NG0
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C4 | C3 | doub | 1.38Å | 1.53Å | Aromatic |
C4 | C5 | sing | 1.38Å | 1.33Å | Aromatic |
C3 | C2 | sing | 1.39Å | 1.32Å | Aromatic |
C5 | C6 | doub | 1.38Å | 1.53Å | Aromatic |
C2 | O1 | sing | 1.36Å | 1.40Å | |
C2 | C1 | doub | 1.39Å | 1.53Å | Aromatic |
C6 | C1 | sing | 1.38Å | 1.33Å | Aromatic |
C6 | C7 | sing | 1.51Å | 1.56Å | |
C13 | C11 | sing | 1.53Å | 1.52Å | |
C11 | C7 | sing | 1.53Å | 1.52Å | |
C11 | C10 | sing | 1.53Å | 1.56Å | |
C12 | C7 | sing | 1.53Å | 1.54Å | |
C7 | C8 | sing | 1.53Å | 1.53Å | |
C10 | N1 | sing | 1.47Å | 1.46Å | |
C8 | C9 | sing | 1.53Å | 1.55Å | |
N1 | C9 | sing | 1.47Å | 1.44Å | |
N1 | C14 | sing | 1.47Å | 1.47Å | |
C14 | C15 | sing | 1.53Å | 1.54Å | |
C15 | C16 | sing | 1.53Å | 1.53Å | |
C15 | C23 | sing | 1.51Å | 1.52Å | |
C16 | C17 | sing | 1.51Å | 1.56Å | |
C23 | N2 | sing | 1.35Å | 1.45Å | |
C23 | O2 | doub | 1.21Å | 1.18Å | |
N2 | C24 | sing | 1.47Å | 1.46Å | |
C17 | C18 | doub | 1.38Å | 1.32Å | Aromatic |
C17 | C22 | sing | 1.38Å | 1.52Å | Aromatic |
O4 | C25 | doub | 1.21Å | 1.26Å | |
C25 | C24 | sing | 1.51Å | 1.52Å | |
C25 | O3 | sing | 1.34Å | 1.26Å | |
C18 | C19 | sing | 1.38Å | 1.52Å | Aromatic |
C22 | C21 | doub | 1.38Å | 1.32Å | Aromatic |
C21 | C20 | sing | 1.38Å | 1.52Å | Aromatic |
C19 | C20 | doub | 1.38Å | 1.31Å | Aromatic |
C4 | H2 | sing | 1.08Å | 1.08Å | |
C5 | H3 | sing | 1.08Å | 1.08Å | |
C8 | H4 | sing | 1.09Å | 1.10Å | |
C8 | H5 | sing | 1.09Å | 1.10Å | |
C10 | H6 | sing | 1.09Å | 1.10Å | |
C10 | H7 | sing | 1.09Å | 1.10Å | |
C13 | H8 | sing | 1.09Å | 1.10Å | |
C13 | H9 | sing | 1.09Å | 1.10Å | |
C13 | H10 | sing | 1.09Å | 1.10Å | |
C15 | H11 | sing | 1.09Å | 1.10Å | |
C20 | H12 | sing | 1.08Å | 1.08Å | |
C21 | H13 | sing | 1.08Å | 1.08Å | |
C22 | H14 | sing | 1.08Å | 1.08Å | |
C24 | H15 | sing | 1.09Å | 1.10Å | |
C24 | H16 | sing | 1.09Å | 1.10Å | |
C1 | H17 | sing | 1.08Å | 1.08Å | |
C11 | H18 | sing | 1.09Å | 1.10Å | |
C12 | H19 | sing | 1.09Å | 1.10Å | |
C12 | H20 | sing | 1.09Å | 1.10Å | |
C12 | H21 | sing | 1.09Å | 1.10Å | |
C14 | H22 | sing | 1.09Å | 1.10Å | |
C14 | H23 | sing | 1.09Å | 1.10Å | |
C16 | H24 | sing | 1.09Å | 1.10Å | |
C16 | H25 | sing | 1.09Å | 1.10Å | |
C18 | H26 | sing | 1.08Å | 1.08Å | |
