HOI
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C20 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
C20 | C19 | doub | 1.39Å | 1.40Å | Aromatic |
O3 | C19 | sing | 1.36Å | 1.36Å | |
C21 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
C19 | C18 | sing | 1.40Å | 1.40Å | Aromatic |
C12 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
C12 | C11 | sing | 1.39Å | 1.40Å | Aromatic |
C31 | O5 | sing | 1.43Å | 1.43Å | |
O5 | C11 | sing | 1.36Å | 1.36Å | |
C22 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
C18 | C17 | doub | 1.41Å | 1.38Å | Aromatic |
C18 | C23 | sing | 1.47Å | 1.48Å | |
C13 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
C11 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
O4 | C23 | doub | 1.22Å | 1.22Å | |
C17 | N2 | sing | 1.39Å | 1.37Å | |
C23 | N3 | sing | 1.35Å | 1.38Å | |
C10 | C9 | sing | 1.51Å | 1.52Å | |
C10 | C15 | sing | 1.38Å | 1.41Å | Aromatic |
C14 | C15 | doub | 1.38Å | 1.41Å | Aromatic |
C14 | C16 | sing | 1.51Å | 1.54Å | |
C9 | O2 | sing | 1.43Å | 1.44Å | |
N3 | C16 | sing | 1.46Å | 1.45Å | |
N3 | C24 | sing | 1.46Å | 1.48Å | |
N2 | C16 | sing | 1.47Å | 1.46Å | |
C24 | C25 | sing | 1.51Å | 1.52Å | |
O2 | C6 | sing | 1.36Å | 1.38Å | |
C6 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
C6 | C5 | sing | 1.39Å | 1.40Å | Aromatic |
C25 | C30 | doub | 1.38Å | 1.41Å | Aromatic |
C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
C7 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
C30 | C29 | sing | 1.38Å | 1.40Å | Aromatic |
C5 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
C26 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
C8 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
C29 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
C4 | C3 | sing | 1.39Å | 1.40Å | Aromatic |
C27 | C28 | sing | 1.38Å | 1.40Å | Aromatic |
C3 | N1 | sing | 1.40Å | 1.42Å | |
N1 | C2 | sing | 1.35Å | 1.38Å | |
O1 | C2 | doub | 1.21Å | 1.22Å | |
C2 | C1 | sing | 1.51Å | 1.52Å | |
N1 | H1 | sing | 0.97Å | 1.00Å | |
C4 | H2 | sing | 1.08Å | 1.08Å | |
C5 | H3 | sing | 1.08Å | 1.08Å | |
C7 | H4 | sing | 1.08Å | 1.08Å | |
C8 | H5 | sing | 1.08Å | 1.08Å | |
C13 | H6 | sing | 1.08Å | 1.08Å | |
C15 | H7 | sing | 1.08Å | 1.08Å | |
C20 | H8 | sing | 1.08Å | 1.08Å | |
