FI6
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.53Å | 1.50Å | |
F2 | C32 | sing | 1.40Å | 1.32Å | |
O4 | C32 | sing | 1.43Å | 1.33Å | |
O4 | C29 | sing | 1.36Å | 1.42Å | |
C2 | O1 | sing | 1.43Å | 1.43Å | |
C32 | F3 | sing | 1.40Å | 1.32Å | |
C32 | F1 | sing | 1.40Å | 1.32Å | |
O1 | C3 | sing | 1.36Å | 1.37Å | |
C30 | C29 | doub | 1.39Å | 1.39Å | Aromatic |
C30 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
C29 | C28 | sing | 1.39Å | 1.39Å | Aromatic |
C3 | C8 | doub | 1.39Å | 1.38Å | Aromatic |
C3 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
C8 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
C31 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
N5 | C21 | doub | 1.32Å | 1.34Å | Aromatic |
N5 | C20 | sing | 1.32Å | 1.34Å | Aromatic |
C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
C28 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
C21 | C22 | sing | 1.38Å | 1.37Å | Aromatic |
C7 | C6 | doub | 1.39Å | 1.38Å | Aromatic |
C20 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
C26 | C27 | sing | 1.38Å | 1.39Å | Aromatic |
C26 | C25 | sing | 1.51Å | 1.51Å | |
C5 | C6 | sing | 1.39Å | 1.38Å | Aromatic |
O2 | C9 | doub | 1.22Å | 1.22Å | |
C6 | N1 | sing | 1.40Å | 1.45Å | |
O3 | C24 | doub | 1.21Å | 1.23Å | |
C22 | C23 | doub | 1.39Å | 1.37Å | Aromatic |
C25 | C24 | sing | 1.51Å | 1.51Å | |
C24 | N4 | sing | 1.35Å | 1.36Å | |
C19 | C23 | sing | 1.39Å | 1.38Å | Aromatic |
C19 | C18 | sing | 1.51Å | 1.50Å | |
C9 | N1 | sing | 1.35Å | 1.41Å | |
C9 | C10 | sing | 1.47Å | 1.45Å | |
N1 | C15 | sing | 1.36Å | 1.40Å | |
N4 | C18 | sing | 1.46Å | 1.47Å | |
N4 | C16 | sing | 1.47Å | 1.48Å | |
C10 | C14 | doub | 1.40Å | 1.42Å | Aromatic |
C10 | C11 | sing | 1.41Å | 1.42Å | Aromatic |
C14 | C13 | sing | 1.38Å | 1.36Å | Aromatic |
C15 | C16 | sing | 1.51Å | 1.52Å | |
C15 | N3 | doub | 1.30Å | 1.29Å | |
C16 | C17 | sing | 1.53Å | 1.52Å | |
C11 | N3 | sing | 1.36Å | 1.36Å | |
C11 | N2 | doub | 1.33Å | 1.36Å | Aromatic |
C13 | C12 | doub | 1.39Å | 1.41Å | Aromatic |
C12 | N2 | sing | 1.32Å | 1.32Å | Aromatic |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H2 | sing | 1.09Å | 1.10Å | |
C1 | H3 | sing | 1.09Å | 1.10Å | |
C2 | H4 | sing | 1.09Å | 1.10Å | |
C2 | H5 | sing | 1.09Å | 1.10Å | |
C4 | H6 | sing | 1.08Å | 1.08Å | |
C5 | H7 | sing | 1.08Å | 1.08Å | |
C7 | H8 | sing | 1.08Å | 1.08Å | |
