921
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C10 | C9 | sing | 1.53Å | 1.53Å | |
C10 | C3 | sing | 1.53Å | 1.52Å | |
C35 | C34 | doub | 1.38Å | 1.38Å | Aromatic |
C35 | C36 | sing | 1.38Å | 1.38Å | Aromatic |
C20 | N19 | sing | 1.46Å | 1.47Å | |
C20 | C21 | sing | 1.51Å | 1.50Å | |
C9 | C7 | sing | 1.53Å | 1.53Å | |
C34 | C33 | sing | 1.38Å | 1.38Å | Aromatic |
N19 | C17 | sing | 1.35Å | 1.37Å | |
N19 | C25 | sing | 1.40Å | 1.44Å | |
C1 | N2 | sing | 1.46Å | 1.46Å | |
C17 | N2 | sing | 1.35Å | 1.35Å | |
C17 | O18 | doub | 1.22Å | 1.21Å | |
C36 | C31 | doub | 1.39Å | 1.38Å | Aromatic |
N2 | C3 | sing | 1.47Å | 1.47Å | |
C3 | C5 | sing | 1.53Å | 1.52Å | |
C21 | C22 | doub | 1.31Å | 1.32Å | |
C37 | C25 | doub | 1.39Å | 1.39Å | Aromatic |
C37 | C29 | sing | 1.39Å | 1.39Å | Aromatic |
C33 | C32 | doub | 1.38Å | 1.38Å | Aromatic |
C7 | C11 | sing | 1.51Å | 1.51Å | |
C7 | C6 | sing | 1.53Å | 1.53Å | |
C25 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
C31 | C32 | sing | 1.39Å | 1.38Å | Aromatic |
C31 | O30 | sing | 1.36Å | 1.39Å | |
C23 | C22 | sing | 1.51Å | 1.50Å | |
C22 | C24 | sing | 1.51Å | 1.50Å | |
C16 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
C16 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
C11 | C12 | sing | 1.39Å | 1.38Å | Aromatic |
C5 | C6 | sing | 1.53Å | 1.51Å | |
O30 | C29 | sing | 1.36Å | 1.39Å | |
C29 | C28 | doub | 1.39Å | 1.38Å | Aromatic |
C15 | N14 | doub | 1.32Å | 1.33Å | Aromatic |
C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
N14 | C13 | sing | 1.32Å | 1.33Å | Aromatic |
C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
C5 | H1 | sing | 1.09Å | 1.10Å | |
C5 | H2 | sing | 1.09Å | 1.10Å | |
C6 | H3 | sing | 1.09Å | 1.10Å | |
C6 | H4 | sing | 1.09Å | 1.10Å | |
C7 | H5 | sing | 1.09Å | 1.10Å | |
C10 | H6 | sing | 1.09Å | 1.10Å | |
C10 | H7 | sing | 1.09Å | 1.10Å | |
C13 | H8 | sing | 1.08Å | 1.08Å | |
C15 | H9 | sing | 1.08Å | 1.08Å | |
C20 | H10 | sing | 1.09Å | 1.10Å | |
C20 | H11 | sing | 1.09Å | 1.10Å | |
C21 | H12 | sing | 1.08Å | 1.08Å | |
C24 | H13 | sing | 1.09Å | 1.10Å | |
C24 | H14 | sing | 1.09Å | 1.10Å | |
C24 | H15 | sing | 1.09Å | 1.10Å | |
C26 | H16 | sing | 1.08Å | 1.08Å | |
C28 | H17 | sing | 1.08Å | 1.08Å | |
C1 | H18 | sing | 1.09Å | 1.10Å | |
C1 | H19 | sing | 1.09Å | 1.10Å | |
C1 | H20 | sing | 1.09Å | 1.10Å | |
C3 | H21 | sing | 1.09Å | 1.10Å | |
C9 | H22 | sing | 1.09Å | 1.10Å | |
C9 | H23 | sing | 1.09Å | 1.10Å | |
