T0H
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C28 | C27 | sing | 1.53Å | 1.52Å | |
C26 | C27 | sing | 1.53Å | 1.52Å | |
C27 | O3 | sing | 1.43Å | 1.44Å | |
C27 | C25 | sing | 1.53Å | 1.53Å | |
C25 | C24 | sing | 1.53Å | 1.52Å | |
C24 | C23 | sing | 1.53Å | 1.53Å | |
C23 | C22 | sing | 1.51Å | 1.50Å | |
C18 | C13 | sing | 1.53Å | 1.54Å | |
C22 | C20 | doub | 1.31Å | 1.30Å | |
C19 | C10 | doub | 1.33Å | 1.32Å | |
C11 | C12 | sing | 1.54Å | 1.53Å | |
C11 | C9 | sing | 1.53Å | 1.53Å | |
C12 | C13 | sing | 1.51Å | 1.54Å | |
C20 | C17 | doub | 1.31Å | 1.30Å | |
C4 | C5 | sing | 1.52Å | 1.51Å | |
C4 | C3 | sing | 1.53Å | 1.52Å | |
C13 | C17 | sing | 1.50Å | 1.52Å | |
C13 | C14 | sing | 1.55Å | 1.56Å | |
C10 | C5 | sing | 1.48Å | 1.47Å | |
C10 | C1 | sing | 1.52Å | 1.51Å | |
O1 | C1 | sing | 1.43Å | 1.42Å | |
C2 | C1 | sing | 1.53Å | 1.52Å | |
C2 | C3 | sing | 1.53Å | 1.52Å | |
C5 | C6 | doub | 1.35Å | 1.36Å | |
C17 | C16 | sing | 1.52Å | 1.52Å | |
C6 | C7 | sing | 1.46Å | 1.43Å | |
C3 | O2 | sing | 1.43Å | 1.43Å | |
C9 | C8 | sing | 1.52Å | 1.50Å | |
C7 | C8 | doub | 1.33Å | 1.33Å | |
C8 | C14 | sing | 1.50Å | 1.52Å | |
C14 | C15 | sing | 1.53Å | 1.54Å | |
C16 | C15 | sing | 1.55Å | 1.53Å | |
O2 | H1 | sing | 0.97Å | 0.95Å | |
C1 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H3 | sing | 1.09Å | 1.10Å | |
C2 | H4 | sing | 1.09Å | 1.10Å | |
C3 | H5 | sing | 1.09Å | 1.10Å | |
C4 | H6 | sing | 1.09Å | 1.10Å | |
C4 | H7 | sing | 1.09Å | 1.10Å | |
C6 | H8 | sing | 1.08Å | 1.08Å | |
C7 | H9 | sing | 1.08Å | 1.08Å | |
C9 | H10 | sing | 1.09Å | 1.10Å | |
C9 | H11 | sing | 1.09Å | 1.10Å | |
C11 | H12 | sing | 1.09Å | 1.10Å | |
C11 | H13 | sing | 1.09Å | 1.10Å | |
C12 | H14 | sing | 1.09Å | 1.10Å | |
C12 | H15 | sing | 1.09Å | 1.10Å | |
C14 | H16 | sing | 1.09Å | 1.10Å | |
C15 | H17 | sing | 1.09Å | 1.10Å | |
C15 | H18 | sing | 1.09Å | 1.10Å | |
C16 | H19 | sing | 1.09Å | 1.10Å | |
C16 | H20 | sing | 1.09Å | 1.10Å | |
C18 | H21 | sing | 1.09Å | 1.10Å | |
C18 | H22 | sing | 1.09Å | 1.10Å | |
C18 | H23 | sing | 1.09Å | 1.10Å | |
C19 | H24 | sing | 1.08Å | 1.08Å | |
C19 | H25 | sing | 1.08Å | 1.08Å | |
C22 | H26 | sing | 1.08Å | 1.08Å | |
C23 | H27 | sing | 1.09Å | 1.10Å | |
C23 | H28 | sing | 1.09Å | 1.10Å | |
C24 | H29 | sing | 1.09Å | 1.10Å | |
C24 | H30 | sing | 1.09Å | 1.10Å | |
C25 | H31 | sing | 1.09Å | 1.10Å | |
C25 | H32 | sing | 1.09Å | 1.10Å | |
