ZDM
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.53Å | 1.47Å | |
O1 | C9 | sing | 1.43Å | 1.45Å | |
C2 | C3 | sing | 1.53Å | 1.41Å | |
C2 | O55 | sing | 1.43Å | 1.46Å | |
C3 | O7 | sing | 1.43Å | 1.50Å | |
C4 | C3 | sing | 1.53Å | 1.48Å | |
C4 | C57 | sing | 1.53Å | 1.47Å | |
C5 | O3 | sing | 1.43Å | 1.43Å | |
C5 | C7 | sing | 1.53Å | 1.45Å | |
O5 | C4 | sing | 1.43Å | 1.49Å | |
C6 | C1 | sing | 1.53Å | 1.51Å | |
C6 | O5 | sing | 1.43Å | 1.39Å | |
O6 | C11 | sing | 1.43Å | 1.35Å | |
C7 | O4 | sing | 1.43Å | 1.47Å | |
O7 | C10 | sing | 1.43Å | 1.41Å | |
C8 | O2 | sing | 1.43Å | 1.45Å | |
C8 | C7 | sing | 1.53Å | 1.40Å | |
C9 | C8 | sing | 1.53Å | 1.48Å | |
C9 | C11 | sing | 1.53Å | 1.48Å | |
C10 | O1 | sing | 1.43Å | 1.39Å | |
C10 | C5 | sing | 1.53Å | 1.50Å | |
O16 | C6 | sing | 1.43Å | 1.42Å | |
C18 | O16 | sing | 1.43Å | 1.43Å | |
C19 | C18 | sing | 1.53Å | 1.52Å | |
C22 | C19 | sing | 1.53Å | 1.54Å | |
C25 | C22 | sing | 1.53Å | 1.56Å | |
C28 | C25 | sing | 1.53Å | 1.48Å | |
C31 | C28 | sing | 1.53Å | 1.45Å | |
C34 | C31 | sing | 1.53Å | 1.49Å | |
C34 | C20 | sing | 1.53Å | 1.54Å | |
O49 | C1 | sing | 1.43Å | 1.43Å | |
O61 | C57 | sing | 1.43Å | 1.40Å | |
C20 | C21 | sing | 1.53Å | 1.54Å | |
C21 | H38 | sing | 1.09Å | 1.10Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
C6 | H6 | sing | 1.09Å | 1.10Å | |
O6 | H101 | sing | 0.97Å | 0.95Å | |
C7 | H7 | sing | 1.09Å | 1.10Å | |
C8 | H8 | sing | 1.09Å | 1.10Å | |
C9 | H9 | sing | 1.09Å | 1.10Å | |
C10 | H10 | sing | 1.09Å | 1.10Å | |
C11 | H11 | sing | 1.09Å | 1.10Å | |
C11 | H16 | sing | 1.09Å | 1.10Å | |
C18 | H18 | sing | 1.09Å | 1.10Å | |
C18 | H18A | sing | 1.09Å | 1.10Å | |
C19 | H19 | sing | 1.09Å | 1.10Å | |
C19 | H19A | sing | 1.09Å | 1.10Å | |
C22 | H22 | sing | 1.09Å | 1.10Å | |
C22 | H20 | sing | 1.09Å | 1.10Å | |
C25 | H25 | sing | 1.09Å | 1.10Å | |
C25 | H221 | sing | 1.09Å | 1.10Å | |
C28 | H28 | sing | 1.09Å | 1.10Å | |
C28 | H28A | sing | 1.09Å | 1.10Å | |
C31 | H31 | sing | 1.09Å | 1.10Å | |
C31 | H26 | sing | 1.09Å | 1.10Å | |
C34 | H34 | sing | 1.09Å | 1.10Å | |
C34 | H34A | sing | 1.09Å | 1.10Å | |
O49 | HO49 | sing | 0.97Å | 0.95Å | |
O55 | HO55 | sing | 0.97Å | 0.95Å | |
