 | N1 | C1 | 109.2° | 108.3° |
N1 | C10 | C9 | 105.8° | 105.5° |
N1 | C10 | H26 | 110.4° | 110.2° |
N1 | C10 | H27 | 110.4° | 110.3° |
N1 | C1 | C5 | 122.6° | 123.4° |
N1 | C1 | C2 | 113.6° | 114.9° |
C6 | C5 | C1 | 116.1° | 117.3° |
C6 | C5 | N2 | 124.9° | 123.6° |
C5 | C6 | H2 | 119.6° | 121.1° |
C10 | C9 | O5 | 110.0° | 110.5° |
C10 | C9 | C2 | 102.9° | 104.4° |
C10 | C9 | C11 | 112.1° | 110.5° |
C9 | C10 | H26 | 110.4° | 110.3° |
C9 | C10 | H27 | 110.3° | 110.3° |
N3 | C14 | C25 | 102.4° | 110.0° |
N3 | C14 | C13 | 116.4° | 110.0° |
C14 | N3 | H15 | 106.7° | 111.0° |
C16 | C12 | C26 | 110.1° | 109.3° |
C16 | C12 | C11 | 111.9° | 109.6° |
C16 | C12 | O2 | 109.2° | 109.4° |
C12 | C16 | H19 | 108.7° | 109.5° |
C12 | C16 | H20 | 108.7° | 109.5° |
O4 | C22 | C19 | 124.1° | 119.8° |
C22 | O4 | C21 | 114.6° | 116.7° |
C22 | C19 | N4 | 120.7° | 120.5° |
C22 | C19 | N5 | 119.0° | 119.0° |
O4 | C21 | C20 | 116.6° | 109.5° |
O4 | C21 | H8 | 107.7° | 109.5° |
O4 | C21 | H9 | 107.6° | 109.4° |
N4 | C19 | N5 | 119.5° | 120.5° |
C25 | C14 | C13 | 106.7° | 108.8° |
C14 | C25 | C26 | 108.2° | 108.8° |
C14 | C25 | H21 | 109.8° | 109.6° |
C14 | C25 | H22 | 109.8° | 109.6° |
C14 | C13 | O2 | 108.8° | 109.3° |
C14 | C13 | H17 | 109.6° | 109.5° |
C14 | C13 | H18 | 109.7° | 109.5° |
C5 | C1 | C2 | 123.7° | 121.7° |
C1 | C5 | N2 | 118.9° | 119.1° |
C1 | C2 | C9 | 108.0° | 106.9° |
C1 | C2 | C3 | 115.7° | 117.3° |
C19 | N5 | C20 | 121.3° | 119.1° |
C19 | N5 | H10 | 119.3° | 120.5° |
C5 | N2 | C4 | 118.7° | 120.8° |
C25 | C26 | C12 | 111.9° | 109.1° |
C26 | C25 | H21 | 109.8° | 109.6° |
C26 | C25 | H22 | 109.8° | 109.6° |
C25 | C26 | H23 | 108.9° | 109.6° |
C25 | C26 | H24 | 108.9° | 109.6° |
C21 | C20 | N5 | 119.1° | 119.9° |
C21 | C20 | O3 | 119.7° | 120.1° |
C20 | C21 | H8 | 107.6° | 109.5° |
C20 | C21 | H9 | 107.7° | 109.5° |
O5 | C9 | C2 | 103.8° | 110.5° |
O5 | C9 | C11 | 105.5° | 110.4° |
C9 | O5 | H25 | 109.5° | 114.0° |
C2 | C9 | C11 | 122.1° | 110.4° |
C9 | C2 | C3 | 136.0° | 135.8° |
C9 | C11 | C12 | 116.9° | 109.5° |
C9 | C11 | H4 | 107.6° | 109.5° |
C9 | C11 | H5 | 107.6° | 109.5° |
C26 | C12 | C11 | 108.5° | 109.6° |
C26 | C12 | O2 | 106.0° | 109.2° |
C12 | C26 | H23 | 108.9° | 109.5° |
C12 | C26 | H24 | 108.9° | 109.6° |
C11 | C12 | O2 | 111.0° | 109.8° |