O1 | H33 | sing | 0.97Å | 0.95Å | |
C26 | H34 | sing | 1.09Å | 1.10Å | |
C26 | H35 | sing | 1.09Å | 1.10Å | |
C26 | H36 | sing | 1.09Å | 1.10Å | |
C28 | H37 | sing | 1.09Å | 1.10Å | |
C28 | H38 | sing | 1.09Å | 1.10Å | |
C28 | H39 | sing | 1.09Å | 1.10Å | |
O3 | H40 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C28 | C27 | C26 | 110.9° | 109.5° |
C28 | C27 | O3 | 108.0° | 109.5° |
C28 | C27 | C25 | 111.4° | 109.5° |
C27 | C28 | H37 | 109.5° | 109.5° |
C27 | C28 | H38 | 109.4° | 109.5° |
C27 | C28 | H39 | 109.4° | 109.5° |
C26 | C27 | O3 | 107.6° | 109.5° |
C26 | C27 | C25 | 111.4° | 109.5° |
C27 | C26 | H34 | 109.5° | 109.5° |
C27 | C26 | H35 | 109.5° | 109.5° |
C27 | C26 | H36 | 109.5° | 109.5° |
O3 | C27 | C25 | 107.3° | 109.5° |
C27 | O3 | H40 | 109.5° | 114.0° |
C27 | C25 | C24 | 116.5° | 109.5° |
C27 | C25 | H31 | 107.7° | 109.4° |
C27 | C25 | H32 | 107.7° | 109.4° |
C25 | C24 | C23 | 113.0° | 109.5° |
C25 | C24 | H29 | 108.6° | 109.5° |
C25 | C24 | H30 | 108.6° | 109.5° |
C24 | C25 | H31 | 107.7° | 109.5° |
C24 | C25 | H32 | 107.7° | 109.5° |
C24 | C23 | C22 | 112.7° | 109.5° |
C24 | C23 | H27 | 108.6° | 109.5° |
C24 | C23 | H28 | 108.7° | 109.4° |
C23 | C24 | H29 | 108.6° | 109.5° |
C23 | C24 | H30 | 108.6° | 109.5° |
C23 | C22 | C20 | 122.4° | 120.0° |
C23 | C22 | H26 | 118.8° | 120.0° |
C22 | C23 | H27 | 108.7° | 109.5° |
C22 | C23 | H28 | 108.6° | 109.5° |
C18 | C13 | C12 | 111.0° | 109.0° |
C18 | C13 | C17 | 108.6° | 109.1° |
C18 | C13 | C14 | 114.3° | 108.0° |
C13 | C18 | H21 | 109.5° | 109.5° |
C13 | C18 | H22 | 109.4° | 109.5° |
C13 | C18 | H23 | 109.5° | 109.5° |
C22 | C20 | C17 | 167.5° | 180.0° |
C20 | C22 | H26 | 118.8° | 120.0° |
C19 | C10 | C5 | 123.1° | 121.6° |
C19 | C10 | C1 | 120.5° | 121.6° |
C10 | C19 | H24 | 120.0° | 120.0° |
C10 | C19 | H25 | 120.0° | 120.0° |
C12 | C11 | C9 | 111.5° | 111.7° |
C11 | C12 | C13 | 113.3° | 107.7° |
C12 | C11 | H12 | 109.0° | 109.0° |
C12 | C11 | H13 | 109.0° | 109.0° |
C11 | C12 | H14 | 108.5° | 109.8° |
C11 | C12 | H15 | 108.5° | 109.8° |
C11 | C9 | C8 | 109.3° | 110.8° |
C11 | C9 | H10 | 109.5° | 109.2° |
C11 | C9 | H11 | 109.5° | 109.2° |
C9 | C11 | H12 | 109.0° | 109.1° |
C9 | C11 | H13 | 109.0° | 109.0° |
C12 | C13 | C17 | 118.4° | 118.8° |
C12 | C13 | C14 | 102.9° | 107.8° |
C13 | C12 | H14 | 108.5° | 109.9° |
C13 | C12 | H15 | 108.5° | 109.8° |