C57 | H57 | sing | 1.09Å | 1.10Å | |
C57 | H57A | sing | 1.09Å | 1.10Å | |
O61 | HO61 | sing | 0.97Å | 0.95Å | |
C20 | H341 | sing | 1.09Å | 1.10Å | |
C20 | H35 | sing | 1.09Å | 1.10Å | |
C21 | H36 | sing | 1.09Å | 1.10Å | |
C21 | H37 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C1 | C2 | C3 | 107.6° | 109.0° |
C1 | C2 | O55 | 108.4° | 109.5° |
C2 | C1 | C6 | 110.1° | 109.2° |
C2 | C1 | O49 | 110.4° | 109.5° |
C2 | C1 | H1 | 108.7° | 109.6° |
C1 | C2 | H2 | 112.6° | 109.6° |
O1 | C9 | C8 | 109.9° | 109.4° |
O1 | C9 | C11 | 111.1° | 109.5° |
C9 | O1 | C10 | 113.2° | 114.1° |
O1 | C9 | H9 | 108.2° | 109.5° |
C3 | C2 | O55 | 112.8° | 109.6° |
C2 | C3 | O7 | 117.0° | 109.5° |
C2 | C3 | C4 | 108.8° | 109.2° |
C3 | C2 | H2 | 108.2° | 109.5° |
C2 | C3 | H3 | 103.7° | 109.5° |
O55 | C2 | H2 | 107.4° | 109.6° |
C2 | O55 | HO55 | 109.5° | 114.0° |
O7 | C3 | C4 | 106.2° | 109.5° |
C3 | O7 | C10 | 114.1° | 114.0° |
O7 | C3 | H3 | 106.4° | 109.5° |
C3 | C4 | C57 | 107.7° | 109.5° |
C3 | C4 | O5 | 115.4° | 109.4° |
C4 | C3 | H3 | 115.0° | 109.6° |
C3 | C4 | H4 | 106.5° | 109.5° |
C57 | C4 | O5 | 108.9° | 109.5° |
C4 | C57 | O61 | 113.0° | 109.5° |
C57 | C4 | H4 | 113.4° | 109.4° |
C4 | C57 | H57 | 108.3° | 109.5° |
C4 | C57 | H57A | 108.3° | 109.5° |
O3 | C5 | C7 | 107.2° | 109.5° |
O3 | C5 | C10 | 112.7° | 109.5° |
C5 | O3 | HO3 | 109.5° | 114.0° |
O3 | C5 | H5 | 110.2° | 109.5° |
C5 | C7 | O4 | 109.1° | 109.5° |
C5 | C7 | C8 | 111.1° | 109.0° |
C7 | C5 | C10 | 113.2° | 109.1° |
C7 | C5 | H5 | 109.7° | 109.5° |
C5 | C7 | H7 | 109.6° | 109.6° |
C4 | O5 | C6 | 111.0° | 114.1° |
O5 | C4 | H4 | 105.2° | 109.5° |
C1 | C6 | O5 | 110.3° | 109.4° |
C1 | C6 | O16 | 110.8° | 109.5° |
C6 | C1 | O49 | 110.5° | 109.5° |
C6 | C1 | H1 | 108.7° | 109.5° |
C1 | C6 | H6 | 108.5° | 109.5° |
O5 | C6 | O16 | 110.9° | 109.5° |
O5 | C6 | H6 | 108.4° | 109.5° |
O6 | C11 | C9 | 118.1° | 109.5° |
C11 | O6 | H101 | 109.5° | 114.0° |
O6 | C11 | H11 | 106.7° | 109.5° |
O6 | C11 | H16 | 106.7° | 109.4° |
O4 | C7 | C8 | 112.2° | 109.5° |
C7 | O4 | HO4 | 109.5° | 114.0° |
O4 | C7 | H7 | 108.4° | 109.5° |
O7 | C10 | O1 | 111.5° | 109.5° |
O7 | C10 | C5 | 110.6° | 109.5° |