C12 | H9 | sing | 1.08Å | 1.08Å | |
C13 | H10 | sing | 1.08Å | 1.08Å | |
C14 | H11 | sing | 1.08Å | 1.08Å | |
C16 | H12 | sing | 1.09Å | 1.10Å | |
C17 | H13 | sing | 1.09Å | 1.10Å | |
C17 | H14 | sing | 1.09Å | 1.10Å | |
C17 | H15 | sing | 1.09Å | 1.10Å | |
C18 | H16 | sing | 1.09Å | 1.10Å | |
C18 | H17 | sing | 1.09Å | 1.10Å | |
C20 | H18 | sing | 1.08Å | 1.08Å | |
C21 | H19 | sing | 1.08Å | 1.08Å | |
C22 | H20 | sing | 1.08Å | 1.08Å | |
C23 | H21 | sing | 1.08Å | 1.08Å | |
C25 | H22 | sing | 1.09Å | 1.10Å | |
C25 | H23 | sing | 1.09Å | 1.10Å | |
C27 | H24 | sing | 1.08Å | 1.08Å | |
C28 | H25 | sing | 1.08Å | 1.08Å | |
C30 | H26 | sing | 1.08Å | 1.08Å | |
C31 | H27 | sing | 1.08Å | 1.08Å | |
C8 | H28 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C1 | C2 | O1 | 107.5° | 109.4° |
C2 | C1 | H1 | 109.5° | 109.5° |
C2 | C1 | H2 | 109.4° | 109.5° |
C2 | C1 | H3 | 109.4° | 109.5° |
C1 | C2 | H4 | 110.0° | 109.5° |
C1 | C2 | H5 | 110.0° | 109.5° |
F2 | C32 | O4 | 110.3° | 109.5° |
F2 | C32 | F3 | 106.6° | 109.5° |
F2 | C32 | F1 | 106.6° | 109.5° |
C32 | O4 | C29 | 119.5° | 117.0° |
O4 | C32 | F3 | 112.6° | 109.5° |
O4 | C32 | F1 | 112.7° | 109.5° |
O4 | C29 | C30 | 118.9° | 120.1° |
O4 | C29 | C28 | 121.7° | 120.0° |
C2 | O1 | C3 | 118.3° | 117.0° |
O1 | C2 | H4 | 110.0° | 109.4° |
O1 | C2 | H5 | 110.0° | 109.5° |
F3 | C32 | F1 | 107.6° | 109.5° |
O1 | C3 | C8 | 119.5° | 120.0° |
O1 | C3 | C4 | 120.6° | 119.9° |
C29 | C30 | C31 | 119.8° | 120.0° |
C30 | C29 | C28 | 119.4° | 119.9° |
C29 | C30 | H26 | 120.1° | 120.0° |
C30 | C31 | C26 | 121.7° | 120.1° |
C31 | C30 | H26 | 120.1° | 120.0° |
C30 | C31 | H27 | 119.2° | 120.0° |
C29 | C28 | C27 | 119.9° | 119.9° |
C29 | C28 | H25 | 120.0° | 120.1° |
C8 | C3 | C4 | 119.8° | 120.1° |
C3 | C8 | C7 | 120.0° | 120.0° |
C3 | C8 | H28 | 120.0° | 120.1° |
C3 | C4 | C5 | 119.9° | 120.0° |
C3 | C4 | H6 | 120.1° | 120.0° |
C8 | C7 | C6 | 120.1° | 120.0° |
C8 | C7 | H8 | 119.9° | 120.1° |
C7 | C8 | H28 | 120.0° | 119.9° |
C31 | C26 | C27 | 117.7° | 120.1° |
C31 | C26 | C25 | 121.0° | 119.9° |
C26 | C31 | H27 | 119.1° | 119.9° |
C21 | N5 | C20 | 117.0° | 121.7° |
N5 | C21 | C22 | 123.2° | 120.8° |
N5 | C21 | H19 | 118.4° | 119.6° |
N5 | C20 | C19 | 124.0° | 120.8° |
N5 | C20 | H18 | 118.0° | 119.6° |
C4 | C5 | C6 | 120.2° | 120.0° |
C5 | C4 | H6 | 120.0° | 120.0° |
C4 | C5 | H7 | 119.9° | 120.0° |
C28 | C27 | C26 | 121.5° | 120.0° |