C20 | C17 | C13 | 130.9° | 127.2° |
C20 | C17 | C16 | 120.1° | 127.2° |
C5 | C4 | C3 | 111.3° | 108.4° |
C4 | C5 | C10 | 114.6° | 116.8° |
C4 | C5 | C6 | 121.2° | 121.6° |
C5 | C4 | H6 | 109.0° | 109.7° |
C5 | C4 | H7 | 109.0° | 109.6° |
C4 | C3 | C2 | 110.0° | 109.8° |
C4 | C3 | O2 | 109.7° | 109.4° |
C4 | C3 | H5 | 108.8° | 109.4° |
C3 | C4 | H6 | 109.0° | 109.7° |
C3 | C4 | H7 | 109.0° | 109.7° |
C17 | C13 | C14 | 101.3° | 103.6° |
C13 | C17 | C16 | 108.9° | 105.6° |
C13 | C14 | C8 | 105.1° | 105.7° |
C13 | C14 | C15 | 101.5° | 100.6° |
C13 | C14 | H16 | 108.9° | 111.1° |
C5 | C10 | C1 | 116.3° | 116.8° |
C10 | C5 | C6 | 123.6° | 121.6° |
C10 | C1 | O1 | 108.5° | 109.7° |
C10 | C1 | C2 | 110.7° | 108.3° |
C10 | C1 | H2 | 108.7° | 109.6° |
O1 | C1 | C2 | 110.6° | 109.7° |
O1 | C1 | H2 | 109.8° | 109.7° |
C1 | O1 | H33 | 109.5° | 114.0° |
C1 | C2 | C3 | 110.4° | 109.8° |
C2 | C1 | H2 | 108.5° | 109.7° |
C1 | C2 | H3 | 109.2° | 109.4° |
C1 | C2 | H4 | 109.2° | 109.4° |
C2 | C3 | O2 | 109.5° | 109.4° |
C3 | C2 | H3 | 109.2° | 109.4° |
C3 | C2 | H4 | 109.3° | 109.4° |
C2 | C3 | H5 | 108.9° | 109.4° |
C5 | C6 | C7 | 127.8° | 120.0° |
C5 | C6 | H8 | 116.1° | 120.0° |
C17 | C16 | C15 | 104.6° | 106.6° |
C17 | C16 | H19 | 110.7° | 110.3° |
C17 | C16 | H20 | 110.7° | 109.7° |
C6 | C7 | C8 | 126.5° | 120.0° |
C7 | C6 | H8 | 116.1° | 120.0° |
C6 | C7 | H9 | 116.8° | 120.0° |
C3 | O2 | H1 | 109.5° | 114.0° |
O2 | C3 | H5 | 110.0° | 109.5° |
C9 | C8 | C7 | 125.7° | 122.4° |
C9 | C8 | C14 | 110.4° | 115.2° |
C8 | C9 | H10 | 109.5° | 109.2° |
C8 | C9 | H11 | 109.5° | 109.2° |
C7 | C8 | C14 | 123.7° | 122.4° |
C8 | C7 | H9 | 116.8° | 120.0° |
C8 | C14 | C15 | 121.7° | 116.4° |
C8 | C14 | H16 | 109.5° | 110.9° |
C14 | C15 | C16 | 102.5° | 102.4° |
C15 | C14 | H16 | 109.2° | 111.5° |
C14 | C15 | H17 | 111.2° | 110.8° |
C14 | C15 | H18 | 111.2° | 110.8° |
C16 | C15 | H17 | 111.2° | 110.8° |
C16 | C15 | H18 | 111.2° | 111.0° |
C15 | C16 | H19 | 110.7° | 110.0° |
C15 | C16 | H20 | 110.7° | 110.1° |
H3 | C2 | H4 | 109.5° | 109.3° |
H6 | C4 | H7 | 109.5° | 109.7° |
H10 | C9 | H11 | 109.5° | 109.2° |
H12 | C11 | H13 | 109.5° | 108.9° |
H14 | C12 | H15 | 109.5° | 109.8° |
H17 | C15 | H18 | 109.5° | 110.7° |
H19 | C16 | H20 | 109.5° | 110.0° |
H21 | C18 | H22 | 109.5° | 109.5° |
H21 | C18 | H23 | 109.5° | 109.5° |
H22 | C18 | H23 | 109.5° | 109.4° |