C21 | H9 | sing | 1.08Å | 1.08Å | |
C22 | H10 | sing | 1.08Å | 1.08Å | |
C24 | H11 | sing | 1.09Å | 1.10Å | |
C24 | H12 | sing | 1.09Å | 1.10Å | |
C26 | H13 | sing | 1.08Å | 1.08Å | |
C28 | H14 | sing | 1.08Å | 1.08Å | |
C1 | H15 | sing | 1.09Å | 1.10Å | |
C1 | H16 | sing | 1.09Å | 1.10Å | |
C1 | H17 | sing | 1.09Å | 1.10Å | |
N2 | H18 | sing | 0.97Å | 1.00Å | |
O3 | H19 | sing | 0.97Å | 0.95Å | |
C9 | H20 | sing | 1.09Å | 1.10Å | |
C9 | H21 | sing | 1.09Å | 1.10Å | |
C12 | H22 | sing | 1.08Å | 1.08Å | |
C16 | H23 | sing | 1.09Å | 1.10Å | |
C27 | H24 | sing | 1.08Å | 1.08Å | |
C29 | H25 | sing | 1.08Å | 1.08Å | |
C30 | H26 | sing | 1.08Å | 1.08Å | |
C31 | H27 | sing | 1.09Å | 1.10Å | |
C31 | H28 | sing | 1.09Å | 1.10Å | |
C31 | H29 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C21 | C20 | C19 | 119.8° | 120.5° |
C20 | C21 | C22 | 119.1° | 120.7° |
C21 | C20 | H8 | 120.0° | 119.7° |
C20 | C21 | H9 | 120.4° | 119.7° |
C20 | C19 | O3 | 119.8° | 120.3° |
C20 | C19 | C18 | 120.2° | 119.4° |
C19 | C20 | H8 | 120.1° | 119.8° |
O3 | C19 | C18 | 120.0° | 120.3° |
C19 | O3 | H19 | 109.5° | 114.1° |
C21 | C22 | C17 | 120.5° | 119.7° |
C22 | C21 | H9 | 120.4° | 119.6° |
C21 | C22 | H10 | 119.8° | 120.1° |
C19 | C18 | C17 | 120.0° | 119.7° |
C19 | C18 | C23 | 122.1° | 121.9° |
C13 | C12 | C11 | 119.9° | 119.9° |
C12 | C13 | C14 | 120.5° | 120.1° |
C12 | C13 | H6 | 119.7° | 119.9° |
C13 | C12 | H22 | 120.0° | 120.1° |
C12 | C11 | O5 | 120.2° | 120.0° |
C12 | C11 | C10 | 120.7° | 119.9° |
C11 | C12 | H22 | 120.0° | 120.1° |
C31 | O5 | C11 | 117.9° | 117.0° |
O5 | C31 | H27 | 109.5° | 109.5° |
O5 | C31 | H28 | 109.4° | 109.5° |
O5 | C31 | H29 | 109.5° | 109.5° |
O5 | C11 | C10 | 118.9° | 120.1° |
C22 | C17 | C18 | 120.1° | 120.0° |
C22 | C17 | N2 | 122.0° | 121.9° |
C17 | C22 | H10 | 119.7° | 120.1° |
C17 | C18 | C23 | 117.9° | 118.4° |
C18 | C17 | N2 | 117.8° | 118.1° |
C18 | C23 | O4 | 119.3° | 120.3° |
C18 | C23 | N3 | 118.1° | 119.3° |
C13 | C14 | C15 | 117.9° | 120.1° |
C13 | C14 | C16 | 122.8° | 119.9° |
C14 | C13 | H6 | 119.7° | 120.0° |
C11 | C10 | C9 | 118.7° | 120.0° |
C11 | C10 | C15 | 118.5° | 119.9° |
O4 | C23 | N3 | 122.6° | 120.4° |
C17 | N2 | C16 | 118.6° | 118.5° |
C17 | N2 | H18 | 107.1° | 120.7° |
C23 | N3 | C16 | 121.4° | 121.2° |