O7 | C10 | H10 | 109.1° | 109.5° |
O2 | C8 | C7 | 112.8° | 109.5° |
O2 | C8 | C9 | 112.5° | 109.5° |
C8 | O2 | HO2 | 109.5° | 114.0° |
O2 | C8 | H8 | 105.3° | 109.5° |
C7 | C8 | C9 | 110.5° | 109.2° |
C8 | C7 | H7 | 106.3° | 109.7° |
C7 | C8 | H8 | 107.6° | 109.6° |
C8 | C9 | C11 | 109.7° | 109.5° |
C9 | C8 | H8 | 107.8° | 109.6° |
C8 | C9 | H9 | 109.6° | 109.4° |
C11 | C9 | H9 | 108.3° | 109.5° |
C9 | C11 | H11 | 106.7° | 109.5° |
C9 | C11 | H16 | 106.7° | 109.5° |
O1 | C10 | C5 | 114.3° | 109.4° |
O1 | C10 | H10 | 105.0° | 109.5° |
C10 | C5 | H5 | 103.8° | 109.6° |
C5 | C10 | H10 | 106.0° | 109.5° |
C6 | O16 | C18 | 121.5° | 114.0° |
O16 | C6 | H6 | 107.8° | 109.5° |
O16 | C18 | C19 | 118.5° | 109.5° |
O16 | C18 | H18 | 106.6° | 109.5° |
O16 | C18 | H18A | 106.6° | 109.4° |
C18 | C19 | C22 | 118.7° | 109.5° |
C19 | C18 | H18 | 106.6° | 109.5° |
C19 | C18 | H18A | 106.6° | 109.4° |
C18 | C19 | H19 | 106.5° | 109.5° |
C18 | C19 | H19A | 106.5° | 109.4° |
C19 | C22 | C25 | 119.7° | 109.5° |
C22 | C19 | H19 | 106.5° | 109.5° |
C22 | C19 | H19A | 106.5° | 109.5° |
C19 | C22 | H22 | 106.2° | 109.4° |
C19 | C22 | H20 | 106.2° | 109.5° |
C22 | C25 | C28 | 116.9° | 109.5° |
C25 | C22 | H22 | 106.2° | 109.4° |
C25 | C22 | H20 | 106.2° | 109.5° |
C22 | C25 | H25 | 107.0° | 109.4° |
C22 | C25 | H221 | 107.0° | 109.5° |
C25 | C28 | C31 | 121.0° | 109.4° |
C28 | C25 | H25 | 107.1° | 109.5° |
C28 | C25 | H221 | 107.0° | 109.5° |
C25 | C28 | H28 | 105.8° | 109.4° |
C25 | C28 | H28A | 105.8° | 109.5° |
C28 | C31 | C34 | 119.2° | 109.4° |
C31 | C28 | H28 | 105.8° | 109.5° |
C31 | C28 | H28A | 105.8° | 109.5° |
C28 | C31 | H31 | 106.3° | 109.5° |
C28 | C31 | H26 | 106.3° | 109.5° |
C31 | C34 | C20 | 109.5° | 109.4° |
C34 | C31 | H31 | 106.4° | 109.5° |
C34 | C31 | H26 | 106.4° | 109.5° |
C31 | C34 | H34 | 109.5° | 109.5° |
C31 | C34 | H34A | 109.5° | 109.4° |
C34 | C20 | C21 | 109.5° | 109.4° |
C20 | C34 | H34 | 109.4° | 109.5° |
C20 | C34 | H34A | 109.5° | 109.5° |
C34 | C20 | H341 | 109.4° | 109.5° |
C34 | C20 | H35 | 109.4° | 109.5° |
O49 | C1 | H1 | 108.3° | 109.5° |
C1 | O49 | HO49 | 109.5° | 114.0° |
O61 | C57 | H57 | 108.3° | 109.4° |
O61 | C57 | H57A | 108.3° | 109.4° |