H24 | C19 | H25 | 120.0° | 120.0° |
H27 | C23 | H28 | 109.5° | 109.5° |
H29 | C24 | H30 | 109.4° | 109.5° |
H31 | C25 | H32 | 109.5° | 109.4° |
H34 | C26 | H35 | 109.5° | 109.5° |
H34 | C26 | H36 | 109.4° | 109.4° |
H35 | C26 | H36 | 109.5° | 109.4° |
H37 | C28 | H38 | 109.5° | 109.5° |
H37 | C28 | H39 | 109.5° | 109.5° |
H38 | C28 | H39 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C28 | C27 | C26 | O3 | 118.0° | 120.1° |
C28 | C27 | C26 | C25 | 124.7° | 120.0° |
C28 | C27 | O3 | C25 | 120.2° | 120.0° |
C28 | C27 | C25 | C24 | 83.9° | 55.0° |
C28 | C27 | C25 | H31 | 155.0° | 175.1° |
C28 | C27 | C25 | H32 | 37.0° | 65.0° |
C28 | C27 | C26 | H34 | 180.0° | 180.0° |
C28 | C27 | C26 | H35 | 60.0° | 60.0° |
C28 | C27 | C26 | H36 | 60.0° | 60.1° |
C27 | C28 | H37 | H38 | 120.0° | 120.0° |
C27 | C28 | H37 | H39 | 120.0° | 120.0° |
C27 | C28 | H38 | H39 | 120.0° | 120.0° |
C28 | C27 | O3 | H40 | 180.0° | 60.0° |
C26 | C27 | O3 | C25 | 120.0° | 120.0° |
C26 | C27 | C25 | C24 | 40.5° | 175.0° |
C26 | C27 | C25 | H31 | 80.6° | 65.0° |
C26 | C27 | C25 | H32 | 161.5° | 54.9° |
C27 | C26 | H34 | H35 | 120.0° | 120.1° |
C27 | C26 | H34 | H36 | 120.0° | 120.0° |
C27 | C26 | H35 | H36 | 120.0° | 120.1° |
C26 | C27 | C28 | H37 | 180.0° | 60.0° |
C26 | C27 | C28 | H38 | 60.0° | 60.0° |
C26 | C27 | C28 | H39 | 60.0° | 180.0° |
C26 | C27 | O3 | H40 | 60.2° | 60.1° |
O3 | C27 | C25 | C24 | 158.0° | 65.0° |
O3 | C27 | C25 | H31 | 37.0° | 55.0° |
O3 | C27 | C25 | H32 | 81.0° | 174.9° |
O3 | C27 | C26 | H34 | 62.0° | 60.0° |
O3 | C27 | C26 | H35 | 177.9° | 180.0° |
O3 | C27 | C26 | H36 | 57.9° | 60.0° |
O3 | C27 | C28 | H37 | 62.3° | 60.0° |
O3 | C27 | C28 | H38 | 57.7° | 180.0° |
O3 | C27 | C28 | H39 | 177.7° | 60.0° |
C27 | C25 | C24 | H31 | 121.0° | 120.0° |
C27 | C25 | C24 | H32 | 121.0° | 120.0° |
C27 | C25 | C24 | C23 | 116.8° | 180.0° |
C27 | C25 | C24 | H29 | 122.7° | 60.0° |
C27 | C25 | C24 | H30 | 3.8° | 60.0° |
C27 | C25 | H31 | H32 | 116.8° | 119.9° |
C25 | C27 | C26 | H34 | 55.3° | 60.0° |
C25 | C27 | C26 | H35 | 64.7° | 60.0° |
C25 | C27 | C26 | H36 | 175.3° | 180.0° |
C25 | C27 | C28 | H37 | 55.3° | 180.0° |
C25 | C27 | C28 | H38 | 175.3° | 60.0° |
C25 | C27 | C28 | H39 | 64.7° | 60.0° |
C25 | C27 | O3 | H40 | 59.8° | 180.0° |
C25 | C24 | C23 | H29 | 120.5° | 120.0° |
C25 | C24 | C23 | H30 | 120.5° | 120.0° |
C25 | C24 | C23 | C22 | 57.9° | 180.0° |