C23 | N3 | C24 | 120.2° | 119.4° |
C9 | C10 | C15 | 122.8° | 120.1° |
C10 | C9 | O2 | 112.4° | 109.5° |
C10 | C9 | H20 | 108.7° | 109.5° |
C10 | C9 | H21 | 108.7° | 109.5° |
C10 | C15 | C14 | 121.5° | 120.0° |
C10 | C15 | H7 | 119.3° | 120.0° |
C15 | C14 | C16 | 119.1° | 119.9° |
C14 | C15 | H7 | 119.2° | 120.0° |
C14 | C16 | N3 | 113.7° | 109.3° |
C14 | C16 | N2 | 113.1° | 109.3° |
C14 | C16 | H23 | 106.8° | 109.2° |
C9 | O2 | C6 | 123.1° | 117.0° |
O2 | C9 | H20 | 108.7° | 109.4° |
O2 | C9 | H21 | 108.7° | 109.5° |
C16 | N3 | C24 | 117.1° | 119.3° |
N3 | C16 | N2 | 107.5° | 110.3° |
N3 | C16 | H23 | 107.8° | 109.3° |
N3 | C24 | C25 | 117.6° | 109.5° |
N3 | C24 | H11 | 107.4° | 109.5° |
N3 | C24 | H12 | 107.4° | 109.5° |
C16 | N2 | H18 | 107.2° | 120.8° |
N2 | C16 | H23 | 107.7° | 109.4° |
C24 | C25 | C30 | 120.4° | 120.0° |
C24 | C25 | C26 | 119.7° | 120.0° |
C25 | C24 | H11 | 107.4° | 109.4° |
C25 | C24 | H12 | 107.4° | 109.4° |
O2 | C6 | C7 | 118.4° | 120.0° |
O2 | C6 | C5 | 122.3° | 120.0° |
C7 | C6 | C5 | 119.3° | 120.0° |
C6 | C7 | C8 | 120.6° | 120.0° |
C6 | C7 | H4 | 119.7° | 119.9° |
C6 | C5 | C4 | 120.0° | 120.0° |
C6 | C5 | H3 | 120.0° | 120.0° |
C30 | C25 | C26 | 119.1° | 120.0° |
C25 | C30 | C29 | 120.8° | 120.0° |
C25 | C30 | H26 | 119.6° | 120.0° |
C25 | C26 | C27 | 120.0° | 120.0° |
C25 | C26 | H13 | 120.0° | 120.0° |
C7 | C8 | C3 | 120.4° | 120.0° |
C8 | C7 | H4 | 119.7° | 120.0° |
C7 | C8 | H5 | 119.8° | 120.0° |
C30 | C29 | C28 | 119.8° | 120.0° |
C30 | C29 | H25 | 120.1° | 120.0° |
C29 | C30 | H26 | 119.6° | 120.0° |
C5 | C4 | C3 | 121.0° | 120.0° |
C5 | C4 | H2 | 119.5° | 120.0° |
C4 | C5 | H3 | 120.0° | 120.0° |
C26 | C27 | C28 | 120.7° | 120.0° |
C27 | C26 | H13 | 120.0° | 119.9° |
C26 | C27 | H24 | 119.7° | 120.1° |
C8 | C3 | C4 | 118.8° | 119.9° |
C8 | C3 | N1 | 122.2° | 120.1° |
C3 | C8 | H5 | 119.8° | 119.9° |
C29 | C28 | C27 | 119.5° | 120.0° |
C29 | C28 | H14 | 120.2° | 120.0° |
C28 | C29 | H25 | 120.1° | 120.0° |
C4 | C3 | N1 | 119.1° | 120.0° |
C3 | C4 | H2 | 119.5° | 120.0° |
C27 | C28 | H14 | 120.2° | 120.0° |
C28 | C27 | H24 | 119.7° | 119.9° |
C3 | N1 | C2 | 129.6° | 120.0° |
C3 | N1 | H1 | 115.3° | 120.0° |
N1 | C2 | O1 | 123.7° | 120.0° |
N1 | C2 | C1 | 114.4° | 120.0° |