C28 | C27 | H24 | 119.2° | 120.0° |
C27 | C28 | H25 | 120.1° | 120.0° |
C21 | C22 | C23 | 118.5° | 119.2° |
C22 | C21 | H19 | 118.4° | 119.6° |
C21 | C22 | H20 | 120.7° | 120.4° |
C7 | C6 | C5 | 119.6° | 120.0° |
C7 | C6 | N1 | 120.1° | 120.0° |
C6 | C7 | H8 | 119.9° | 120.0° |
C20 | C19 | C23 | 117.0° | 119.2° |
C20 | C19 | C18 | 121.3° | 120.4° |
C19 | C20 | H18 | 118.0° | 119.6° |
C27 | C26 | C25 | 121.3° | 120.0° |
C26 | C27 | H24 | 119.3° | 120.0° |
C26 | C25 | C24 | 111.7° | 109.5° |
C26 | C25 | H22 | 108.9° | 109.4° |
C26 | C25 | H23 | 108.9° | 109.5° |
C5 | C6 | N1 | 119.7° | 120.0° |
C6 | C5 | H7 | 119.9° | 120.0° |
O2 | C9 | N1 | 120.5° | 121.3° |
O2 | C9 | C10 | 123.5° | 121.4° |
C6 | N1 | C9 | 117.4° | 119.8° |
C6 | N1 | C15 | 121.2° | 119.8° |
O3 | C24 | C25 | 121.2° | 120.0° |
O3 | C24 | N4 | 120.7° | 120.0° |
C22 | C23 | C19 | 120.2° | 118.4° |
C23 | C22 | H20 | 120.7° | 120.4° |
C22 | C23 | H21 | 119.9° | 120.8° |
C25 | C24 | N4 | 118.0° | 120.0° |
C24 | C25 | H22 | 108.9° | 109.4° |
C24 | C25 | H23 | 108.9° | 109.5° |
C24 | N4 | C18 | 120.2° | 120.0° |
C24 | N4 | C16 | 121.0° | 120.0° |
C23 | C19 | C18 | 121.8° | 120.4° |
C19 | C23 | H21 | 119.9° | 120.8° |
C19 | C18 | N4 | 113.8° | 109.4° |
C19 | C18 | H16 | 108.4° | 109.4° |
C19 | C18 | H17 | 108.4° | 109.5° |
N1 | C9 | C10 | 115.8° | 117.4° |
C9 | N1 | C15 | 121.0° | 120.5° |
C9 | C10 | C14 | 124.1° | 122.1° |
C9 | C10 | C11 | 118.1° | 118.3° |
N1 | C15 | C16 | 121.5° | 118.3° |
N1 | C15 | N3 | 122.7° | 123.4° |
C18 | N4 | C16 | 118.7° | 120.0° |
N4 | C18 | H16 | 108.4° | 109.5° |
N4 | C18 | H17 | 108.4° | 109.5° |
N4 | C16 | C15 | 114.1° | 109.5° |
N4 | C16 | C17 | 110.3° | 109.4° |
N4 | C16 | H12 | 107.6° | 109.5° |
C14 | C10 | C11 | 117.8° | 119.6° |
C10 | C14 | C13 | 119.7° | 117.9° |
C10 | C14 | H11 | 120.1° | 121.1° |
C10 | C11 | N3 | 121.7° | 118.7° |
C10 | C11 | N2 | 121.8° | 119.8° |
C14 | C13 | C12 | 118.2° | 119.6° |
C14 | C13 | H10 | 120.9° | 120.2° |
C13 | C14 | H11 | 120.2° | 121.1° |
C16 | C15 | N3 | 115.8° | 118.3° |
C15 | C16 | C17 | 110.1° | 109.5° |
C15 | C16 | H12 | 107.2° | 109.5° |
C15 | N3 | C11 | 120.5° | 121.8° |
C17 | C16 | H12 | 107.2° | 109.4° |
C16 | C17 | H13 | 109.5° | 109.5° |
C16 | C17 | H14 | 109.5° | 109.4° |
C16 | C17 | H15 | 109.5° | 109.5° |
N3 | C11 | N2 | 116.5° | 121.5° |
C11 | N2 | C12 | 117.6° | 121.4° |