C12 | C11 | H4 | 107.6° | 109.5° |
C12 | C11 | H5 | 107.6° | 109.4° |
C12 | O2 | C13 | 114.6° | 114.2° |
O2 | C13 | H17 | 109.6° | 109.4° |
O2 | C13 | H18 | 109.6° | 109.5° |
N5 | C20 | O3 | 121.1° | 120.0° |
C20 | N5 | H10 | 119.3° | 120.5° |
C2 | C3 | C4 | 118.0° | 118.7° |
C2 | C3 | F | 122.4° | 120.6° |
N2 | C4 | C3 | 124.9° | 122.4° |
N2 | C4 | H1 | 117.6° | 118.8° |
C4 | C3 | F | 119.6° | 120.6° |
C3 | C4 | H1 | 117.5° | 118.8° |
H4 | C11 | H5 | 109.5° | 109.5° |
H6 | C15 | H7 | 109.5° | 109.7° |
H8 | C21 | H9 | 109.5° | 109.5° |
H13 | C17 | H14 | 109.5° | 109.5° |
H17 | C13 | H18 | 109.5° | 109.5° |
H19 | C16 | H20 | 109.5° | 109.6° |
H21 | C25 | H22 | 109.5° | 109.7° |
H23 | C26 | H24 | 109.5° | 109.5° |
H26 | C10 | H27 | 109.5° | 110.2° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | C8 | C7 | N1 | 179.8° | 180.0° |
O1 | C8 | C7 | C6 | 179.7° | 179.9° |
O1 | C8 | N1 | C10 | 0.5° | 0.1° |
O1 | C8 | N1 | C1 | 180.0° | 179.6° |
O1 | C8 | C7 | H3 | 0.3° | 0.1° |
C8 | C7 | C6 | H3 | 180.0° | 180.0° |
C7 | C8 | N1 | C10 | 179.3° | 180.0° |
C7 | C8 | N1 | C1 | 0.2° | 0.3° |
C8 | C7 | C6 | C5 | 0.1° | 0.0° |
C8 | C7 | C6 | H2 | 179.9° | 180.0° |
N1 | C8 | C7 | C6 | 0.0° | 0.0° |
C8 | N1 | C10 | C1 | 179.6° | 179.7° |
C8 | N1 | C10 | C9 | 175.9° | 180.0° |
C8 | N1 | C1 | C5 | 0.4° | 0.7° |
C8 | N1 | C1 | C2 | 179.9° | 179.7° |
N1 | C8 | C7 | H3 | 179.9° | 180.0° |
C8 | N1 | C10 | H26 | 56.4° | 61.0° |
C8 | N1 | C10 | H27 | 64.7° | 60.9° |
C7 | C6 | C5 | H2 | 180.0° | 180.0° |
C7 | C6 | C5 | C1 | 0.0° | 0.3° |
C7 | C6 | C5 | N2 | 179.3° | 180.0° |
C23 | C24 | C18 | H12 | 180.0° | 179.9° |
C24 | C23 | C22 | H11 | 180.0° | 179.9° |
C23 | C24 | C18 | C17 | 179.4° | 179.8° |
C23 | C24 | C18 | N4 | 0.6° | 0.1° |
C24 | C23 | C22 | O4 | 180.0° | 180.0° |
C24 | C23 | C22 | C19 | 0.2° | 0.0° |
C18 | C24 | C23 | C22 | 1.1° | 0.0° |
C24 | C18 | C17 | N4 | 180.0° | 179.7° |
C24 | C18 | C17 | N3 | 104.7° | 94.7° |
C24 | C18 | N4 | C19 | 1.4° | 0.1° |
C18 | C24 | C23 | H11 | 178.9° | 179.9° |
C24 | C18 | C17 | H13 | 135.8° | 145.3° |
C24 | C18 | C17 | H14 | 14.7° | 25.3° |
C23 | C22 | O4 | C19 | 179.8° | 180.0° |
C23 | C22 | O4 | C21 | 153.6° | 147.4° |
C23 | C22 | C19 | N4 | 2.2° | 0.0° |
C23 | C22 | C19 | N5 | 167.8° | 179.9° |
C22 | C23 | C24 | H12 | 178.9° | 180.0° |