C2 | N1 | H1 | 115.2° | 120.0° |
O1 | C2 | C1 | 121.9° | 120.0° |
C2 | C1 | H15 | 109.5° | 109.5° |
C2 | C1 | H16 | 109.5° | 109.5° |
C2 | C1 | H17 | 109.5° | 109.5° |
H11 | C24 | H12 | 109.4° | 109.4° |
H15 | C1 | H16 | 109.5° | 109.4° |
H15 | C1 | H17 | 109.5° | 109.5° |
H16 | C1 | H17 | 109.4° | 109.5° |
H20 | C9 | H21 | 109.5° | 109.5° |
H27 | C31 | H28 | 109.5° | 109.5° |
H27 | C31 | H29 | 109.5° | 109.4° |
H28 | C31 | H29 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C21 | C20 | C19 | H8 | 180.0° | 179.5° |
C21 | C20 | C19 | O3 | 178.0° | 180.0° |
C20 | C21 | C22 | H9 | 180.0° | 179.5° |
C21 | C20 | C19 | C18 | 0.2° | 0.0° |
C20 | C21 | C22 | C17 | 1.2° | 0.9° |
C20 | C21 | C22 | H10 | 178.8° | 180.0° |
C20 | C19 | O3 | C18 | 178.2° | 180.0° |
C19 | C20 | C21 | C22 | 2.3° | 0.6° |
C20 | C19 | C18 | C17 | 3.0° | 0.2° |
C20 | C19 | C18 | C23 | 174.8° | 178.9° |
C19 | C20 | C21 | H9 | 177.8° | 179.9° |
C20 | C19 | O3 | H19 | 178.6° | 90.0° |
O3 | C19 | C18 | C17 | 178.8° | 179.7° |
O3 | C19 | C18 | C23 | 3.4° | 1.1° |
O3 | C19 | C20 | H8 | 2.0° | 0.5° |
C21 | C22 | C17 | H10 | 180.0° | 179.1° |
C21 | C22 | C17 | C18 | 2.0° | 0.7° |
C21 | C22 | C17 | N2 | 179.1° | 179.8° |
C22 | C21 | C20 | H8 | 177.8° | 179.9° |
C19 | C18 | C17 | C22 | 4.0° | 0.1° |
C19 | C18 | C17 | C23 | 177.9° | 179.2° |
C19 | C18 | C23 | O4 | 15.2° | 13.4° |
C19 | C18 | C17 | N2 | 178.7° | 179.6° |
C19 | C18 | C23 | N3 | 162.7° | 166.7° |
C18 | C19 | C20 | H8 | 179.8° | 179.5° |
C18 | C19 | O3 | H19 | 3.1° | 89.9° |
C13 | C12 | C11 | H22 | 180.0° | 179.8° |
C13 | C12 | C11 | O5 | 168.9° | 179.9° |
C12 | C13 | C14 | H6 | 180.0° | 179.8° |
C13 | C12 | C11 | C10 | 5.8° | 0.0° |
C12 | C13 | C14 | C15 | 7.3° | 0.2° |
C12 | C13 | C14 | C16 | 167.5° | 180.0° |
C12 | C11 | O5 | C31 | 42.6° | 0.1° |
C12 | C11 | O5 | C10 | 174.8° | 179.9° |
C11 | C12 | C13 | C14 | 3.1° | 0.2° |
C12 | C11 | C10 | C9 | 171.3° | 180.0° |
C12 | C11 | C10 | C15 | 10.1° | 0.2° |
C11 | C12 | C13 | H6 | 176.9° | 180.0° |
C31 | O5 | C11 | C10 | 132.2° | 180.0° |
O5 | C31 | H27 | H28 | 120.0° | 120.1° |
O5 | C31 | H27 | H29 | 120.0° | 120.0° |
O5 | C31 | H28 | H29 | 120.0° | 119.9° |
O5 | C11 | C10 | C9 | 13.9° | 0.1° |
O5 | C11 | C10 | C15 | 164.7° | 179.7° |
O5 | C11 | C12 | H22 | 11.1° | 0.3° |