C13 | C12 | N2 | 124.8° | 121.7° |
C13 | C12 | H9 | 117.6° | 119.1° |
C12 | C13 | H10 | 120.9° | 120.2° |
N2 | C12 | H9 | 117.6° | 119.1° |
H1 | C1 | H2 | 109.5° | 109.4° |
H1 | C1 | H3 | 109.5° | 109.5° |
H2 | C1 | H3 | 109.5° | 109.5° |
H4 | C2 | H5 | 109.5° | 109.5° |
H13 | C17 | H14 | 109.4° | 109.5° |
H13 | C17 | H15 | 109.5° | 109.5° |
H14 | C17 | H15 | 109.5° | 109.5° |
H16 | C18 | H17 | 109.4° | 109.5° |
H22 | C25 | H23 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C1 | C2 | O1 | H4 | 119.7° | 120.0° |
C1 | C2 | O1 | H5 | 119.7° | 120.0° |
C1 | C2 | O1 | C3 | 178.0° | 176.0° |
C2 | C1 | H1 | H2 | 120.0° | 120.0° |
C2 | C1 | H1 | H3 | 120.0° | 120.0° |
C2 | C1 | H2 | H3 | 120.0° | 120.0° |
C1 | C2 | H4 | H5 | 120.9° | 120.1° |
F2 | C32 | O4 | F3 | 118.9° | 120.0° |
F2 | C32 | O4 | F1 | 119.1° | 120.0° |
F2 | C32 | O4 | C29 | 179.4° | 60.6° |
F2 | C32 | F3 | F1 | 114.1° | 120.0° |
O4 | C32 | F3 | F1 | 124.8° | 120.0° |
C32 | O4 | C29 | C30 | 177.9° | 0.6° |
C32 | O4 | C29 | C28 | 1.6° | 179.3° |
C29 | O4 | C32 | F3 | 60.5° | 59.4° |
C29 | O4 | C32 | F1 | 61.5° | 179.4° |
O4 | C29 | C30 | C28 | 179.5° | 179.9° |
O4 | C29 | C30 | C31 | 179.7° | 179.7° |
O4 | C29 | C28 | C27 | 179.9° | 179.9° |
O4 | C29 | C28 | H25 | 0.1° | 0.0° |
O4 | C29 | C30 | H26 | 0.3° | 0.1° |
C2 | O1 | C3 | C8 | 178.7° | 175.6° |
C2 | O1 | C3 | C4 | 0.4° | 4.1° |
O1 | C2 | C1 | H1 | 180.0° | 55.1° |
O1 | C2 | C1 | H2 | 60.0° | 175.1° |
O1 | C2 | C1 | H3 | 60.0° | 64.9° |
O1 | C2 | H4 | H5 | 120.9° | 120.0° |
O1 | C3 | C8 | C4 | 179.1° | 179.7° |
O1 | C3 | C8 | C7 | 179.7° | 179.7° |
O1 | C3 | C4 | C5 | 179.1° | 179.7° |
C3 | O1 | C2 | H4 | 62.4° | 63.9° |
C3 | O1 | C2 | H5 | 58.3° | 56.0° |
O1 | C3 | C4 | H6 | 0.9° | 0.2° |
O1 | C3 | C8 | H28 | 0.3° | 0.3° |
C29 | C30 | C31 | H26 | 180.0° | 179.6° |
C29 | C30 | C31 | C26 | 0.3° | 0.6° |
C30 | C29 | C28 | C27 | 0.4° | 0.0° |
C30 | C29 | C28 | H25 | 179.6° | 180.0° |
C29 | C30 | C31 | H27 | 179.7° | 180.0° |
C31 | C30 | C29 | C28 | 0.3° | 0.3° |
C30 | C31 | C26 | H27 | 180.0° | 179.4° |
C30 | C31 | C26 | C27 | 0.4° | 0.6° |
C30 | C31 | C26 | C25 | 180.0° | 179.7° |
C29 | C28 | C27 | H25 | 180.0° | 180.0° |
C29 | C28 | C27 | C26 | 0.6° | 0.0° |
C29 | C28 | C27 | H24 | 179.5° | 180.0° |
C28 | C29 | C30 | H26 | 179.7° | 180.0° |
C3 | C8 | C7 | H28 | 180.0° | 180.0° |
C8 | C3 | C4 | C5 | 0.0° | 0.0° |