C19 | H27 | sing | 1.08Å | 1.08Å | |
C3 | H28 | sing | 1.08Å | 1.08Å | |
C9 | H29 | sing | 1.09Å | 1.10Å | |
C9 | H30 | sing | 1.09Å | 1.10Å | |
N2 | H31 | sing | 0.97Å | 1.00Å | |
O1 | H32 | sing | 0.97Å | 0.95Å | |
O3 | H33 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C3 | C4 | C5 | 119.4° | 120.0° |
C4 | C3 | C2 | 120.2° | 120.0° |
C3 | C4 | H2 | 120.3° | 120.0° |
C4 | C3 | H28 | 119.9° | 120.0° |
C4 | C5 | C6 | 120.6° | 120.2° |
C5 | C4 | H2 | 120.3° | 120.0° |
C4 | C5 | H3 | 119.7° | 120.0° |
C3 | C2 | O1 | 120.4° | 120.0° |
C3 | C2 | C1 | 120.3° | 119.9° |
C2 | C3 | H28 | 119.9° | 120.1° |
C5 | C6 | C1 | 119.3° | 120.0° |
C5 | C6 | C7 | 119.9° | 120.0° |
C6 | C5 | H3 | 119.7° | 119.9° |
O1 | C2 | C1 | 119.3° | 120.1° |
C2 | O1 | H32 | 109.5° | 114.0° |
C2 | C1 | C6 | 120.2° | 120.0° |
C2 | C1 | H17 | 119.9° | 120.0° |
C1 | C6 | C7 | 120.7° | 120.0° |
C6 | C1 | H17 | 119.9° | 120.0° |
C6 | C7 | C11 | 112.9° | 109.5° |
C6 | C7 | C12 | 105.2° | 109.6° |
C6 | C7 | C8 | 110.8° | 109.5° |
C13 | C11 | C7 | 112.6° | 109.5° |
C13 | C11 | C10 | 108.3° | 109.5° |
C11 | C13 | H8 | 109.5° | 109.5° |
C11 | C13 | H9 | 109.5° | 109.4° |
C11 | C13 | H10 | 109.5° | 109.5° |
C13 | C11 | H18 | 108.8° | 109.5° |
C7 | C11 | C10 | 109.9° | 109.3° |
C11 | C7 | C12 | 108.9° | 109.6° |
C11 | C7 | C8 | 109.0° | 109.1° |
C7 | C11 | H18 | 108.8° | 109.5° |
C11 | C10 | N1 | 115.2° | 109.5° |
C11 | C10 | H6 | 108.0° | 109.5° |
C11 | C10 | H7 | 108.0° | 109.4° |
C10 | C11 | H18 | 108.3° | 109.5° |
C12 | C7 | C8 | 110.0° | 109.5° |
C7 | C12 | H19 | 109.5° | 109.4° |
C7 | C12 | H20 | 109.4° | 109.4° |
C7 | C12 | H21 | 109.5° | 109.5° |
C7 | C8 | C9 | 113.3° | 109.3° |
C7 | C8 | H4 | 108.5° | 109.5° |
C7 | C8 | H5 | 108.5° | 109.5° |
C10 | N1 | C9 | 112.6° | 111.2° |
C10 | N1 | C14 | 106.9° | 111.0° |
N1 | C10 | H6 | 108.0° | 109.5° |
N1 | C10 | H7 | 108.0° | 109.4° |
C8 | C9 | N1 | 110.9° | 109.5° |
C9 | C8 | H4 | 108.5° | 109.5° |
C9 | C8 | H5 | 108.5° | 109.5° |
C8 | C9 | H29 | 109.1° | 109.5° |
C8 | C9 | H30 | 109.1° | 109.5° |
C9 | N1 | C14 | 109.3° | 111.0° |
N1 | C9 | H29 | 109.1° | 109.5° |
N1 | C9 | H30 | 109.1° | 109.4° |
N1 | C14 | C15 | 110.0° | 109.4° |
N1 | C14 | H22 | 109.4° | 109.4° |
N1 | C14 | H23 | 109.3° | 109.5° |