C57 | O61 | HO61 | 109.5° | 114.0° |
C20 | C21 | H38 | 109.5° | 109.5° |
C21 | C20 | H341 | 109.5° | 109.4° |
C21 | C20 | H35 | 109.5° | 109.5° |
C20 | C21 | H36 | 109.5° | 109.5° |
C20 | C21 | H37 | 109.5° | 109.5° |
H38 | C21 | H36 | 109.4° | 109.4° |
H38 | C21 | H37 | 109.5° | 109.4° |
H11 | C11 | H16 | 112.1° | 109.5° |
H18 | C18 | H18A | 112.2° | 109.5° |
H19 | C19 | H19A | 112.3° | 109.5° |
H22 | C22 | H20 | 112.6° | 109.5° |
H25 | C25 | H221 | 111.8° | 109.5° |
H28 | C28 | H28A | 112.9° | 109.4° |
H31 | C31 | H26 | 112.4° | 109.5° |
H34 | C34 | H34A | 109.5° | 109.5° |
H57 | C57 | H57A | 110.6° | 109.5° |
H341 | C20 | H35 | 109.5° | 109.4° |
H36 | C21 | H37 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C1 | C2 | C3 | O55 | 119.4° | 119.9° |
C1 | C2 | C3 | H2 | 121.9° | 119.9° |
C1 | C2 | O55 | H2 | 121.9° | 120.3° |
C1 | C2 | C3 | O7 | 179.2° | 176.9° |
C1 | C2 | C3 | C4 | 60.4° | 57.0° |
C2 | C1 | C6 | O49 | 122.3° | 119.9° |
C2 | C1 | C6 | H1 | 119.0° | 119.9° |
C2 | C1 | C6 | O5 | 61.2° | 57.6° |
C2 | C1 | C6 | O16 | 175.5° | 177.6° |
C2 | C1 | O49 | H1 | 118.9° | 120.2° |
C1 | C2 | C3 | H3 | 62.5° | 63.0° |
C2 | C1 | C6 | H6 | 57.3° | 62.4° |
C2 | C1 | O49 | HO49 | 180.0° | 180.0° |
C1 | C2 | O55 | HO55 | 180.0° | 60.0° |
O1 | C9 | C11 | O6 | 44.3° | 65.0° |
C9 | O1 | C10 | O7 | 159.2° | 58.7° |
O1 | C9 | C8 | O2 | 164.8° | 177.6° |
O1 | C9 | C8 | C7 | 68.1° | 57.6° |
O1 | C9 | C8 | C11 | 122.5° | 120.0° |
O1 | C9 | C8 | H9 | 118.7° | 120.0° |
O1 | C9 | C11 | H9 | 118.7° | 120.1° |
C9 | O1 | C10 | C5 | 32.9° | 61.2° |
O1 | C9 | C8 | H8 | 49.2° | 62.3° |
C9 | O1 | C10 | H10 | 82.8° | 178.8° |
O1 | C9 | C11 | H11 | 164.3° | 54.9° |
O1 | C9 | C11 | H16 | 75.7° | 175.0° |
C3 | C2 | O55 | H2 | 119.1° | 120.2° |
C2 | C3 | O7 | C4 | 121.7° | 119.7° |
C2 | C3 | O7 | H3 | 115.3° | 120.1° |
C2 | C3 | C4 | H3 | 115.8° | 120.0° |
C2 | C3 | C4 | C57 | 175.1° | 177.6° |
C2 | C3 | C4 | O5 | 53.3° | 57.6° |
C3 | C2 | C1 | C6 | 65.9° | 57.0° |
C2 | C3 | O7 | C10 | 66.5° | 85.2° |
C3 | C2 | C1 | O49 | 171.8° | 176.9° |
C3 | C2 | C1 | H1 | 53.1° | 62.9° |
C2 | C3 | C4 | H4 | 63.0° | 62.4° |
C3 | C2 | O55 | HO55 | 61.0° | 179.5° |