C18 | C17 | N3 | H13 | 119.5° | 120.0° |
C18 | C17 | N3 | H14 | 119.5° | 120.0° |
C18 | C17 | N3 | C14 | 147.6° | 180.0° |
C17 | C18 | N4 | C19 | 178.6° | 179.8° |
C17 | C18 | C24 | H12 | 0.6° | 0.3° |
C18 | C17 | H13 | H14 | 121.6° | 120.0° |
C18 | C17 | N3 | H15 | 90.9° | 56.0° |
N3 | C17 | C18 | N4 | 75.3° | 85.0° |
C17 | N3 | C14 | C15 | 44.5° | 59.8° |
C17 | N3 | C14 | H15 | 121.5° | 124.0° |
C17 | N3 | C14 | C25 | 161.9° | 180.0° |
C17 | N3 | C14 | C13 | 82.1° | 60.2° |
N3 | C17 | H13 | H14 | 121.5° | 120.0° |
C18 | N4 | C19 | C22 | 2.7° | 0.0° |
C18 | N4 | C19 | N5 | 167.2° | 179.9° |
N4 | C18 | C24 | H12 | 179.4° | 180.0° |
N4 | C18 | C17 | H13 | 44.2° | 35.0° |
N4 | C18 | C17 | H14 | 165.3° | 155.0° |
C16 | C15 | C14 | H6 | 119.6° | 119.8° |
C16 | C15 | C14 | H7 | 119.6° | 119.8° |
C16 | C15 | C14 | N3 | 174.3° | 177.7° |
C15 | C16 | C12 | H19 | 120.4° | 119.9° |
C15 | C16 | C12 | H20 | 120.5° | 119.8° |
C16 | C15 | C14 | C25 | 61.1° | 61.5° |
C16 | C15 | C14 | C13 | 55.1° | 57.0° |
C15 | C16 | C12 | C26 | 56.5° | 60.9° |
C15 | C16 | C12 | C11 | 177.2° | 179.0° |
C15 | C16 | C12 | O2 | 59.5° | 58.6° |
C16 | C15 | H6 | H7 | 121.1° | 120.3° |
C15 | C16 | H19 | H20 | 118.6° | 120.2° |
C15 | C14 | N3 | C25 | 117.4° | 120.2° |
C15 | C14 | N3 | C13 | 126.6° | 120.0° |
C14 | C15 | C16 | C12 | 2.0° | 0.1° |
C15 | C14 | C25 | C13 | 117.6° | 118.4° |
C15 | C14 | C25 | C26 | 61.3° | 61.9° |
C15 | C14 | C13 | O2 | 59.6° | 59.2° |
C14 | C15 | H6 | H7 | 121.1° | 120.4° |
C15 | C14 | N3 | H15 | 77.0° | 64.1° |
C15 | C14 | C13 | H17 | 179.4° | 179.1° |
C15 | C14 | C13 | H18 | 60.3° | 60.9° |
C14 | C15 | C16 | H19 | 118.5° | 119.7° |
C14 | C15 | C16 | H20 | 122.5° | 120.0° |
C15 | C14 | C25 | H21 | 58.5° | 57.9° |
C15 | C14 | C25 | H22 | 178.9° | 178.3° |
N1 | C10 | C9 | H26 | 119.4° | 119.0° |
N1 | C10 | C9 | H27 | 119.5° | 119.1° |
C10 | N1 | C1 | C5 | 179.2° | 179.6° |
C10 | N1 | C1 | C2 | 0.3° | 0.5° |
N1 | C10 | C9 | O5 | 104.1° | 118.7° |
N1 | C10 | C9 | C2 | 6.0° | 0.0° |
N1 | C10 | C9 | C11 | 138.9° | 118.8° |
N1 | C10 | H26 | H27 | 121.7° | 122.0° |
N1 | C1 | C5 | C6 | 0.3° | 0.6° |
C1 | N1 | C10 | C9 | 3.7° | 0.3° |
N1 | C1 | C5 | C2 | 179.5° | 179.0° |
N1 | C1 | C5 | N2 | 179.1° | 179.7° |
N1 | C1 | C2 | C9 | 4.4° | 0.5° |
N1 | C1 | C2 | C3 | 179.8° | 179.7° |