C14 | C15 | C16 | 108.7° | 109.4° |
C14 | C15 | C23 | 107.5° | 109.5° |
C14 | C15 | H11 | 108.9° | 109.4° |
C15 | C14 | H22 | 109.3° | 109.5° |
C15 | C14 | H23 | 109.3° | 109.5° |
C16 | C15 | C23 | 113.4° | 109.5° |
C15 | C16 | C17 | 113.6° | 109.5° |
C16 | C15 | H11 | 109.1° | 109.5° |
C15 | C16 | H24 | 108.4° | 109.4° |
C15 | C16 | H25 | 108.4° | 109.4° |
C15 | C23 | N2 | 120.2° | 120.0° |
C15 | C23 | O2 | 120.7° | 120.0° |
C23 | C15 | H11 | 109.2° | 109.5° |
C16 | C17 | C18 | 120.3° | 120.0° |
C16 | C17 | C22 | 119.3° | 120.0° |
C17 | C16 | H24 | 108.4° | 109.5° |
C17 | C16 | H25 | 108.4° | 109.5° |
N2 | C23 | O2 | 119.0° | 120.0° |
C23 | N2 | C24 | 119.6° | 120.0° |
C23 | N2 | H31 | 120.2° | 120.0° |
N2 | C24 | C25 | 108.1° | 109.4° |
N2 | C24 | H15 | 109.8° | 109.5° |
N2 | C24 | H16 | 109.8° | 109.5° |
C24 | N2 | H31 | 120.2° | 120.0° |
C18 | C17 | C22 | 120.4° | 120.0° |
C17 | C18 | C19 | 119.8° | 120.0° |
C17 | C18 | H26 | 120.1° | 120.0° |
C17 | C22 | C21 | 119.9° | 120.1° |
C17 | C22 | H14 | 120.1° | 119.9° |
O4 | C25 | C24 | 119.3° | 120.0° |
O4 | C25 | O3 | 120.0° | 120.0° |
C24 | C25 | O3 | 120.7° | 120.0° |
C25 | C24 | H15 | 109.8° | 109.4° |
C25 | C24 | H16 | 109.8° | 109.4° |
C25 | O3 | H33 | 109.5° | 117.0° |
C18 | C19 | C20 | 119.8° | 120.0° |
C19 | C18 | H26 | 120.0° | 120.0° |
C18 | C19 | H27 | 120.1° | 120.0° |
C22 | C21 | C20 | 119.5° | 120.0° |
C22 | C21 | H13 | 120.3° | 120.0° |
C21 | C22 | H14 | 120.0° | 120.0° |
C21 | C20 | C19 | 120.6° | 120.0° |
C21 | C20 | H12 | 119.7° | 120.0° |
C20 | C21 | H13 | 120.2° | 120.0° |
C19 | C20 | H12 | 119.7° | 120.0° |
C20 | C19 | H27 | 120.1° | 120.0° |
H4 | C8 | H5 | 109.4° | 109.5° |
H6 | C10 | H7 | 109.5° | 109.5° |
H8 | C13 | H9 | 109.5° | 109.4° |
H8 | C13 | H10 | 109.4° | 109.5° |
H9 | C13 | H10 | 109.5° | 109.4° |
H15 | C24 | H16 | 109.5° | 109.5° |
H19 | C12 | H20 | 109.5° | 109.5° |
H19 | C12 | H21 | 109.5° | 109.5° |
H20 | C12 | H21 | 109.5° | 109.6° |
H22 | C14 | H23 | 109.5° | 109.5° |
H24 | C16 | H25 | 109.4° | 109.5° |
H29 | C9 | H30 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C3 | C4 | C5 | H2 | 180.0° | 179.7° |
C4 | C3 | C2 | H28 | 180.0° | 180.0° |
C3 | C4 | C5 | C6 | 0.2° | 0.1° |
C4 | C3 | C2 | O1 | 179.9° | 180.0° |
C4 | C3 | C2 | C1 | 0.1° | 0.0° |