C12 | H24 | sing | 1.08Å | 1.08Å | |
C16 | H25 | sing | 1.08Å | 1.08Å | |
C23 | H26 | sing | 1.09Å | 1.10Å | |
C23 | H27 | sing | 1.09Å | 1.10Å | |
C23 | H28 | sing | 1.09Å | 1.10Å | |
C27 | H29 | sing | 1.08Å | 1.08Å | |
C32 | H30 | sing | 1.08Å | 1.08Å | |
C33 | H31 | sing | 1.08Å | 1.08Å | |
C34 | H32 | sing | 1.08Å | 1.08Å | |
C35 | H33 | sing | 1.08Å | 1.08Å | |
C36 | H34 | sing | 1.08Å | 1.08Å | |
C37 | H35 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C9 | C10 | C3 | 108.4° | 109.5° |
C10 | C9 | C7 | 111.6° | 109.5° |
C9 | C10 | H6 | 109.7° | 109.5° |
C9 | C10 | H7 | 109.7° | 109.5° |
C10 | C9 | H22 | 109.0° | 109.5° |
C10 | C9 | H23 | 108.9° | 109.5° |
C10 | C3 | N2 | 118.6° | 109.4° |
C10 | C3 | C5 | 109.9° | 109.5° |
C3 | C10 | H6 | 109.7° | 109.5° |
C3 | C10 | H7 | 109.8° | 109.5° |
C10 | C3 | H21 | 108.0° | 109.5° |
C34 | C35 | C36 | 120.5° | 120.0° |
C35 | C34 | C33 | 119.9° | 120.1° |
C35 | C34 | H32 | 120.0° | 120.0° |
C34 | C35 | H33 | 119.8° | 120.0° |
C35 | C36 | C31 | 119.2° | 120.0° |
C36 | C35 | H33 | 119.8° | 120.0° |
C35 | C36 | H34 | 120.4° | 120.0° |
N19 | C20 | C21 | 109.4° | 109.5° |
C20 | N19 | C17 | 119.2° | 120.0° |
C20 | N19 | C25 | 112.1° | 120.0° |
N19 | C20 | H10 | 109.5° | 109.5° |
N19 | C20 | H11 | 109.5° | 109.5° |
C20 | C21 | C22 | 126.7° | 120.0° |
C21 | C20 | H10 | 109.5° | 109.4° |
C21 | C20 | H11 | 109.5° | 109.4° |
C20 | C21 | H12 | 116.6° | 120.0° |
C9 | C7 | C11 | 113.3° | 109.5° |
C9 | C7 | C6 | 109.7° | 109.4° |
C9 | C7 | H5 | 107.4° | 109.5° |
C7 | C9 | H22 | 108.9° | 109.5° |
C7 | C9 | H23 | 108.9° | 109.5° |
C34 | C33 | C32 | 120.5° | 120.0° |
C34 | C33 | H31 | 119.8° | 120.0° |
C33 | C34 | H32 | 120.0° | 119.9° |
C17 | N19 | C25 | 115.8° | 120.0° |
N19 | C17 | N2 | 117.0° | 120.0° |
N19 | C17 | O18 | 121.7° | 120.0° |
N19 | C25 | C37 | 119.9° | 120.1° |
N19 | C25 | C26 | 120.6° | 120.1° |
C1 | N2 | C17 | 122.1° | 120.0° |
C1 | N2 | C3 | 118.5° | 120.0° |
N2 | C1 | H18 | 109.5° | 109.5° |
N2 | C1 | H19 | 109.5° | 109.5° |
N2 | C1 | H20 | 109.5° | 109.5° |
N2 | C17 | O18 | 121.2° | 120.0° |
C17 | N2 | C3 | 119.4° | 120.0° |
C36 | C31 | C32 | 120.7° | 119.8° |
C36 | C31 | O30 | 119.3° | 120.1° |
C31 | C36 | H34 | 120.4° | 120.0° |
N2 | C3 | C5 | 103.4° | 109.5° |
N2 | C3 | H21 | 108.5° | 109.4° |
C3 | C5 | C6 | 109.0° | 109.5° |
C3 | C5 | H1 | 109.6° | 109.5° |
C3 | C5 | H2 | 109.6° | 109.5° |
C5 | C3 | H21 | 107.9° | 109.5° |
C21 | C22 | C23 | 123.0° | 120.0° |