O55 | C2 | C3 | O7 | 59.8° | 63.2° |
O55 | C2 | C3 | C4 | 179.8° | 176.9° |
O55 | C2 | C1 | C6 | 171.9° | 176.9° |
O55 | C2 | C1 | O49 | 49.5° | 63.2° |
O55 | C2 | C1 | H1 | 69.2° | 57.0° |
O55 | C2 | C3 | H3 | 57.0° | 56.9° |
O7 | C3 | C4 | H3 | 117.4° | 120.2° |
O7 | C3 | C4 | C57 | 58.1° | 62.5° |
O7 | C3 | C4 | O5 | 179.9° | 177.5° |
C3 | O7 | C10 | O1 | 116.8° | 72.4° |
C3 | O7 | C10 | C5 | 114.9° | 167.7° |
O7 | C3 | C2 | H2 | 58.8° | 57.0° |
O7 | C3 | C4 | H4 | 63.8° | 57.4° |
C3 | O7 | C10 | H10 | 1.3° | 47.6° |
C3 | C4 | C57 | O5 | 125.8° | 120.0° |
C3 | C4 | C57 | H4 | 117.5° | 120.0° |
C3 | C4 | O5 | H4 | 117.0° | 120.0° |
C3 | C4 | O5 | C6 | 48.6° | 61.2° |
C4 | C3 | O7 | C10 | 171.7° | 155.1° |
C3 | C4 | C57 | O61 | 171.2° | 175.9° |
C4 | C3 | C2 | H2 | 61.6° | 62.9° |
C3 | C4 | C57 | H57 | 68.8° | 55.9° |
C3 | C4 | C57 | H57A | 51.2° | 64.1° |
C57 | C4 | O5 | H4 | 121.8° | 120.0° |
C57 | C4 | O5 | C6 | 169.7° | 178.9° |
C4 | C57 | O61 | H57 | 120.0° | 120.0° |
C4 | C57 | O61 | H57A | 120.0° | 120.0° |
C57 | C4 | C3 | H3 | 59.3° | 57.6° |
C4 | C57 | H57 | H57A | 118.6° | 120.0° |
C4 | C57 | O61 | HO61 | 180.0° | 180.0° |
O3 | C5 | C7 | C10 | 125.0° | 119.9° |
O3 | C5 | C7 | H5 | 119.6° | 120.1° |
O3 | C5 | C7 | O4 | 118.6° | 63.3° |
O3 | C5 | C10 | O7 | 56.6° | 57.5° |
O3 | C5 | C7 | C8 | 117.1° | 176.9° |
O3 | C5 | C10 | O1 | 70.2° | 177.5° |
O3 | C5 | C10 | H5 | 119.2° | 120.1° |
O3 | C5 | C7 | H7 | 0.1° | 56.9° |
O3 | C5 | C10 | H10 | 174.7° | 62.5° |
C5 | C7 | O4 | C8 | 123.6° | 119.5° |
C5 | C7 | O4 | H7 | 119.3° | 120.2° |
C7 | C5 | C10 | O7 | 178.6° | 62.3° |
C5 | C7 | C8 | O2 | 175.6° | 176.9° |
C5 | C7 | C8 | H7 | 119.2° | 120.0° |
C5 | C7 | C8 | C9 | 48.7° | 57.0° |
C7 | C5 | C10 | O1 | 51.8° | 57.7° |
C7 | C5 | C10 | H5 | 118.9° | 120.0° |
C7 | C5 | O3 | HO3 | 180.0° | 180.0° |
C5 | C7 | O4 | HO4 | 180.0° | 60.0° |
C5 | C7 | C8 | H8 | 68.8° | 63.0° |
C7 | C5 | C10 | H10 | 63.3° | 177.6° |
C4 | O5 | C6 | C1 | 50.3° | 61.1° |
C4 | O5 | C6 | O16 | 173.4° | 178.8° |
O5 | C4 | C57 | O61 | 45.4° | 64.1° |
O5 | C4 | C3 | H3 | 62.4° | 62.4° |
C4 | O5 | C6 | H6 | 68.4° | 58.9° |
O5 | C4 | C57 | H57 | 165.4° | 175.9° |