C3 | C4 | C5 | H3 | 179.8° | 180.0° |
C5 | C4 | C3 | C2 | 0.1° | 0.0° |
C4 | C5 | C6 | H3 | 180.0° | 179.9° |
C4 | C5 | C6 | C1 | 0.7° | 0.0° |
C4 | C5 | C6 | C7 | 178.6° | 180.0° |
C5 | C4 | C3 | H28 | 179.9° | 180.0° |
C3 | C2 | O1 | C1 | 179.8° | 179.9° |
C3 | C2 | C1 | C6 | 0.6° | 0.1° |
C2 | C3 | C4 | H2 | 179.9° | 179.7° |
C3 | C2 | C1 | H17 | 179.4° | 180.0° |
C3 | C2 | O1 | H32 | 180.0° | 90.0° |
C5 | C6 | C1 | C2 | 0.9° | 0.0° |
C5 | C6 | C1 | C7 | 177.9° | 180.0° |
C5 | C6 | C7 | C11 | 46.7° | 63.1° |
C5 | C6 | C7 | C12 | 72.0° | 57.1° |
C5 | C6 | C7 | C8 | 169.2° | 177.3° |
C6 | C5 | C4 | H2 | 179.9° | 179.7° |
C5 | C6 | C1 | H17 | 179.2° | 179.9° |
O1 | C2 | C1 | C6 | 179.6° | 180.0° |
O1 | C2 | C1 | H17 | 0.4° | 0.1° |
O1 | C2 | C3 | H28 | 0.1° | 0.0° |
C2 | C1 | C6 | H17 | 180.0° | 179.9° |
C2 | C1 | C6 | C7 | 178.7° | 180.0° |
C1 | C2 | C3 | H28 | 179.9° | 180.0° |
C1 | C2 | O1 | H32 | 0.2° | 90.0° |
C1 | C6 | C7 | C11 | 135.5° | 116.9° |
C1 | C6 | C7 | C12 | 105.9° | 122.9° |
C1 | C6 | C7 | C8 | 13.0° | 2.7° |
C1 | C6 | C5 | H3 | 179.3° | 180.0° |
C6 | C7 | C11 | C13 | 54.1° | 57.6° |
C6 | C7 | C11 | C12 | 116.4° | 120.2° |
C6 | C7 | C11 | C8 | 123.5° | 119.9° |
C6 | C7 | C11 | C10 | 174.9° | 177.5° |
C6 | C7 | C12 | C8 | 119.3° | 120.1° |
C6 | C7 | C8 | C9 | 179.5° | 177.6° |
C7 | C6 | C5 | H3 | 1.4° | 0.0° |
C6 | C7 | C8 | H4 | 59.9° | 57.6° |
C6 | C7 | C8 | H5 | 58.9° | 62.5° |
C7 | C6 | C1 | H17 | 1.3° | 0.1° |
C6 | C7 | C11 | H18 | 66.6° | 62.5° |
C6 | C7 | C12 | H19 | 180.0° | 60.0° |
C6 | C7 | C12 | H20 | 60.0° | 180.0° |
C6 | C7 | C12 | H21 | 60.0° | 59.9° |
C13 | C11 | C7 | C10 | 120.8° | 119.9° |
C13 | C11 | C7 | H18 | 120.7° | 120.1° |
C13 | C11 | C10 | H18 | 117.8° | 120.1° |
C13 | C11 | C7 | C12 | 170.6° | 177.8° |
C13 | C11 | C7 | C8 | 69.4° | 62.3° |
C13 | C11 | C10 | N1 | 71.4° | 60.7° |
C13 | C11 | C10 | H6 | 167.8° | 59.3° |
C13 | C11 | C10 | H7 | 49.5° | 179.3° |
C11 | C13 | H8 | H9 | 120.0° | 119.9° |
C11 | C13 | H8 | H10 | 120.0° | 120.1° |
C11 | C13 | H9 | H10 | 120.0° | 120.0° |
C7 | C11 | C10 | H18 | 118.7° | 120.0° |
C11 | C7 | C12 | C8 | 119.4° | 119.7° |
C7 | C11 | C10 | N1 | 52.1° | 59.2° |
C11 | C7 | C8 | C9 | 55.7° | 57.7° |
C11 | C7 | C8 | H4 | 64.9° | 62.3° |
C11 | C7 | C8 | H5 | 176.3° | 177.6° |