C11 | O5 | C31 | H27 | 180.0° | 179.9° |
C11 | O5 | C31 | H28 | 60.0° | 60.0° |
C11 | O5 | C31 | H29 | 60.0° | 59.9° |
C22 | C17 | C18 | N2 | 177.3° | 179.5° |
C22 | C17 | C18 | C23 | 173.8° | 179.3° |
C22 | C17 | N2 | C16 | 138.6° | 150.3° |
C17 | C22 | C21 | H9 | 178.8° | 179.5° |
C22 | C17 | N2 | H18 | 17.3° | 30.2° |
C17 | C18 | C23 | O4 | 167.0° | 165.8° |
C17 | C18 | C23 | N3 | 15.1° | 14.2° |
C18 | C17 | N2 | C16 | 38.7° | 29.1° |
C18 | C17 | C22 | H10 | 178.0° | 179.8° |
C18 | C17 | N2 | H18 | 160.0° | 150.3° |
C18 | C23 | O4 | N3 | 177.8° | 180.0° |
C23 | C18 | C17 | N2 | 3.5° | 1.2° |
C18 | C23 | N3 | C16 | 0.7° | 3.7° |
C18 | C23 | N3 | C24 | 167.5° | 176.6° |
C13 | C14 | C15 | C10 | 2.9° | 0.0° |
C13 | C14 | C15 | C16 | 175.0° | 179.8° |
C13 | C14 | C16 | N3 | 107.9° | 30.1° |
C13 | C14 | C16 | N2 | 15.1° | 150.9° |
C13 | C14 | C15 | H7 | 177.1° | 179.9° |
C14 | C13 | C12 | H22 | 176.9° | 180.0° |
C13 | C14 | C16 | H23 | 133.3° | 89.5° |
C11 | C10 | C9 | C15 | 178.5° | 179.8° |
C11 | C10 | C15 | C14 | 5.7° | 0.2° |
C11 | C10 | C9 | O2 | 173.0° | 179.7° |
C11 | C10 | C15 | H7 | 174.3° | 179.7° |
C11 | C10 | C9 | H20 | 52.5° | 59.8° |
C11 | C10 | C9 | H21 | 66.6° | 60.2° |
C10 | C11 | C12 | H22 | 174.2° | 179.8° |
O4 | C23 | N3 | C16 | 177.1° | 176.3° |
O4 | C23 | N3 | C24 | 10.3° | 3.4° |
C17 | N2 | C16 | C14 | 75.6° | 76.0° |
C17 | N2 | C16 | N3 | 50.8° | 44.2° |
C17 | N2 | C16 | H18 | 121.3° | 179.4° |
N2 | C17 | C22 | H10 | 0.9° | 0.8° |
C17 | N2 | C16 | H23 | 166.7° | 164.5° |
C23 | N3 | C16 | C14 | 95.2° | 89.0° |
C23 | N3 | C16 | C24 | 167.1° | 179.7° |
C23 | N3 | C16 | N2 | 30.8° | 31.2° |
C23 | N3 | C24 | C25 | 135.2° | 90.3° |
C23 | N3 | C24 | H11 | 14.0° | 29.7° |
C23 | N3 | C24 | H12 | 103.6° | 149.7° |
C23 | N3 | C16 | H23 | 146.6° | 151.5° |
C9 | C10 | C15 | C14 | 175.8° | 180.0° |
C10 | C9 | O2 | H20 | 120.5° | 120.0° |
C10 | C9 | O2 | H21 | 120.4° | 120.0° |
C10 | C9 | O2 | C6 | 103.2° | 180.0° |
C9 | C10 | C15 | H7 | 4.2° | 0.1° |
C10 | C9 | H20 | H21 | 118.7° | 120.0° |
C10 | C15 | C14 | H7 | 180.0° | 179.9° |
C10 | C15 | C14 | C16 | 172.1° | 179.8° |
C15 | C10 | C9 | O2 | 8.5° | 0.1° |
C15 | C10 | C9 | H20 | 128.9° | 120.0° |
C15 | C10 | C9 | H21 | 112.0° | 120.0° |
C15 | C14 | C16 | N3 | 77.3° | 149.7° |