C1 | N1 | C10 | H26 | 123.1° | 118.7° |
C1 | N1 | C10 | H27 | 115.7° | 119.4° |
C6 | C5 | C1 | N2 | 179.4° | 179.7° |
C6 | C5 | C1 | C2 | 179.7° | 179.6° |
C6 | C5 | N2 | C4 | 179.6° | 180.0° |
C5 | C6 | C7 | H3 | 179.8° | 180.0° |
C10 | C9 | C2 | C1 | 6.2° | 0.3° |
C10 | C9 | O5 | C2 | 109.5° | 114.9° |
C10 | C9 | O5 | C11 | 121.0° | 122.6° |
C10 | C9 | C2 | C11 | 126.8° | 118.8° |
C10 | C9 | C11 | C12 | 57.8° | 58.8° |
C10 | C9 | C2 | C3 | 179.9° | 180.0° |
C10 | C9 | C11 | H4 | 63.2° | 178.9° |
C10 | C9 | C11 | H5 | 178.9° | 61.1° |
C10 | C9 | O5 | H25 | 180.0° | 55.7° |
C9 | C10 | H26 | H27 | 121.6° | 122.0° |
N3 | C14 | C25 | C13 | 122.7° | 120.5° |
N3 | C14 | C25 | C26 | 179.0° | 177.0° |
N3 | C14 | C13 | O2 | 171.9° | 179.8° |
N3 | C14 | C15 | H6 | 54.7° | 57.9° |
N3 | C14 | C15 | H7 | 66.1° | 62.5° |
C14 | N3 | C17 | H13 | 28.1° | 60.0° |
C14 | N3 | C17 | H14 | 92.9° | 60.0° |
N3 | C14 | C13 | H17 | 52.0° | 59.9° |
N3 | C14 | C13 | H18 | 68.3° | 60.2° |
N3 | C14 | C25 | H21 | 61.2° | 63.2° |
N3 | C14 | C25 | H22 | 59.2° | 57.2° |
C16 | C12 | C26 | C25 | 56.6° | 60.5° |
C16 | C12 | C11 | C9 | 63.9° | 170.4° |
C16 | C12 | C26 | C11 | 122.7° | 120.0° |
C16 | C12 | C26 | O2 | 118.0° | 119.6° |
C16 | C12 | C11 | O2 | 122.3° | 120.2° |
C16 | C12 | O2 | C13 | 57.1° | 59.9° |
C16 | C12 | C11 | H4 | 57.1° | 69.6° |
C16 | C12 | C11 | H5 | 175.0° | 50.4° |
C12 | C16 | C15 | H6 | 117.6° | 120.0° |
C12 | C16 | C15 | H7 | 121.6° | 119.7° |
C12 | C16 | H19 | H20 | 118.6° | 120.2° |
C16 | C12 | C26 | H23 | 63.8° | 59.4° |
C16 | C12 | C26 | H24 | 177.0° | 179.5° |
O4 | C22 | C19 | N4 | 178.1° | 179.9° |
O4 | C22 | C19 | N5 | 12.0° | 0.1° |
C22 | O4 | C21 | C20 | 24.6° | 46.1° |
C22 | O4 | C21 | H8 | 145.6° | 73.9° |
C22 | O4 | C21 | H9 | 96.4° | 166.1° |
O4 | C22 | C23 | H11 | 0.0° | 0.0° |
C19 | C22 | O4 | C21 | 26.2° | 32.6° |
C22 | C19 | N4 | N5 | 169.9° | 179.9° |
C22 | C19 | N5 | C20 | 3.9° | 15.4° |
C22 | C19 | N5 | H10 | 176.1° | 164.6° |
C19 | C22 | C23 | H11 | 179.8° | 180.0° |
O4 | C21 | C20 | H8 | 121.0° | 120.0° |
O4 | C21 | C20 | H9 | 121.0° | 120.0° |
O4 | C21 | C20 | N5 | 11.3° | 31.2° |
O4 | C21 | C20 | O3 | 172.6° | 148.9° |
O4 | C21 | H8 | H9 | 116.7° | 120.0° |
N4 | C19 | N5 | C20 | 166.2° | 164.7° |
N4 | C19 | N5 | H10 | 13.8° | 15.3° |