C21 | C22 | C24 | 122.4° | 120.0° |
C22 | C21 | H12 | 116.7° | 119.9° |
C25 | C37 | C29 | 119.3° | 119.9° |
C37 | C25 | C26 | 119.5° | 119.9° |
C25 | C37 | H35 | 120.4° | 120.0° |
C37 | C29 | O30 | 120.7° | 120.0° |
C37 | C29 | C28 | 121.3° | 120.0° |
C29 | C37 | H35 | 120.3° | 120.1° |
C33 | C32 | C31 | 119.2° | 120.0° |
C33 | C32 | H30 | 120.4° | 120.0° |
C32 | C33 | H31 | 119.8° | 120.0° |
C11 | C7 | C6 | 111.1° | 109.5° |
C7 | C11 | C16 | 121.2° | 120.8° |
C7 | C11 | C12 | 120.9° | 120.8° |
C11 | C7 | H5 | 107.6° | 109.5° |
C7 | C6 | C5 | 111.0° | 109.5° |
C7 | C6 | H3 | 109.1° | 109.5° |
C7 | C6 | H4 | 109.1° | 109.4° |
C6 | C7 | H5 | 107.4° | 109.5° |
C25 | C26 | C27 | 120.1° | 120.1° |
C25 | C26 | H16 | 120.0° | 120.0° |
C32 | C31 | O30 | 120.0° | 120.0° |
C31 | C32 | H30 | 120.4° | 120.0° |
C31 | O30 | C29 | 119.5° | 118.0° |
C23 | C22 | C24 | 114.6° | 120.0° |
C22 | C23 | H26 | 109.5° | 109.5° |
C22 | C23 | H27 | 109.5° | 109.5° |
C22 | C23 | H28 | 109.5° | 109.5° |
C22 | C24 | H13 | 109.5° | 109.4° |
C22 | C24 | H14 | 109.5° | 109.5° |
C22 | C24 | H15 | 109.5° | 109.5° |
C11 | C16 | C15 | 118.9° | 119.2° |
C16 | C11 | C12 | 117.9° | 118.4° |
C11 | C16 | H25 | 120.5° | 120.5° |
C16 | C15 | N14 | 123.7° | 120.7° |
C16 | C15 | H9 | 118.1° | 119.6° |
C15 | C16 | H25 | 120.5° | 120.4° |
C11 | C12 | C13 | 119.1° | 119.1° |
C11 | C12 | H24 | 120.5° | 120.4° |
C6 | C5 | H1 | 109.6° | 109.5° |
C6 | C5 | H2 | 109.6° | 109.5° |
C5 | C6 | H3 | 109.1° | 109.5° |
C5 | C6 | H4 | 109.1° | 109.5° |
O30 | C29 | C28 | 118.0° | 120.0° |
C29 | C28 | C27 | 119.2° | 120.1° |
C29 | C28 | H17 | 120.4° | 120.0° |
C15 | N14 | C13 | 116.7° | 121.7° |
N14 | C15 | H9 | 118.1° | 119.6° |
C12 | C13 | N14 | 123.7° | 120.8° |
C12 | C13 | H8 | 118.2° | 119.6° |
C13 | C12 | H24 | 120.5° | 120.5° |
C26 | C27 | C28 | 120.7° | 120.1° |
C27 | C26 | H16 | 119.9° | 120.0° |
C26 | C27 | H29 | 119.7° | 120.0° |
N14 | C13 | H8 | 118.2° | 119.6° |
C27 | C28 | H17 | 120.4° | 119.9° |
C28 | C27 | H29 | 119.7° | 120.0° |
H1 | C5 | H2 | 109.5° | 109.4° |
H3 | C6 | H4 | 109.5° | 109.4° |
H6 | C10 | H7 | 109.5° | 109.4° |
H10 | C20 | H11 | 109.4° | 109.5° |
H13 | C24 | H14 | 109.5° | 109.5° |
H13 | C24 | H15 | 109.4° | 109.5° |
H14 | C24 | H15 | 109.5° | 109.5° |
H18 | C1 | H19 | 109.5° | 109.5° |
H18 | C1 | H20 | 109.4° | 109.4° |
H19 | C1 | H20 | 109.5° | 109.4° |
H22 | C9 | H23 | 109.5° | 109.4° |
H26 | C23 | H27 | 109.4° | 109.5° |