C15 | C14 | C16 | N2 | 159.7° | 28.9° |
C15 | C14 | C13 | H6 | 172.6° | 180.0° |
C15 | C14 | C16 | H23 | 41.4° | 90.7° |
C14 | C16 | N3 | N2 | 126.0° | 120.2° |
C14 | C16 | N3 | H23 | 118.1° | 119.5° |
C14 | C16 | N3 | C24 | 71.9° | 90.7° |
C14 | C16 | N2 | H23 | 117.7° | 119.5° |
C16 | C14 | C13 | H6 | 12.5° | 0.2° |
C16 | C14 | C15 | H7 | 7.9° | 0.3° |
C14 | C16 | N2 | H18 | 45.7° | 104.6° |
C9 | O2 | C6 | C7 | 154.7° | 179.9° |
C9 | O2 | C6 | C5 | 24.7° | 0.1° |
O2 | C9 | H20 | H21 | 118.6° | 120.0° |
N3 | C16 | N2 | H23 | 116.0° | 120.3° |
C16 | N3 | C24 | C25 | 57.5° | 90.0° |
C16 | N3 | C24 | H11 | 178.7° | 150.0° |
C16 | N3 | C24 | H12 | 63.7° | 30.0° |
N3 | C16 | N2 | H18 | 172.0° | 135.2° |
C24 | N3 | C16 | N2 | 162.1° | 149.1° |
N3 | C24 | C25 | H11 | 121.2° | 120.0° |
N3 | C24 | C25 | H12 | 121.2° | 120.1° |
N3 | C24 | C25 | C30 | 129.8° | 89.9° |
N3 | C24 | C25 | C26 | 60.1° | 90.0° |
N3 | C24 | H11 | H12 | 116.3° | 120.1° |
C24 | N3 | C16 | H23 | 46.2° | 28.8° |
C24 | C25 | C30 | C26 | 170.2° | 179.9° |
C24 | C25 | C30 | C29 | 171.0° | 179.9° |
C24 | C25 | C26 | C27 | 169.1° | 180.0° |
C25 | C24 | H11 | H12 | 116.3° | 119.9° |
C24 | C25 | C26 | H13 | 10.9° | 0.3° |
C24 | C25 | C30 | H26 | 9.0° | 0.0° |
O2 | C6 | C7 | C5 | 179.4° | 179.9° |
O2 | C6 | C7 | C8 | 179.5° | 180.0° |
O2 | C6 | C5 | C4 | 179.4° | 180.0° |
O2 | C6 | C5 | H3 | 0.6° | 0.1° |
O2 | C6 | C7 | H4 | 0.5° | 0.1° |
C6 | O2 | C9 | H20 | 136.3° | 60.0° |
C6 | O2 | C9 | H21 | 17.2° | 60.0° |
C6 | C7 | C8 | H4 | 180.0° | 179.9° |
C7 | C6 | C5 | C4 | 0.0° | 0.1° |
C6 | C7 | C8 | C3 | 1.1° | 0.1° |
C7 | C6 | C5 | H3 | 179.9° | 180.0° |
C6 | C7 | C8 | H5 | 178.9° | 180.0° |
C5 | C6 | C7 | C8 | 0.1° | 0.1° |
C6 | C5 | C4 | H3 | 180.0° | 180.0° |
C6 | C5 | C4 | C3 | 1.4° | 0.1° |
C6 | C5 | C4 | H2 | 178.6° | 179.7° |
C5 | C6 | C7 | H4 | 179.9° | 179.9° |
C25 | C30 | C29 | H26 | 180.0° | 179.9° |
C30 | C25 | C26 | C27 | 1.1° | 0.0° |
C25 | C30 | C29 | C28 | 1.9° | 0.2° |
C30 | C25 | C24 | H11 | 109.0° | 30.1° |
C30 | C25 | C24 | H12 | 8.6° | 150.0° |
C30 | C25 | C26 | H13 | 178.9° | 179.7° |
C25 | C30 | C29 | H25 | 178.1° | 179.6° |
C26 | C25 | C30 | C29 | 0.8° | 0.0° |
C25 | C26 | C27 | H13 | 180.0° | 179.7° |
C25 | C26 | C27 | C28 | 2.0° | 0.3° |