C14 | C25 | C26 | H21 | 119.8° | 119.8° |
C14 | C25 | C26 | H22 | 119.8° | 119.8° |
C14 | C25 | C26 | C12 | 1.8° | 0.9° |
C25 | C14 | C13 | O2 | 58.4° | 59.3° |
C25 | C14 | C15 | H6 | 58.5° | 178.7° |
C25 | C14 | C15 | H7 | 179.2° | 58.3° |
C25 | C14 | N3 | H15 | 40.4° | 56.0° |
C25 | C14 | C13 | H17 | 61.5° | 60.6° |
C25 | C14 | C13 | H18 | 178.2° | 179.3° |
C14 | C25 | H21 | H22 | 120.6° | 120.3° |
C14 | C25 | C26 | H23 | 122.1° | 120.7° |
C14 | C25 | C26 | H24 | 118.6° | 119.1° |
C13 | C14 | C25 | C26 | 56.2° | 56.5° |
C14 | C13 | O2 | C12 | 1.8° | 0.2° |
C14 | C13 | O2 | H17 | 119.9° | 119.9° |
C14 | C13 | O2 | H18 | 119.9° | 120.0° |
C13 | C14 | C15 | H6 | 174.7° | 62.8° |
C13 | C14 | C15 | H7 | 64.5° | 176.7° |
C13 | C14 | N3 | H15 | 156.3° | 175.9° |
C14 | C13 | H17 | H18 | 120.3° | 120.1° |
C13 | C14 | C25 | H21 | 176.1° | 176.3° |
C13 | C14 | C25 | H22 | 63.5° | 63.4° |
C5 | C1 | C2 | C9 | 175.0° | 179.6° |
C5 | C1 | C2 | C3 | 0.3° | 0.6° |
C1 | C5 | N2 | C4 | 0.3° | 0.3° |
C1 | C5 | C6 | H2 | 180.0° | 179.7° |
C2 | C1 | C5 | N2 | 0.3° | 0.7° |
C1 | C2 | C9 | O5 | 108.5° | 119.0° |
C1 | C2 | C9 | C3 | 174.0° | 179.7° |
C1 | C2 | C9 | C11 | 132.9° | 118.6° |
C1 | C2 | C3 | C4 | 0.9° | 0.3° |
C1 | C2 | C3 | F | 179.4° | 179.7° |
C19 | N5 | C20 | C21 | 3.4° | 1.7° |
C19 | N5 | C20 | H10 | 180.0° | 180.0° |
C19 | N5 | C20 | O3 | 172.7° | 178.4° |
C5 | N2 | C4 | C3 | 0.4° | 0.0° |
C5 | N2 | C4 | H1 | 179.6° | 180.0° |
N2 | C5 | C6 | H2 | 0.7° | 0.0° |
C25 | C26 | C12 | H23 | 120.4° | 119.9° |
C25 | C26 | C12 | H24 | 120.4° | 120.0° |
C25 | C26 | C12 | C11 | 179.3° | 179.5° |
C25 | C26 | C12 | O2 | 61.4° | 59.1° |
C26 | C25 | H21 | H22 | 120.6° | 120.4° |
C25 | C26 | H23 | H24 | 118.9° | 120.2° |
C21 | C20 | N5 | O3 | 176.1° | 179.9° |
C20 | C21 | H8 | H9 | 116.8° | 120.0° |
C21 | C20 | N5 | H10 | 176.6° | 178.3° |
O5 | C9 | C2 | C11 | 118.6° | 122.4° |
O5 | C9 | C11 | C12 | 61.8° | 178.6° |
O5 | C9 | C2 | C3 | 65.5° | 61.3° |
O5 | C9 | C11 | H4 | 177.1° | 58.6° |
O5 | C9 | C11 | H5 | 59.2° | 61.4° |
O5 | C9 | C10 | H26 | 15.4° | 122.3° |
O5 | C9 | C10 | H27 | 136.5° | 0.4° |
C2 | C9 | C11 | C12 | 179.6° | 56.1° |
C9 | C2 | C3 | C4 | 172.7° | 180.0° |
C9 | C2 | C3 | F | 6.9° | 0.0° |
C2 | C9 | C11 | H4 | 59.3° | 63.9° |
C2 | C9 | C11 | H5 | 58.6° | 176.1° |