C3 | C8 | C7 | C6 | 2.3° | 0.0° |
C8 | C3 | C4 | H6 | 180.0° | 180.0° |
C3 | C8 | C7 | H8 | 177.7° | 180.0° |
C4 | C3 | C8 | C7 | 0.6° | 0.0° |
C3 | C4 | C5 | H6 | 180.0° | 180.0° |
C3 | C4 | C5 | C6 | 3.5° | 0.0° |
C3 | C4 | C5 | H7 | 176.5° | 179.9° |
C4 | C3 | C8 | H28 | 179.4° | 180.0° |
C8 | C7 | C6 | H8 | 180.0° | 180.0° |
C8 | C7 | C6 | C5 | 5.7° | 0.0° |
C8 | C7 | C6 | N1 | 177.2° | 180.0° |
C31 | C26 | C27 | C28 | 0.5° | 0.2° |
C31 | C26 | C27 | C25 | 179.6° | 179.7° |
C31 | C26 | C25 | C24 | 100.6° | 95.7° |
C31 | C26 | C25 | H22 | 139.0° | 144.4° |
C31 | C26 | C25 | H23 | 19.7° | 24.3° |
C31 | C26 | C27 | H24 | 179.5° | 179.7° |
C26 | C31 | C30 | H26 | 179.7° | 179.7° |
N5 | C21 | C22 | H19 | 180.0° | 179.5° |
C21 | N5 | C20 | C19 | 0.1° | 0.0° |
N5 | C21 | C22 | C23 | 0.0° | 0.5° |
C21 | N5 | C20 | H18 | 179.9° | 180.0° |
N5 | C21 | C22 | H20 | 180.0° | 179.5° |
C20 | N5 | C21 | C22 | 0.0° | 0.3° |
N5 | C20 | C19 | H18 | 180.0° | 180.0° |
N5 | C20 | C19 | C23 | 0.2° | 0.0° |
N5 | C20 | C19 | C18 | 179.9° | 179.8° |
C20 | N5 | C21 | H19 | 179.9° | 179.8° |
C4 | C5 | C6 | C7 | 6.4° | 0.1° |
C4 | C5 | C6 | H7 | 180.0° | 179.9° |
C4 | C5 | C6 | N1 | 177.8° | 180.0° |
C28 | C27 | C26 | H24 | 180.0° | 180.0° |
C28 | C27 | C26 | C25 | 179.8° | 180.0° |
C21 | C22 | C23 | H20 | 180.0° | 180.0° |
C21 | C22 | C23 | C19 | 0.0° | 0.5° |
C21 | C22 | C23 | H21 | 180.0° | 179.5° |
C7 | C6 | C5 | N1 | 171.5° | 180.0° |
C7 | C6 | N1 | C9 | 118.7° | 71.6° |
C7 | C6 | N1 | C15 | 67.4° | 108.4° |
C7 | C6 | C5 | H7 | 173.6° | 179.9° |
C6 | C7 | C8 | H28 | 177.7° | 180.0° |
C20 | C19 | C23 | C22 | 0.1° | 0.3° |
C20 | C19 | C23 | C18 | 179.8° | 179.8° |
C20 | C19 | C18 | N4 | 36.5° | 86.2° |
C20 | C19 | C18 | H16 | 157.1° | 33.8° |
C20 | C19 | C18 | H17 | 84.2° | 153.8° |
C20 | C19 | C23 | H21 | 179.9° | 179.8° |
C27 | C26 | C25 | C24 | 79.7° | 84.6° |
C27 | C26 | C25 | H22 | 40.6° | 35.4° |
C27 | C26 | C25 | H23 | 159.9° | 155.4° |
C26 | C27 | C28 | H25 | 179.4° | 180.0° |
C27 | C26 | C31 | H27 | 179.6° | 180.0° |
C26 | C25 | C24 | O3 | 11.0° | 7.2° |
C26 | C25 | C24 | H22 | 120.3° | 120.0° |
C26 | C25 | C24 | H23 | 120.3° | 120.0° |
C26 | C25 | C24 | N4 | 172.4° | 172.8° |
C26 | C25 | H22 | H23 | 119.0° | 120.0° |
C25 | C26 | C27 | H24 | 0.1° | 0.0° |
C25 | C26 | C31 | H27 | 0.0° | 0.3° |
C5 | C6 | N1 | C9 | 52.7° | 108.4° |
C5 | C6 | N1 | C15 | 121.1° | 71.6° |