C25 | C24 | C23 | H27 | 178.4° | 60.0° |
C25 | C24 | C23 | H28 | 62.6° | 60.0° |
C25 | C24 | H29 | H30 | 118.4° | 120.0° |
C24 | C25 | H31 | H32 | 116.8° | 120.1° |
C24 | C23 | C22 | H27 | 120.5° | 120.0° |
C24 | C23 | C22 | H28 | 120.5° | 119.9° |
C24 | C23 | C22 | C20 | 85.3° | 125.0° |
C24 | C23 | C22 | H26 | 94.7° | 55.0° |
C24 | C23 | H27 | H28 | 118.5° | 119.9° |
C23 | C24 | H29 | H30 | 118.4° | 120.0° |
C23 | C24 | C25 | H31 | 4.3° | 60.0° |
C23 | C24 | C25 | H32 | 122.3° | 60.0° |
C23 | C22 | C20 | H26 | 180.0° | 180.0° |
C23 | C22 | C20 | C17 | 5.7° | 144.8° |
C22 | C23 | H27 | H28 | 118.5° | 120.1° |
C22 | C23 | C24 | H29 | 62.7° | 60.0° |
C22 | C23 | C24 | H30 | 178.4° | 60.0° |
C18 | C13 | C12 | C11 | 60.8° | 49.1° |
C18 | C13 | C12 | C17 | 126.6° | 125.8° |
C18 | C13 | C12 | C14 | 122.7° | 117.0° |
C18 | C13 | C17 | C20 | 77.9° | 95.8° |
C18 | C13 | C17 | C14 | 120.7° | 114.8° |
C18 | C13 | C17 | C16 | 98.8° | 83.6° |
C18 | C13 | C14 | C8 | 52.1° | 51.4° |
C18 | C13 | C14 | C15 | 75.5° | 70.0° |
C18 | C13 | C12 | H14 | 178.7° | 168.6° |
C18 | C13 | C12 | H15 | 59.8° | 70.5° |
C18 | C13 | C14 | H16 | 169.4° | 171.8° |
C13 | C18 | H21 | H22 | 120.0° | 120.0° |
C13 | C18 | H21 | H23 | 120.0° | 120.0° |
C13 | C18 | H22 | H23 | 120.0° | 120.0° |
C22 | C20 | C17 | C13 | 10.9° | 54.9° |
C22 | C20 | C17 | C16 | 165.4° | 125.9° |
C20 | C22 | C23 | H27 | 35.2° | 115.0° |
C20 | C22 | C23 | H28 | 154.2° | 5.1° |
C19 | C10 | C5 | C4 | 132.9° | 137.0° |
C19 | C10 | C5 | C1 | 176.4° | 179.9° |
C19 | C10 | C1 | O1 | 8.0° | 106.8° |
C19 | C10 | C1 | C2 | 129.5° | 133.4° |
C19 | C10 | C5 | C6 | 38.0° | 43.0° |
C19 | C10 | C1 | H2 | 111.4° | 13.8° |
C10 | C19 | H24 | H25 | 180.0° | 179.9° |
C12 | C11 | C9 | H12 | 120.3° | 120.6° |
C12 | C11 | C9 | H13 | 120.3° | 120.5° |
C11 | C12 | C13 | H14 | 120.6° | 119.6° |
C11 | C12 | C13 | H15 | 120.6° | 119.6° |
C11 | C12 | C13 | C17 | 172.6° | 174.9° |
C11 | C12 | C13 | C14 | 61.9° | 67.9° |
C12 | C11 | C9 | C8 | 49.2° | 48.6° |
C12 | C11 | C9 | H10 | 169.2° | 71.7° |
C12 | C11 | C9 | H11 | 70.7° | 168.9° |
C12 | C11 | H12 | H13 | 119.1° | 118.9° |
C11 | C12 | H14 | H15 | 118.3° | 120.9° |
C9 | C11 | C12 | C13 | 53.5° | 58.9° |
C11 | C9 | C8 | H10 | 120.0° | 120.3° |
C11 | C9 | C8 | H11 | 120.0° | 120.3° |
C11 | C9 | C8 | C7 | 115.1° | 129.6° |
C11 | C9 | C8 | C14 | 60.1° | 50.1° |
C11 | C9 | H10 | H11 | 120.1° | 119.3° |