H26 | C23 | H28 | 109.5° | 109.4° |
H27 | C23 | H28 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C9 | C10 | C3 | H6 | 119.8° | 120.0° |
C9 | C10 | C3 | H7 | 119.8° | 120.0° |
C10 | C9 | C7 | H22 | 120.3° | 120.0° |
C10 | C9 | C7 | H23 | 120.3° | 120.0° |
C9 | C10 | C3 | N2 | 179.8° | 180.0° |
C9 | C10 | C3 | C5 | 61.3° | 60.0° |
C10 | C9 | C7 | C11 | 179.6° | 180.0° |
C10 | C9 | C7 | C6 | 55.6° | 60.0° |
C10 | C9 | C7 | H5 | 60.9° | 60.0° |
C9 | C10 | H6 | H7 | 120.5° | 120.0° |
C9 | C10 | C3 | H21 | 56.3° | 60.1° |
C10 | C9 | H22 | H23 | 119.0° | 120.0° |
C3 | C10 | C9 | C7 | 58.3° | 60.0° |
C10 | C3 | N2 | C1 | 63.7° | 60.0° |
C10 | C3 | N2 | C17 | 119.8° | 120.0° |
C10 | C3 | N2 | C5 | 121.9° | 120.0° |
C10 | C3 | N2 | H21 | 123.6° | 119.9° |
C10 | C3 | C5 | H21 | 117.6° | 120.0° |
C10 | C3 | C5 | C6 | 62.3° | 60.0° |
C10 | C3 | C5 | H1 | 177.7° | 60.0° |
C10 | C3 | C5 | H2 | 57.6° | 180.0° |
C3 | C10 | H6 | H7 | 120.5° | 120.0° |
C3 | C10 | C9 | H22 | 178.6° | 60.0° |
C3 | C10 | C9 | H23 | 62.1° | 180.0° |
C34 | C35 | C36 | H33 | 180.0° | 179.7° |
C35 | C34 | C33 | H32 | 180.0° | 180.0° |
C34 | C35 | C36 | C31 | 0.1° | 0.6° |
C35 | C34 | C33 | C32 | 0.3° | 0.0° |
C35 | C34 | C33 | H31 | 179.7° | 179.9° |
C34 | C35 | C36 | H34 | 179.8° | 180.0° |
C36 | C35 | C34 | C33 | 0.3° | 0.3° |
C35 | C36 | C31 | H34 | 180.0° | 179.4° |
C35 | C36 | C31 | C32 | 0.1° | 0.6° |
C35 | C36 | C31 | O30 | 179.8° | 179.7° |
C36 | C35 | C34 | H32 | 179.7° | 179.7° |
N19 | C20 | C21 | H10 | 120.0° | 120.0° |
N19 | C20 | C21 | H11 | 120.0° | 120.0° |
C20 | N19 | C17 | C25 | 138.5° | 179.9° |
C20 | N19 | C17 | N2 | 160.8° | 2.2° |
C20 | N19 | C17 | O18 | 22.8° | 177.8° |
N19 | C20 | C21 | C22 | 111.4° | 129.2° |
C20 | N19 | C25 | C37 | 73.7° | 171.8° |
C20 | N19 | C25 | C26 | 106.3° | 8.1° |
N19 | C20 | H10 | H11 | 120.0° | 120.0° |
N19 | C20 | C21 | H12 | 68.6° | 50.7° |
C21 | C20 | N19 | C17 | 68.8° | 97.9° |
C21 | C20 | N19 | C25 | 71.1° | 82.0° |
C20 | C21 | C22 | H12 | 180.0° | 179.9° |
C20 | C21 | C22 | C23 | 0.2° | 176.3° |
C20 | C21 | C22 | C24 | 179.8° | 3.7° |
C21 | C20 | H10 | H11 | 120.0° | 119.9° |
C9 | C7 | C11 | C6 | 124.1° | 120.0° |
C9 | C7 | C11 | H5 | 118.6° | 120.0° |
C9 | C7 | C6 | H5 | 116.5° | 120.0° |
C9 | C7 | C11 | C16 | 106.2° | 60.0° |
C9 | C7 | C11 | C12 | 75.6° | 120.0° |
C9 | C7 | C6 | C5 | 55.9° | 60.0° |
C9 | C7 | C6 | H3 | 176.1° | 60.0° |
C9 | C7 | C6 | H4 | 64.4° | 180.0° |
C7 | C9 | C10 | H6 | 178.1° | 60.0° |