C7 | C11 | C10 | H6 | 68.8° | 179.2° |
C7 | C11 | C10 | H7 | 172.9° | 60.8° |
C7 | C11 | C13 | H8 | 180.0° | 64.7° |
C7 | C11 | C13 | H9 | 60.0° | 175.4° |
C7 | C11 | C13 | H10 | 60.0° | 55.4° |
C11 | C7 | C12 | H19 | 58.7° | 60.2° |
C11 | C7 | C12 | H20 | 178.7° | 59.8° |
C11 | C7 | C12 | H21 | 61.3° | 179.9° |
C10 | C11 | C7 | C12 | 68.6° | 62.3° |
C10 | C11 | C7 | C8 | 51.4° | 57.7° |
C11 | C10 | N1 | H6 | 120.8° | 120.0° |
C11 | C10 | N1 | H7 | 120.9° | 120.0° |
C11 | C10 | N1 | C9 | 53.2° | 61.7° |
C11 | C10 | N1 | C14 | 173.3° | 174.2° |
C11 | C10 | H6 | H7 | 117.4° | 119.9° |
C10 | C11 | C13 | H8 | 58.2° | 55.1° |
C10 | C11 | C13 | H9 | 178.2° | 64.8° |
C10 | C11 | C13 | H10 | 61.8° | 175.2° |
C12 | C7 | C8 | C9 | 63.7° | 62.3° |
C12 | C7 | C8 | H4 | 175.8° | 177.8° |
C12 | C7 | C8 | H5 | 56.9° | 57.6° |
C12 | C7 | C11 | H18 | 49.8° | 57.7° |
C7 | C12 | H19 | H20 | 120.0° | 119.9° |
C7 | C12 | H19 | H21 | 120.0° | 120.0° |
C7 | C12 | H20 | H21 | 120.0° | 120.0° |
C7 | C8 | C9 | H4 | 120.6° | 120.0° |
C7 | C8 | C9 | H5 | 120.6° | 119.9° |
C7 | C8 | C9 | N1 | 56.5° | 59.2° |
C7 | C8 | H4 | H5 | 118.3° | 120.1° |
C8 | C7 | C11 | H18 | 169.9° | 177.6° |
C8 | C7 | C12 | H19 | 60.7° | 179.8° |
C8 | C7 | C12 | H20 | 59.3° | 59.9° |
C8 | C7 | C12 | H21 | 179.3° | 60.2° |
C7 | C8 | C9 | H29 | 176.8° | 60.8° |
C7 | C8 | C9 | H30 | 63.7° | 179.2° |
C10 | N1 | C9 | C8 | 53.3° | 61.7° |
C10 | N1 | C9 | C14 | 118.7° | 124.1° |
C10 | N1 | C14 | C15 | 147.9° | 155.0° |
N1 | C10 | H6 | H7 | 117.4° | 120.0° |
N1 | C10 | C11 | H18 | 170.8° | 179.2° |
C10 | N1 | C14 | H22 | 92.1° | 85.1° |
C10 | N1 | C14 | H23 | 27.8° | 34.9° |
C10 | N1 | C9 | H29 | 173.5° | 58.3° |
C10 | N1 | C9 | H30 | 66.9° | 178.2° |
C8 | C9 | N1 | H29 | 120.2° | 120.0° |
C8 | C9 | N1 | H30 | 120.2° | 120.0° |
C8 | C9 | N1 | C14 | 172.0° | 174.2° |
C9 | C8 | H4 | H5 | 118.2° | 120.0° |
C8 | C9 | H29 | H30 | 119.4° | 120.1° |
C9 | N1 | C14 | C15 | 90.0° | 80.8° |
N1 | C9 | C8 | H4 | 64.0° | 60.8° |
N1 | C9 | C8 | H5 | 177.1° | 179.2° |
C9 | N1 | C10 | H6 | 67.6° | 178.2° |
C9 | N1 | C10 | H7 | 174.1° | 58.2° |
C9 | N1 | C14 | H22 | 30.1° | 39.1° |
C9 | N1 | C14 | H23 | 150.0° | 159.1° |
N1 | C9 | H29 | H30 | 119.4° | 119.9° |
N1 | C14 | C15 | H22 | 120.1° | 120.0° |