C9 | C11 | H12 | H13 | 119.1° | 118.9° |
C9 | C11 | C12 | H14 | 67.0° | 60.6° |
C9 | C11 | C12 | H15 | 174.1° | 178.5° |
C12 | C13 | C17 | C20 | 49.8° | 30.0° |
C12 | C13 | C17 | C14 | 111.6° | 119.5° |
C12 | C13 | C17 | C16 | 133.5° | 150.6° |
C12 | C13 | C14 | C8 | 68.3° | 66.2° |
C12 | C13 | C14 | C15 | 164.1° | 172.3° |
C13 | C12 | C11 | H12 | 66.8° | 179.6° |
C13 | C12 | C11 | H13 | 173.8° | 61.6° |
C13 | C12 | H14 | H15 | 118.2° | 120.9° |
C12 | C13 | C14 | H16 | 48.9° | 54.1° |
C12 | C13 | C18 | H21 | 180.0° | 60.7° |
C12 | C13 | C18 | H22 | 60.0° | 179.3° |
C12 | C13 | C18 | H23 | 60.0° | 59.3° |
C20 | C17 | C13 | C16 | 176.7° | 179.4° |
C20 | C17 | C13 | C14 | 161.4° | 149.5° |
C20 | C17 | C16 | C15 | 171.2° | 175.6° |
C20 | C17 | C16 | H19 | 69.6° | 64.9° |
C20 | C17 | C16 | H20 | 52.0° | 56.5° |
C17 | C20 | C22 | H26 | 174.3° | 35.2° |
C5 | C4 | C3 | H6 | 120.3° | 119.7° |
C5 | C4 | C3 | H7 | 120.3° | 119.7° |
C4 | C5 | C10 | C6 | 170.8° | 180.0° |
C4 | C5 | C10 | C1 | 43.6° | 43.1° |
C5 | C4 | C3 | C2 | 56.4° | 57.7° |
C4 | C5 | C6 | C7 | 177.4° | 180.0° |
C5 | C4 | C3 | O2 | 64.1° | 177.8° |
C5 | C4 | C3 | H5 | 175.5° | 62.3° |
C5 | C4 | H6 | H7 | 119.2° | 120.5° |
C4 | C5 | C6 | H8 | 2.6° | 0.0° |
C3 | C4 | C5 | C10 | 47.4° | 46.6° |
C4 | C3 | C2 | C1 | 61.3° | 66.3° |
C4 | C3 | C2 | O2 | 120.6° | 120.1° |
C4 | C3 | C2 | H5 | 119.1° | 120.0° |
C3 | C4 | C5 | C6 | 141.5° | 133.4° |
C4 | C3 | O2 | H5 | 119.7° | 119.8° |
C4 | C3 | O2 | H1 | 180.0° | 59.7° |
C4 | C3 | C2 | H3 | 178.6° | 53.9° |
C4 | C3 | C2 | H4 | 58.8° | 173.6° |
C3 | C4 | H6 | H7 | 119.1° | 120.6° |
C17 | C13 | C14 | C8 | 168.7° | 167.0° |
C17 | C13 | C14 | C15 | 41.1° | 45.5° |
C13 | C17 | C16 | C15 | 5.9° | 5.0° |
C17 | C13 | C12 | H14 | 52.1° | 65.6° |
C17 | C13 | C12 | H15 | 66.8° | 55.3° |
C17 | C13 | C14 | H16 | 74.0° | 72.6° |
C13 | C17 | C16 | H19 | 113.3° | 114.5° |
C13 | C17 | C16 | H20 | 125.1° | 124.2° |
C17 | C13 | C18 | H21 | 48.1° | 168.1° |
C17 | C13 | C18 | H22 | 71.8° | 48.1° |
C17 | C13 | C18 | H23 | 168.2° | 71.9° |
C14 | C13 | C17 | C16 | 22.0° | 31.1° |
C13 | C14 | C8 | C9 | 71.5° | 57.9° |
C13 | C14 | C8 | C7 | 103.9° | 121.9° |
C13 | C14 | C8 | C15 | 114.1° | 110.6° |
C13 | C14 | C8 | H16 | 116.9° | 120.5° |
C13 | C14 | C15 | H16 | 114.9° | 117.8° |
C13 | C14 | C15 | C16 | 45.6° | 41.2° |
C14 | C13 | C12 | H14 | 58.6° | 51.7° |