O5 | C4 | C57 | H57A | 74.6° | 55.8° |
C1 | C6 | O5 | O16 | 123.2° | 120.0° |
C1 | C6 | O5 | H6 | 118.7° | 120.0° |
C1 | C6 | O16 | H6 | 118.6° | 120.1° |
C1 | C6 | O16 | C18 | 92.0° | 175.0° |
C6 | C1 | O49 | H1 | 118.9° | 120.1° |
C6 | C1 | C2 | H2 | 53.2° | 62.9° |
C6 | C1 | O49 | HO49 | 57.9° | 60.3° |
O5 | C6 | O16 | H6 | 118.5° | 120.0° |
O5 | C6 | O16 | C18 | 145.2° | 65.1° |
O5 | C6 | C1 | O49 | 176.4° | 177.5° |
O5 | C6 | C1 | H1 | 57.7° | 62.3° |
C6 | O5 | C4 | H4 | 68.5° | 58.9° |
O6 | C11 | C9 | C8 | 77.4° | 175.1° |
O6 | C11 | C9 | H11 | 120.0° | 120.0° |
O6 | C11 | C9 | H16 | 120.0° | 120.0° |
O6 | C11 | C9 | H9 | 163.0° | 55.1° |
O6 | C11 | H11 | H16 | 116.4° | 120.0° |
O4 | C7 | C8 | O2 | 61.9° | 63.2° |
O4 | C7 | C8 | H7 | 118.3° | 120.2° |
O4 | C7 | C8 | C9 | 171.2° | 176.9° |
O4 | C7 | C5 | C10 | 116.4° | 176.9° |
O4 | C7 | C5 | H5 | 1.0° | 56.8° |
O4 | C7 | C8 | H8 | 53.7° | 56.9° |
O7 | C10 | O1 | C5 | 126.3° | 120.0° |
O7 | C10 | O1 | H10 | 118.0° | 120.1° |
O7 | C10 | C5 | H10 | 118.1° | 120.0° |
C10 | O7 | C3 | H3 | 48.7° | 34.9° |
O7 | C10 | C5 | H5 | 62.6° | 177.7° |
O2 | C8 | C7 | C9 | 126.9° | 119.9° |
O2 | C8 | C7 | H8 | 115.6° | 120.1° |
O2 | C8 | C9 | H8 | 115.7° | 120.1° |
O2 | C8 | C9 | C11 | 42.4° | 62.5° |
O2 | C8 | C7 | H7 | 56.4° | 57.0° |
O2 | C8 | C9 | H9 | 76.4° | 57.6° |
C7 | C8 | C9 | H8 | 117.3° | 120.0° |
C7 | C8 | C9 | C11 | 169.4° | 177.6° |
C8 | C7 | C5 | C10 | 7.8° | 57.0° |
C7 | C8 | O2 | HO2 | 180.0° | 60.0° |
C8 | C7 | O4 | HO4 | 56.4° | 179.5° |
C8 | C7 | C5 | H5 | 123.3° | 63.0° |
C7 | C8 | C9 | H9 | 50.6° | 62.3° |
C8 | C9 | C11 | H9 | 119.6° | 120.0° |
C8 | C9 | O1 | C10 | 23.1° | 61.2° |
C9 | C8 | O2 | HO2 | 54.2° | 179.7° |
C9 | C8 | C7 | H7 | 70.5° | 62.9° |
C8 | C9 | C11 | H11 | 42.6° | 65.0° |
C8 | C9 | C11 | H16 | 162.6° | 55.1° |
C11 | C9 | O1 | C10 | 144.7° | 178.8° |
C9 | C11 | O6 | H101 | 180.0° | 180.0° |
C11 | C9 | C8 | H8 | 73.3° | 57.6° |
C9 | C11 | H11 | H16 | 116.5° | 120.0° |
O1 | C10 | C5 | H10 | 115.1° | 120.0° |
O1 | C10 | C5 | H5 | 170.6° | 62.3° |
C10 | O1 | C9 | H9 | 96.5° | 58.7° |
C10 | C5 | O3 | HO3 | 54.7° | 60.3° |
C10 | C5 | C7 | H7 | 125.1° | 63.0° |
C6 | O16 | C18 | C19 | 173.7° | 180.0° |