C26 | C25 | C24 | H11 | 61.1° | 150.0° |
C26 | C25 | C24 | H12 | 178.7° | 30.1° |
C25 | C26 | C27 | H24 | 178.0° | 179.7° |
C26 | C25 | C30 | H26 | 179.2° | 179.9° |
C7 | C8 | C3 | H5 | 180.0° | 179.9° |
C7 | C8 | C3 | C4 | 2.4° | 0.1° |
C7 | C8 | C3 | N1 | 178.2° | 179.8° |
C30 | C29 | C28 | H25 | 180.0° | 179.9° |
C30 | C29 | C28 | C27 | 1.1° | 0.5° |
C30 | C29 | C28 | H14 | 178.9° | 179.9° |
C5 | C4 | C3 | C8 | 2.6° | 0.1° |
C5 | C4 | C3 | H2 | 180.0° | 179.8° |
C5 | C4 | C3 | N1 | 178.0° | 179.7° |
C26 | C27 | C28 | C29 | 0.8° | 0.6° |
C26 | C27 | C28 | H24 | 180.0° | 180.0° |
C26 | C27 | C28 | H14 | 179.2° | 180.0° |
C8 | C3 | C4 | N1 | 179.4° | 179.7° |
C8 | C3 | N1 | C2 | 29.5° | 145.2° |
C8 | C3 | N1 | H1 | 150.5° | 35.1° |
C8 | C3 | C4 | H2 | 177.4° | 179.7° |
C3 | C8 | C7 | H4 | 178.8° | 180.0° |
C29 | C28 | C27 | H14 | 180.0° | 179.4° |
C29 | C28 | C27 | H24 | 179.2° | 179.5° |
C28 | C29 | C30 | H26 | 178.1° | 179.7° |
C4 | C3 | N1 | C2 | 151.1° | 35.1° |
C4 | C3 | N1 | H1 | 28.9° | 144.6° |
C3 | C4 | C5 | H3 | 178.6° | 180.0° |
C4 | C3 | C8 | H5 | 177.6° | 180.0° |
C28 | C27 | C26 | H13 | 178.0° | 180.0° |
C27 | C28 | C29 | H25 | 178.9° | 179.4° |
C3 | N1 | C2 | H1 | 180.0° | 179.7° |
C3 | N1 | C2 | O1 | 0.7° | 4.3° |
C3 | N1 | C2 | C1 | 178.2° | 175.6° |
N1 | C3 | C4 | H2 | 2.0° | 0.0° |
N1 | C3 | C8 | H5 | 1.8° | 0.3° |
N1 | C2 | O1 | C1 | 178.9° | 180.0° |
N1 | C2 | C1 | H15 | 178.9° | 0.0° |
N1 | C2 | C1 | H16 | 61.0° | 120.0° |
N1 | C2 | C1 | H17 | 58.9° | 120.0° |
O1 | C2 | N1 | H1 | 179.3° | 175.4° |
O1 | C2 | C1 | H15 | 0.0° | 180.0° |
O1 | C2 | C1 | H16 | 120.0° | 60.0° |
O1 | C2 | C1 | H17 | 120.0° | 60.0° |
C1 | C2 | N1 | H1 | 1.8° | 4.6° |
C2 | C1 | H15 | H16 | 120.0° | 120.0° |
C2 | C1 | H15 | H17 | 120.0° | 120.0° |
C2 | C1 | H16 | H17 | 120.0° | 120.0° |
H2 | C4 | C5 | H3 | 1.4° | 0.3° |
H4 | C7 | C8 | H5 | 1.1° | 0.0° |
H6 | C13 | C12 | H22 | 3.1° | 0.2° |
H8 | C20 | C21 | H9 | 2.2° | 0.4° |
H9 | C21 | C22 | H10 | 1.2° | 0.5° |
H13 | C26 | C27 | H24 | 2.0° | 0.0° |
H14 | C28 | C27 | H24 | 0.8° | 0.1° |
H14 | C28 | C29 | H25 | 1.1° | 0.0° |
H15 | C1 | H16 | H17 | 120.0° | 120.0° |
H18 | N2 | C16 | H23 | 72.0° | 14.9° |
H25 | C29 | C30 | H26 | 1.9° | 0.4° |
H27 | C31 | H28 | H29 | 120.0° | 119.9° |