C7 | C9 | C10 | H7 | 61.6° | 180.0° |
C7 | C9 | H22 | H23 | 119.0° | 120.0° |
C34 | C33 | C32 | H31 | 180.0° | 179.9° |
C34 | C33 | C32 | C31 | 0.3° | 0.1° |
C34 | C33 | C32 | H30 | 179.7° | 180.0° |
C33 | C34 | C35 | H33 | 179.7° | 180.0° |
N19 | C17 | N2 | C1 | 1.5° | 14.3° |
N19 | C17 | N2 | O18 | 176.4° | 179.9° |
N19 | C17 | N2 | C3 | 174.9° | 165.7° |
C17 | N19 | C25 | C37 | 145.0° | 8.3° |
C17 | N19 | C25 | C26 | 35.1° | 171.8° |
C17 | N19 | C20 | H10 | 51.2° | 22.1° |
C17 | N19 | C20 | H11 | 171.2° | 142.1° |
C25 | N19 | C17 | N2 | 60.7° | 177.7° |
C25 | N19 | C17 | O18 | 115.7° | 2.3° |
N19 | C25 | C37 | C26 | 180.0° | 179.9° |
N19 | C25 | C37 | C29 | 180.0° | 179.9° |
N19 | C25 | C26 | C27 | 179.4° | 179.9° |
C25 | N19 | C20 | H10 | 168.9° | 158.0° |
C25 | N19 | C20 | H11 | 48.9° | 38.0° |
N19 | C25 | C26 | H16 | 0.6° | 0.2° |
N19 | C25 | C37 | H35 | 0.0° | 0.2° |
C1 | N2 | C17 | C3 | 176.4° | 180.0° |
C1 | N2 | C17 | O18 | 177.9° | 165.7° |
C1 | N2 | C3 | C5 | 58.2° | 60.0° |
N2 | C1 | H18 | H19 | 120.0° | 120.1° |
N2 | C1 | H18 | H20 | 120.0° | 120.0° |
N2 | C1 | H19 | H20 | 120.0° | 120.0° |
C1 | N2 | C3 | H21 | 172.7° | 180.0° |
C17 | N2 | C3 | C5 | 118.3° | 120.0° |
C17 | N2 | C1 | H18 | 180.0° | 95.7° |
C17 | N2 | C1 | H19 | 60.0° | 144.3° |
C17 | N2 | C1 | H20 | 60.0° | 24.3° |
C17 | N2 | C3 | H21 | 3.9° | 0.1° |
O18 | C17 | N2 | C3 | 1.5° | 14.2° |
C36 | C31 | C32 | C33 | 0.1° | 0.2° |
C36 | C31 | C32 | O30 | 179.7° | 179.8° |
C36 | C31 | O30 | C29 | 133.2° | 174.8° |
C36 | C31 | C32 | H30 | 179.9° | 179.7° |
C31 | C36 | C35 | H33 | 179.8° | 179.7° |
N2 | C3 | C5 | H21 | 114.9° | 120.0° |
N2 | C3 | C5 | C6 | 170.2° | 180.0° |
N2 | C3 | C5 | H1 | 50.2° | 60.0° |
N2 | C3 | C5 | H2 | 69.9° | 60.0° |
N2 | C3 | C10 | H6 | 60.3° | 60.0° |
N2 | C3 | C10 | H7 | 60.0° | 60.0° |
C3 | N2 | C1 | H18 | 3.6° | 84.4° |
C3 | N2 | C1 | H19 | 116.5° | 35.6° |
C3 | N2 | C1 | H20 | 123.5° | 155.6° |
C3 | C5 | C6 | C7 | 59.4° | 60.0° |
C3 | C5 | C6 | H1 | 119.9° | 120.0° |
C3 | C5 | C6 | H2 | 119.9° | 120.1° |
C3 | C5 | H1 | H2 | 120.2° | 120.0° |
C3 | C5 | C6 | H3 | 179.6° | 60.1° |
C3 | C5 | C6 | H4 | 60.9° | 180.0° |
C5 | C3 | C10 | H6 | 178.9° | 60.0° |
C5 | C3 | C10 | H7 | 58.6° | 180.0° |
C21 | C22 | C23 | C24 | 179.7° | 180.0° |
C22 | C21 | C20 | H10 | 128.6° | 110.7° |
C22 | C21 | C20 | H11 | 8.6° | 9.2° |
C21 | C22 | C24 | H13 | 180.0° | 90.5° |
C21 | C22 | C24 | H14 | 60.0° | 149.5° |