N1 | C14 | C15 | H23 | 120.1° | 120.0° |
N1 | C14 | C15 | C16 | 138.3° | 173.7° |
N1 | C14 | C15 | C23 | 98.7° | 66.3° |
C14 | N1 | C10 | H6 | 52.4° | 54.1° |
C14 | N1 | C10 | H7 | 65.9° | 65.9° |
N1 | C14 | C15 | H11 | 19.5° | 53.8° |
N1 | C14 | H22 | H23 | 119.8° | 120.0° |
C14 | N1 | C9 | H29 | 67.8° | 65.8° |
C14 | N1 | C9 | H30 | 51.8° | 54.2° |
C14 | C15 | C16 | C23 | 119.4° | 120.0° |
C14 | C15 | C16 | H11 | 118.6° | 119.9° |
C14 | C15 | C23 | H11 | 118.0° | 120.0° |
C14 | C15 | C16 | C17 | 142.3° | 66.4° |
C14 | C15 | C23 | N2 | 113.1° | 131.6° |
C14 | C15 | C23 | O2 | 64.2° | 48.5° |
C15 | C14 | H22 | H23 | 119.7° | 120.0° |
C14 | C15 | C16 | H24 | 21.7° | 173.6° |
C14 | C15 | C16 | H25 | 97.1° | 53.6° |
C16 | C15 | C23 | H11 | 121.9° | 120.0° |
C15 | C16 | C17 | H24 | 120.6° | 120.0° |
C15 | C16 | C17 | H25 | 120.6° | 120.0° |
C16 | C15 | C23 | N2 | 126.8° | 108.5° |
C16 | C15 | C23 | O2 | 56.0° | 71.5° |
C15 | C16 | C17 | C18 | 72.7° | 82.2° |
C15 | C16 | C17 | C22 | 108.4° | 98.1° |
C16 | C15 | C14 | H22 | 101.6° | 66.3° |
C16 | C15 | C14 | H23 | 18.2° | 53.7° |
C15 | C16 | H24 | H25 | 118.1° | 119.9° |
C23 | C15 | C16 | C17 | 22.9° | 173.6° |
C15 | C23 | N2 | O2 | 177.3° | 180.0° |
C15 | C23 | N2 | C24 | 179.2° | 180.0° |
C23 | C15 | C14 | H22 | 21.4° | 53.7° |
C23 | C15 | C14 | H23 | 141.3° | 173.7° |
C23 | C15 | C16 | H24 | 97.8° | 53.6° |
C23 | C15 | C16 | H25 | 143.5° | 66.4° |
C15 | C23 | N2 | H31 | 0.8° | 0.0° |
C16 | C17 | C18 | C22 | 178.8° | 179.7° |
C16 | C17 | C18 | C19 | 179.9° | 179.7° |
C16 | C17 | C22 | C21 | 179.4° | 179.7° |
C17 | C16 | C15 | H11 | 99.1° | 53.6° |
C16 | C17 | C22 | H14 | 0.7° | 0.3° |
C17 | C16 | H24 | H25 | 118.1° | 120.1° |
C16 | C17 | C18 | H26 | 0.1° | 0.3° |
C23 | N2 | C24 | H31 | 180.0° | 180.0° |
C23 | N2 | C24 | C25 | 165.5° | 180.0° |
N2 | C23 | C15 | H11 | 4.9° | 11.6° |
C23 | N2 | C24 | H15 | 45.7° | 60.1° |
C23 | N2 | C24 | H16 | 74.7° | 60.0° |
O2 | C23 | N2 | C24 | 1.9° | 0.0° |
O2 | C23 | C15 | H11 | 177.9° | 168.4° |
O2 | C23 | N2 | H31 | 178.1° | 180.0° |
N2 | C24 | C25 | O4 | 123.9° | 0.0° |
N2 | C24 | C25 | H15 | 119.8° | 120.0° |
N2 | C24 | C25 | H16 | 119.8° | 120.0° |
N2 | C24 | C25 | O3 | 56.5° | 180.0° |
N2 | C24 | H15 | H16 | 120.6° | 120.1° |