C14 | C13 | C12 | H15 | 177.5° | 172.6° |
C13 | C14 | C15 | H17 | 73.3° | 77.0° |
C13 | C14 | C15 | H18 | 164.5° | 159.6° |
C14 | C13 | C18 | H21 | 64.2° | 56.2° |
C14 | C13 | C18 | H22 | 175.8° | 63.8° |
C14 | C13 | C18 | H23 | 55.8° | 176.2° |
C5 | C10 | C1 | O1 | 168.5° | 73.1° |
C5 | C10 | C1 | C2 | 47.0° | 46.6° |
C10 | C5 | C6 | C7 | 12.4° | 0.0° |
C5 | C10 | C1 | H2 | 72.1° | 166.3° |
C10 | C5 | C4 | H6 | 72.9° | 73.1° |
C10 | C5 | C4 | H7 | 167.6° | 166.3° |
C10 | C5 | C6 | H8 | 167.6° | 180.0° |
C5 | C10 | C19 | H24 | 176.3° | 0.1° |
C5 | C10 | C19 | H25 | 3.8° | 180.0° |
C10 | C1 | O1 | C2 | 121.5° | 118.9° |
C10 | C1 | O1 | H2 | 118.7° | 120.5° |
C10 | C1 | C2 | H2 | 119.2° | 119.6° |
C10 | C1 | C2 | C3 | 55.4° | 57.7° |
C1 | C10 | C5 | C6 | 145.6° | 136.9° |
C10 | C1 | C2 | H3 | 175.5° | 62.4° |
C10 | C1 | C2 | H4 | 64.7° | 177.8° |
C1 | C10 | C19 | H24 | 0.0° | 180.0° |
C1 | C10 | C19 | H25 | 180.0° | 0.1° |
C10 | C1 | O1 | H33 | 180.0° | 60.6° |
O1 | C1 | C2 | H2 | 120.5° | 120.6° |
O1 | C1 | C2 | C3 | 175.7° | 62.0° |
O1 | C1 | C2 | H3 | 64.2° | 177.8° |
O1 | C1 | C2 | H4 | 55.5° | 58.1° |
C1 | C2 | C3 | H3 | 120.1° | 120.2° |
C1 | C2 | C3 | H4 | 120.1° | 120.1° |
C1 | C2 | C3 | O2 | 59.3° | 173.7° |
C1 | C2 | H3 | H4 | 119.6° | 119.8° |
C1 | C2 | C3 | H5 | 179.6° | 53.7° |
C2 | C1 | O1 | H33 | 58.5° | 179.5° |
C2 | C3 | O2 | H5 | 119.6° | 119.9° |
C2 | C3 | O2 | H1 | 59.2° | 180.0° |
C3 | C2 | C1 | H2 | 63.8° | 177.4° |
C3 | C2 | H3 | H4 | 119.6° | 119.8° |
C2 | C3 | C4 | H6 | 64.0° | 62.0° |
C2 | C3 | C4 | H7 | 176.6° | 177.4° |
C5 | C6 | C7 | H8 | 180.0° | 180.0° |
C5 | C6 | C7 | C8 | 174.2° | 180.0° |
C6 | C5 | C4 | H6 | 98.2° | 106.9° |
C6 | C5 | C4 | H7 | 21.3° | 13.7° |
C5 | C6 | C7 | H9 | 5.8° | 0.0° |
C17 | C16 | C15 | C14 | 31.9° | 23.2° |
C17 | C16 | C15 | H19 | 119.2° | 119.7° |
C17 | C16 | C15 | H20 | 119.2° | 118.9° |
C17 | C16 | C15 | H17 | 87.0° | 95.0° |
C17 | C16 | C15 | H18 | 150.7° | 141.5° |
C17 | C16 | H19 | H20 | 122.3° | 121.2° |
C6 | C7 | C8 | C9 | 4.7° | 0.3° |
C6 | C7 | C8 | H9 | 180.0° | 180.0° |
C6 | C7 | C8 | C14 | 179.3° | 180.0° |
O2 | C3 | C2 | H3 | 60.8° | 66.2° |
O2 | C3 | C2 | H4 | 179.4° | 53.6° |
O2 | C3 | C4 | H6 | 175.6° | 58.1° |
O2 | C3 | C4 | H7 | 56.2° | 62.5° |
C9 | C8 | C7 | C14 | 174.7° | 179.7° |
C9 | C8 | C14 | C15 | 174.4° | 168.5° |
C9 | C8 | C7 | H9 | 175.3° | 179.7° |