C21 | C22 | C24 | H15 | 60.0° | 29.5° |
C21 | C22 | C23 | H26 | 180.0° | 90.0° |
C21 | C22 | C23 | H27 | 60.0° | 150.0° |
C21 | C22 | C23 | H28 | 60.0° | 29.9° |
C25 | C37 | C29 | H35 | 180.0° | 179.9° |
C25 | C37 | C29 | O30 | 179.8° | 179.6° |
C25 | C37 | C29 | C28 | 0.4° | 0.3° |
C37 | C25 | C26 | C27 | 0.6° | 0.0° |
C37 | C25 | C26 | H16 | 179.4° | 179.7° |
C29 | C37 | C25 | C26 | 0.0° | 0.0° |
C37 | C29 | O30 | C31 | 58.1° | 76.5° |
C37 | C29 | O30 | C28 | 179.4° | 179.4° |
C37 | C29 | C28 | C27 | 0.2° | 0.6° |
C37 | C29 | C28 | H17 | 179.8° | 180.0° |
C33 | C32 | C31 | H30 | 180.0° | 180.0° |
C33 | C32 | C31 | O30 | 179.9° | 180.0° |
C32 | C33 | C34 | H32 | 179.6° | 180.0° |
C11 | C7 | C6 | H5 | 117.5° | 120.0° |
C7 | C11 | C16 | C12 | 178.3° | 180.0° |
C7 | C11 | C16 | C15 | 179.1° | 179.7° |
C11 | C7 | C6 | C5 | 178.1° | 180.0° |
C7 | C11 | C12 | C13 | 179.3° | 179.9° |
C11 | C7 | C6 | H3 | 57.8° | 60.0° |
C11 | C7 | C6 | H4 | 61.7° | 60.0° |
C11 | C7 | C9 | H22 | 59.3° | 60.0° |
C11 | C7 | C9 | H23 | 60.1° | 60.0° |
C7 | C11 | C12 | H24 | 0.7° | 0.0° |
C7 | C11 | C16 | H25 | 0.9° | 0.0° |
C6 | C7 | C11 | C16 | 129.7° | 60.0° |
C6 | C7 | C11 | C12 | 48.5° | 120.0° |
C7 | C6 | C5 | H3 | 120.2° | 120.0° |
C7 | C6 | C5 | H4 | 120.2° | 120.0° |
C7 | C6 | C5 | H1 | 179.3° | 60.0° |
C7 | C6 | C5 | H2 | 60.6° | 179.9° |
C7 | C6 | H3 | H4 | 119.4° | 120.0° |
C6 | C7 | C9 | H22 | 175.9° | 60.0° |
C6 | C7 | C9 | H23 | 64.7° | 180.0° |
C25 | C26 | C27 | H16 | 180.0° | 179.7° |
C25 | C26 | C27 | C28 | 0.8° | 0.3° |
C25 | C26 | C27 | H29 | 179.2° | 179.7° |
C26 | C25 | C37 | H35 | 180.0° | 179.9° |
C32 | C31 | O30 | C29 | 47.1° | 5.4° |
C31 | C32 | C33 | H31 | 179.7° | 180.0° |
C32 | C31 | C36 | H34 | 179.9° | 180.0° |
C31 | O30 | C29 | C28 | 122.5° | 104.1° |
O30 | C31 | C32 | H30 | 0.1° | 0.0° |
O30 | C31 | C36 | H34 | 0.2° | 0.3° |
C23 | C22 | C21 | H12 | 179.9° | 3.6° |
C23 | C22 | C24 | H13 | 0.3° | 89.5° |
C23 | C22 | C24 | H14 | 120.3° | 30.5° |
C23 | C22 | C24 | H15 | 119.7° | 150.5° |
C22 | C23 | H26 | H27 | 120.0° | 120.0° |
C22 | C23 | H26 | H28 | 120.0° | 120.0° |
C22 | C23 | H27 | H28 | 120.0° | 120.0° |
C24 | C22 | C21 | H12 | 0.2° | 176.4° |
C22 | C24 | H13 | H14 | 120.0° | 120.0° |
C22 | C24 | H13 | H15 | 120.0° | 120.0° |
C22 | C24 | H14 | H15 | 120.0° | 120.0° |
C24 | C22 | C23 | H26 | 0.3° | 90.0° |
C24 | C22 | C23 | H27 | 119.7° | 30.0° |
C24 | C22 | C23 | H28 | 120.3° | 150.0° |