C2 | C9 | O5 | H25 | 70.6° | 59.3° |
C2 | C9 | C10 | H26 | 125.4° | 118.9° |
C2 | C9 | C10 | H27 | 113.5° | 119.1° |
C9 | C11 | C12 | C26 | 57.7° | 69.7° |
C9 | C11 | C12 | H4 | 121.0° | 120.0° |
C9 | C11 | C12 | H5 | 121.1° | 120.0° |
C9 | C11 | C12 | O2 | 173.8° | 50.2° |
C11 | C9 | C2 | C3 | 53.1° | 61.2° |
C9 | C11 | H4 | H5 | 116.6° | 120.0° |
C11 | C9 | O5 | H25 | 58.9° | 178.2° |
C11 | C9 | C10 | H26 | 101.7° | 0.2° |
C11 | C9 | C10 | H27 | 19.5° | 122.1° |
C26 | C12 | C11 | O2 | 116.1° | 120.0° |
C26 | C12 | O2 | C13 | 61.5° | 59.7° |
C26 | C12 | C11 | H4 | 178.8° | 50.3° |
C26 | C12 | C11 | H5 | 63.3° | 170.3° |
C26 | C12 | C16 | H19 | 176.9° | 179.2° |
C26 | C12 | C16 | H20 | 64.0° | 58.9° |
C12 | C26 | C25 | H21 | 118.1° | 118.9° |
C12 | C26 | C25 | H22 | 121.6° | 120.7° |
C12 | C26 | H23 | H24 | 118.9° | 120.2° |
C11 | C12 | O2 | C13 | 179.1° | 179.9° |
C12 | C11 | H4 | H5 | 116.6° | 120.0° |
C11 | C12 | C16 | H19 | 62.3° | 59.2° |
C11 | C12 | C16 | H20 | 56.8° | 61.1° |
C11 | C12 | C26 | H23 | 59.0° | 60.6° |
C11 | C12 | C26 | H24 | 60.3° | 59.5° |
O2 | C12 | C11 | H4 | 65.1° | 170.3° |
O2 | C12 | C11 | H5 | 52.7° | 69.7° |
C12 | O2 | C13 | H17 | 121.6° | 119.7° |
C12 | O2 | C13 | H18 | 118.1° | 120.2° |
O2 | C12 | C16 | H19 | 61.0° | 61.3° |
O2 | C12 | C16 | H20 | 180.0° | 178.4° |
O2 | C12 | C26 | H23 | 178.2° | 179.0° |
O2 | C12 | C26 | H24 | 58.9° | 60.9° |
O2 | C13 | H17 | H18 | 120.3° | 120.1° |
N5 | C20 | C21 | H8 | 132.3° | 88.8° |
N5 | C20 | C21 | H9 | 109.8° | 151.2° |
C2 | C3 | C4 | N2 | 1.0° | 0.0° |
C2 | C3 | C4 | F | 179.7° | 180.0° |
C2 | C3 | C4 | H1 | 179.0° | 180.0° |
O3 | C20 | C21 | H8 | 51.6° | 91.1° |
O3 | C20 | C21 | H9 | 66.4° | 28.9° |
O3 | C20 | N5 | H10 | 7.3° | 1.6° |
N2 | C4 | C3 | H1 | 180.0° | 180.0° |
N2 | C4 | C3 | F | 179.3° | 180.0° |
F | C3 | C4 | H1 | 0.7° | 0.0° |
H2 | C6 | C7 | H3 | 0.1° | 0.0° |
H6 | C15 | C16 | H19 | 121.9° | 0.1° |
H6 | C15 | C16 | H20 | 2.8° | 120.2° |
H7 | C15 | C16 | H19 | 1.2° | 120.5° |
H7 | C15 | C16 | H20 | 117.9° | 0.2° |
H11 | C23 | C24 | H12 | 1.1° | 0.0° |
H13 | C17 | N3 | H15 | 149.6° | 176.0° |
H14 | C17 | N3 | H15 | 28.6° | 64.0° |
H21 | C25 | C26 | H23 | 2.3° | 0.9° |
H21 | C25 | C26 | H24 | 121.6° | 121.1° |
H22 | C25 | C26 | H23 | 118.1° | 119.5° |
H22 | C25 | C26 | H24 | 1.2° | 0.7° |