C8 | C9 | H10 | H11 | 120.1° | 119.4° |
C8 | C9 | C11 | H12 | 71.1° | 169.2° |
C8 | C9 | C11 | H13 | 169.5° | 71.9° |
C9 | C8 | C14 | H16 | 45.4° | 62.6° |
C7 | C8 | C14 | C15 | 10.2° | 11.2° |
C8 | C7 | C6 | H8 | 5.8° | 0.0° |
C7 | C8 | C9 | H10 | 4.8° | 110.1° |
C7 | C8 | C9 | H11 | 124.9° | 9.3° |
C7 | C8 | C14 | H16 | 139.2° | 117.7° |
C8 | C14 | C15 | H16 | 129.1° | 128.6° |
C8 | C14 | C15 | C16 | 161.6° | 154.8° |
C14 | C8 | C7 | H9 | 0.7° | 0.0° |
C14 | C8 | C9 | H10 | 179.9° | 70.2° |
C14 | C8 | C9 | H11 | 59.8° | 170.4° |
C8 | C14 | C15 | H17 | 42.7° | 36.5° |
C8 | C14 | C15 | H18 | 79.6° | 86.8° |
C14 | C15 | C16 | H17 | 118.9° | 118.2° |
C14 | C15 | C16 | H18 | 118.8° | 118.3° |
C14 | C15 | H17 | H18 | 123.2° | 123.4° |
C14 | C15 | C16 | H19 | 87.3° | 142.9° |
C14 | C15 | C16 | H20 | 151.1° | 95.7° |
C16 | C15 | C14 | H16 | 69.3° | 76.6° |
C16 | C15 | H17 | H18 | 123.3° | 123.6° |
C15 | C16 | H19 | H20 | 122.3° | 121.4° |
H1 | O2 | C3 | H5 | 60.3° | 60.1° |
H2 | C1 | C2 | H3 | 56.3° | 57.2° |
H2 | C1 | C2 | H4 | 176.1° | 62.5° |
H2 | C1 | O1 | H33 | 61.2° | 59.9° |
H3 | C2 | C3 | H5 | 59.5° | 173.9° |
H4 | C2 | C3 | H5 | 60.3° | 66.3° |
H5 | C3 | C4 | H6 | 55.2° | 177.9° |
H5 | C3 | C4 | H7 | 64.2° | 57.3° |
H8 | C6 | C7 | H9 | 174.2° | 180.0° |
H10 | C9 | C11 | H12 | 48.9° | 48.9° |
H10 | C9 | C11 | H13 | 70.5° | 167.7° |
H11 | C9 | C11 | H12 | 169.0° | 70.5° |
H11 | C9 | C11 | H13 | 49.6° | 48.4° |
H12 | C11 | C12 | H14 | 172.6° | 60.0° |
H12 | C11 | C12 | H15 | 53.8° | 60.9° |
H13 | C11 | C12 | H14 | 53.2° | 178.8° |
H13 | C11 | C12 | H15 | 65.6° | 57.9° |
H16 | C14 | C15 | H17 | 171.8° | 165.2° |
H16 | C14 | C15 | H18 | 49.6° | 41.8° |
H17 | C15 | C16 | H19 | 153.8° | 24.7° |
H17 | C15 | C16 | H20 | 32.2° | 146.1° |
H18 | C15 | C16 | H19 | 31.5° | 98.8° |
H18 | C15 | C16 | H20 | 90.1° | 22.6° |
H21 | C18 | H22 | H23 | 120.0° | 120.0° |
H26 | C22 | C23 | H27 | 144.9° | 65.0° |
H26 | C22 | C23 | H28 | 25.8° | 175.0° |
H27 | C23 | C24 | H29 | 57.8° | 180.0° |
H27 | C23 | C24 | H30 | 61.1° | 60.0° |
H28 | C23 | C24 | H29 | 176.9° | 60.0° |
H28 | C23 | C24 | H30 | 57.9° | 180.0° |
H29 | C24 | C25 | H31 | 116.3° | 180.0° |
H29 | C24 | C25 | H32 | 1.7° | 60.0° |
H30 | C24 | C25 | H31 | 124.8° | 60.0° |
H30 | C24 | C25 | H32 | 117.2° | 180.0° |
H34 | C26 | H35 | H36 | 120.0° | 119.9° |
H37 | C28 | H38 | H39 | 120.0° | 120.0° |