C11 | C16 | C15 | H25 | 180.0° | 179.7° |
C11 | C16 | C15 | N14 | 0.3° | 0.3° |
C16 | C11 | C12 | C13 | 1.0° | 0.0° |
C16 | C11 | C7 | H5 | 12.4° | 180.0° |
C11 | C16 | C15 | H9 | 179.7° | 179.8° |
C16 | C11 | C12 | H24 | 179.0° | 180.0° |
C15 | C16 | C11 | C12 | 0.8° | 0.3° |
C16 | C15 | N14 | H9 | 180.0° | 180.0° |
C16 | C15 | N14 | C13 | 0.2° | 0.0° |
C11 | C12 | C13 | H24 | 180.0° | 180.0° |
C11 | C12 | C13 | N14 | 0.5° | 0.2° |
C12 | C11 | C7 | H5 | 165.8° | 0.0° |
C11 | C12 | C13 | H8 | 179.5° | 180.0° |
C12 | C11 | C16 | H25 | 179.2° | 180.0° |
C6 | C5 | H1 | H2 | 120.2° | 120.0° |
C5 | C6 | H3 | H4 | 119.3° | 120.0° |
C5 | C6 | C7 | H5 | 60.6° | 60.0° |
C6 | C5 | C3 | H21 | 55.3° | 60.1° |
O30 | C29 | C28 | C27 | 179.6° | 179.9° |
O30 | C29 | C28 | H17 | 0.4° | 0.6° |
O30 | C29 | C37 | H35 | 0.2° | 0.3° |
C29 | C28 | C27 | C26 | 0.4° | 0.6° |
C29 | C28 | C27 | H17 | 180.0° | 179.4° |
C29 | C28 | C27 | H29 | 179.6° | 179.4° |
C28 | C29 | C37 | H35 | 179.6° | 179.6° |
C15 | N14 | C13 | C12 | 0.1° | 0.2° |
C15 | N14 | C13 | H8 | 179.9° | 180.0° |
N14 | C15 | C16 | H25 | 179.8° | 180.0° |
C12 | C13 | N14 | H8 | 180.0° | 179.8° |
C26 | C27 | C28 | H29 | 180.0° | 180.0° |
C26 | C27 | C28 | H17 | 179.6° | 180.0° |
C13 | N14 | C15 | H9 | 179.8° | 180.0° |
N14 | C13 | C12 | H24 | 179.5° | 179.8° |
C28 | C27 | C26 | H16 | 179.2° | 180.0° |
H1 | C5 | C6 | H3 | 60.5° | 180.0° |
H1 | C5 | C6 | H4 | 59.0° | 60.0° |
H1 | C5 | C3 | H21 | 64.7° | 180.0° |
H2 | C5 | C6 | H3 | 59.6° | 60.0° |
H2 | C5 | C6 | H4 | 179.2° | 59.9° |
H2 | C5 | C3 | H21 | 175.2° | 60.0° |
H3 | C6 | C7 | H5 | 59.6° | 180.0° |
H4 | C6 | C7 | H5 | 179.2° | 60.0° |
H5 | C7 | C9 | H22 | 59.5° | 180.0° |
H5 | C7 | C9 | H23 | 178.8° | 60.0° |
H6 | C10 | C3 | H21 | 63.6° | 179.9° |
H6 | C10 | C9 | H22 | 61.6° | 180.0° |
H6 | C10 | C9 | H23 | 57.8° | 60.0° |
H7 | C10 | C3 | H21 | 176.1° | 59.9° |
H7 | C10 | C9 | H22 | 58.7° | 60.0° |
H7 | C10 | C9 | H23 | 178.1° | 59.9° |
H8 | C13 | C12 | H24 | 0.5° | 0.0° |
H9 | C15 | C16 | H25 | 0.2° | 0.1° |
H10 | C20 | C21 | H12 | 51.4° | 69.3° |
H11 | C20 | C21 | H12 | 171.4° | 170.7° |
H13 | C24 | H14 | H15 | 119.9° | 120.0° |
H16 | C26 | C27 | H29 | 0.8° | 0.0° |
H17 | C28 | C27 | H29 | 0.4° | 0.0° |
H18 | C1 | H19 | H20 | 120.0° | 119.9° |
H26 | C23 | H27 | H28 | 120.0° | 120.0° |
H30 | C32 | C33 | H31 | 0.2° | 0.1° |
H31 | C33 | C34 | H32 | 0.4° | 0.1° |
H32 | C34 | C35 | H33 | 0.3° | 0.0° |
H33 | C35 | C36 | H34 | 0.2° | 0.3° |