C6 | C5 | C4 | H6 | 176.5° | 179.9° |
C5 | C6 | C7 | H8 | 174.3° | 179.9° |
O2 | C9 | N1 | C6 | 6.2° | 0.0° |
O2 | C9 | N1 | C10 | 175.1° | 180.0° |
O2 | C9 | N1 | C15 | 180.0° | 180.0° |
O2 | C9 | C10 | C14 | 2.6° | 0.1° |
O2 | C9 | C10 | C11 | 178.6° | 179.7° |
C6 | N1 | C9 | C15 | 173.8° | 180.0° |
C6 | N1 | C9 | C10 | 178.8° | 180.0° |
C6 | N1 | C15 | C16 | 2.6° | 0.0° |
C6 | N1 | C15 | N3 | 177.1° | 179.7° |
N1 | C6 | C5 | H7 | 2.1° | 0.1° |
N1 | C6 | C7 | H8 | 2.8° | 0.1° |
O3 | C24 | C25 | N4 | 176.6° | 180.0° |
O3 | C24 | N4 | C18 | 9.0° | 175.0° |
O3 | C24 | N4 | C16 | 175.2° | 5.0° |
O3 | C24 | C25 | H22 | 109.3° | 127.1° |
O3 | C24 | C25 | H23 | 131.4° | 112.9° |
C22 | C23 | C19 | H21 | 180.0° | 180.0° |
C22 | C23 | C19 | C18 | 179.9° | 180.0° |
C23 | C22 | C21 | H19 | 180.0° | 180.0° |
C25 | C24 | N4 | C18 | 167.6° | 5.0° |
C25 | C24 | N4 | C16 | 8.1° | 175.0° |
C24 | C25 | H22 | H23 | 119.0° | 120.0° |
C24 | N4 | C18 | C19 | 95.7° | 83.2° |
C24 | N4 | C18 | C16 | 175.9° | 180.0° |
C24 | N4 | C16 | C15 | 135.0° | 125.3° |
C24 | N4 | C16 | C17 | 100.4° | 114.8° |
C24 | N4 | C16 | H12 | 16.2° | 5.2° |
C24 | N4 | C18 | H16 | 143.6° | 156.8° |
C24 | N4 | C18 | H17 | 25.0° | 36.8° |
N4 | C24 | C25 | H22 | 67.3° | 52.9° |
N4 | C24 | C25 | H23 | 52.0° | 67.1° |
C23 | C19 | C18 | N4 | 143.3° | 93.5° |
C23 | C19 | C18 | H16 | 22.6° | 146.5° |
C23 | C19 | C18 | H17 | 96.1° | 26.4° |
C23 | C19 | C20 | H18 | 179.8° | 180.0° |
C19 | C23 | C22 | H20 | 180.0° | 179.5° |
C19 | C18 | N4 | H16 | 120.7° | 120.0° |
C19 | C18 | N4 | H17 | 120.7° | 120.0° |
C19 | C18 | N4 | C16 | 88.4° | 96.8° |
C19 | C18 | H16 | H17 | 118.0° | 120.0° |
C18 | C19 | C20 | H18 | 0.1° | 0.2° |
C18 | C19 | C23 | H21 | 0.2° | 0.0° |
N1 | C9 | C10 | C14 | 177.5° | 180.0° |
N1 | C9 | C10 | C11 | 3.7° | 0.3° |
C9 | N1 | C15 | C16 | 176.2° | 180.0° |
C9 | N1 | C15 | N3 | 3.5° | 0.3° |
C10 | C9 | N1 | C15 | 4.9° | 0.0° |
C9 | C10 | C14 | C11 | 178.9° | 179.7° |
C9 | C10 | C14 | C13 | 178.9° | 179.7° |
C9 | C10 | C11 | N3 | 0.9° | 0.2° |
C9 | C10 | C11 | N2 | 179.0° | 179.7° |
C9 | C10 | C14 | H11 | 1.1° | 0.3° |
N1 | C15 | C16 | N4 | 93.1° | 74.7° |
N1 | C15 | C16 | N3 | 179.7° | 179.7° |
N1 | C15 | C16 | C17 | 142.2° | 165.3° |
N1 | C15 | N3 | C11 | 0.4° | 0.3° |
N1 | C15 | C16 | H12 | 25.9° | 45.3° |
C18 | N4 | C16 | C15 | 49.1° | 54.8° |
C18 | N4 | C16 | C17 | 75.4° | 65.2° |