C17 | C18 | C19 | H26 | 180.0° | 180.0° |
C18 | C17 | C22 | C21 | 0.6° | 0.0° |
C17 | C18 | C19 | C20 | 0.9° | 0.0° |
C18 | C17 | C22 | H14 | 179.5° | 180.0° |
C18 | C17 | C16 | H24 | 166.6° | 37.8° |
C18 | C17 | C16 | H25 | 47.9° | 157.8° |
C17 | C18 | C19 | H27 | 179.1° | 180.0° |
C22 | C17 | C18 | C19 | 1.1° | 0.0° |
C17 | C22 | C21 | H14 | 180.0° | 179.9° |
C17 | C22 | C21 | C20 | 0.2° | 0.0° |
C17 | C22 | C21 | H13 | 179.8° | 179.9° |
C22 | C17 | C16 | H24 | 12.2° | 141.9° |
C22 | C17 | C16 | H25 | 130.9° | 21.9° |
C22 | C17 | C18 | H26 | 178.9° | 180.0° |
O4 | C25 | C24 | O3 | 179.6° | 180.0° |
O4 | C25 | C24 | H15 | 4.1° | 120.0° |
O4 | C25 | C24 | H16 | 116.3° | 120.0° |
O4 | C25 | O3 | H33 | 0.0° | 0.0° |
C25 | C24 | H15 | H16 | 120.6° | 120.0° |
C25 | C24 | N2 | H31 | 14.5° | 0.0° |
C24 | C25 | O3 | H33 | 179.5° | 180.0° |
O3 | C25 | C24 | H15 | 176.3° | 60.0° |
O3 | C25 | C24 | H16 | 63.3° | 60.0° |
C18 | C19 | C20 | C21 | 0.2° | 0.0° |
C18 | C19 | C20 | H27 | 180.0° | 180.0° |
C18 | C19 | C20 | H12 | 179.8° | 179.9° |
C22 | C21 | C20 | H13 | 180.0° | 179.9° |
C22 | C21 | C20 | C19 | 0.3° | 0.0° |
C22 | C21 | C20 | H12 | 179.6° | 180.0° |
C21 | C20 | C19 | H12 | 180.0° | 179.9° |
C20 | C21 | C22 | H14 | 179.8° | 180.0° |
C21 | C20 | C19 | H27 | 179.8° | 180.0° |
C19 | C20 | C21 | H13 | 179.6° | 179.9° |
C20 | C19 | C18 | H26 | 179.1° | 180.0° |
H2 | C4 | C5 | H3 | 0.2° | 0.3° |
H2 | C4 | C3 | H28 | 0.1° | 0.3° |
H4 | C8 | C9 | H29 | 56.2° | 179.2° |
H4 | C8 | C9 | H30 | 175.7° | 59.2° |
H5 | C8 | C9 | H29 | 62.6° | 59.1° |
H5 | C8 | C9 | H30 | 56.9° | 60.9° |
H6 | C10 | C11 | H18 | 50.0° | 60.8° |
H7 | C10 | C11 | H18 | 68.4° | 59.2° |
H8 | C13 | H9 | H10 | 120.0° | 120.0° |
H8 | C13 | C11 | H18 | 59.3° | 175.3° |
H9 | C13 | C11 | H18 | 60.7° | 55.3° |
H10 | C13 | C11 | H18 | 179.3° | 64.7° |
H11 | C15 | C14 | H22 | 139.6° | 173.7° |
H11 | C15 | C14 | H23 | 100.6° | 66.3° |
H11 | C15 | C16 | H24 | 140.3° | 66.5° |
H11 | C15 | C16 | H25 | 21.5° | 173.6° |
H12 | C20 | C21 | H13 | 0.4° | 0.1° |
H12 | C20 | C19 | H27 | 0.2° | 0.1° |
H13 | C21 | C22 | H14 | 0.2° | 0.1° |
H15 | C24 | N2 | H31 | 134.3° | 120.0° |
H16 | C24 | N2 | H31 | 105.3° | 119.9° |
H19 | C12 | H20 | H21 | 120.0° | 120.1° |
H26 | C18 | C19 | H27 | 0.9° | 0.0° |