C18 | N4 | C16 | H12 | 168.0° | 174.8° |
N4 | C18 | H16 | H17 | 118.0° | 120.0° |
N4 | C16 | C15 | C17 | 124.7° | 120.0° |
N4 | C16 | C15 | H12 | 119.1° | 120.0° |
N4 | C16 | C15 | N3 | 87.1° | 105.0° |
N4 | C16 | C17 | H12 | 116.9° | 120.0° |
N4 | C16 | C17 | H13 | 180.0° | 175.3° |
N4 | C16 | C17 | H14 | 60.0° | 55.3° |
N4 | C16 | C17 | H15 | 60.0° | 64.7° |
C16 | N4 | C18 | H16 | 32.3° | 23.2° |
C16 | N4 | C18 | H17 | 150.9° | 143.2° |
C10 | C14 | C13 | H11 | 180.0° | 180.0° |
C14 | C10 | C11 | N3 | 179.9° | 179.9° |
C14 | C10 | C11 | N2 | 0.1° | 0.0° |
C10 | C14 | C13 | C12 | 0.1° | 0.0° |
C10 | C14 | C13 | H10 | 179.9° | 180.0° |
C11 | C10 | C14 | C13 | 0.0° | 0.0° |
C10 | C11 | N3 | C15 | 0.8° | 0.1° |
C10 | C11 | N3 | N2 | 180.0° | 179.9° |
C10 | C11 | N2 | C12 | 0.1° | 0.0° |
C11 | C10 | C14 | H11 | 180.0° | 180.0° |
C14 | C13 | C12 | H10 | 180.0° | 180.0° |
C14 | C13 | C12 | N2 | 0.1° | 0.0° |
C14 | C13 | C12 | H9 | 180.0° | 180.0° |
C15 | C16 | C17 | H12 | 116.3° | 120.0° |
C16 | C15 | N3 | C11 | 179.3° | 180.0° |
C15 | C16 | C17 | H13 | 53.2° | 55.3° |
C15 | C16 | C17 | H14 | 66.8° | 64.7° |
C15 | C16 | C17 | H15 | 173.2° | 175.3° |
N3 | C15 | C16 | C17 | 37.5° | 15.0° |
C15 | N3 | C11 | N2 | 179.2° | 180.0° |
N3 | C15 | C16 | H12 | 153.8° | 135.0° |
C16 | C17 | H13 | H14 | 120.0° | 120.0° |
C16 | C17 | H13 | H15 | 120.0° | 120.0° |
C16 | C17 | H14 | H15 | 120.0° | 120.0° |
N3 | C11 | N2 | C12 | 179.9° | 179.9° |
C11 | N2 | C12 | C13 | 0.0° | 0.0° |
C11 | N2 | C12 | H9 | 179.9° | 179.9° |
C13 | C12 | N2 | H9 | 180.0° | 179.9° |
C12 | C13 | C14 | H11 | 180.0° | 180.0° |
N2 | C12 | C13 | H10 | 179.9° | 180.0° |
H1 | C1 | H2 | H3 | 120.0° | 120.0° |
H1 | C1 | C2 | H4 | 60.3° | 175.1° |
H1 | C1 | C2 | H5 | 60.3° | 64.8° |
H2 | C1 | C2 | H4 | 59.7° | 64.9° |
H2 | C1 | C2 | H5 | 179.7° | 55.1° |
H3 | C1 | C2 | H4 | 179.7° | 55.0° |
H3 | C1 | C2 | H5 | 59.7° | 175.1° |
H6 | C4 | C5 | H7 | 3.6° | 0.0° |
H8 | C7 | C8 | H28 | 2.3° | 0.0° |
H9 | C12 | C13 | H10 | 0.0° | 0.1° |
H10 | C13 | C14 | H11 | 0.1° | 0.0° |
H12 | C16 | C17 | H13 | 63.1° | 64.8° |
H12 | C16 | C17 | H14 | 176.9° | 175.2° |
H12 | C16 | C17 | H15 | 56.9° | 55.2° |
H13 | C17 | H14 | H15 | 120.0° | 120.0° |
H19 | C21 | C22 | H20 | 0.0° | 0.0° |
H20 | C22 | C23 | H21 | 0.0° | 0.4° |
H24 | C27 | C28 | H25 | 0.5° | 0.0° |
H26 | C30 | C31 | H27 | 0.3° | 0.3° |