O16 | C6 | C1 | O49 | 53.2° | 62.5° |
O16 | C6 | C1 | H1 | 65.5° | 57.7° |
C6 | O16 | C18 | H18 | 66.3° | 60.0° |
C6 | O16 | C18 | H18A | 53.7° | 60.1° |
O16 | C18 | C19 | H18 | 120.0° | 120.1° |
O16 | C18 | C19 | H18A | 120.0° | 119.9° |
O16 | C18 | C19 | C22 | 141.4° | 180.0° |
C18 | O16 | C6 | H6 | 26.6° | 54.9° |
O16 | C18 | H18 | H18A | 116.3° | 120.0° |
O16 | C18 | C19 | H19 | 98.6° | 59.9° |
O16 | C18 | C19 | H19A | 21.4° | 60.0° |
C18 | C19 | C22 | H19 | 120.0° | 120.0° |
C18 | C19 | C22 | H19A | 120.0° | 120.0° |
C18 | C19 | C22 | C25 | 149.5° | 180.0° |
C19 | C18 | H18 | H18A | 116.3° | 120.0° |
C18 | C19 | H19 | H19A | 116.2° | 119.9° |
C18 | C19 | C22 | H22 | 90.5° | 60.0° |
C18 | C19 | C22 | H20 | 29.5° | 60.0° |
C19 | C22 | C25 | H22 | 120.0° | 119.9° |
C19 | C22 | C25 | H20 | 120.0° | 120.0° |
C19 | C22 | C25 | C28 | 175.8° | 180.0° |
C22 | C19 | C18 | H18 | 21.4° | 60.0° |
C22 | C19 | C18 | H18A | 98.6° | 60.0° |
C22 | C19 | H19 | H19A | 116.2° | 120.1° |
C19 | C22 | H22 | H20 | 115.8° | 120.0° |
C19 | C22 | C25 | H25 | 64.2° | 60.0° |
C19 | C22 | C25 | H221 | 55.8° | 60.0° |
C22 | C25 | C28 | H25 | 120.0° | 120.0° |
C22 | C25 | C28 | H221 | 120.0° | 120.0° |
C22 | C25 | C28 | C31 | 149.5° | 180.0° |
C25 | C22 | C19 | H19 | 29.5° | 60.0° |
C25 | C22 | C19 | H19A | 90.5° | 60.0° |
C25 | C22 | H22 | H20 | 115.8° | 120.0° |
C22 | C25 | H25 | H221 | 116.9° | 120.0° |
C22 | C25 | C28 | H28 | 90.5° | 60.0° |
C22 | C25 | C28 | H28A | 29.5° | 60.0° |
C25 | C28 | C31 | H28 | 120.0° | 120.0° |
C25 | C28 | C31 | H28A | 120.0° | 120.0° |
C25 | C28 | C31 | C34 | 119.0° | 180.0° |
C28 | C25 | C22 | H22 | 55.8° | 60.1° |
C28 | C25 | C22 | H20 | 64.2° | 60.0° |
C28 | C25 | H25 | H221 | 116.9° | 120.1° |
C25 | C28 | H28 | H28A | 115.2° | 120.0° |
C25 | C28 | C31 | H31 | 121.0° | 60.0° |
C25 | C28 | C31 | H26 | 1.0° | 60.0° |
C28 | C31 | C34 | H31 | 120.0° | 120.0° |
C28 | C31 | C34 | H26 | 120.0° | 120.0° |
C28 | C31 | C34 | C20 | 168.7° | 180.0° |
C31 | C28 | C25 | H25 | 29.5° | 60.0° |
C31 | C28 | C25 | H221 | 90.5° | 60.0° |
C31 | C28 | H28 | H28A | 115.2° | 120.0° |
C28 | C31 | H31 | H26 | 115.9° | 120.0° |
C28 | C31 | C34 | H34 | 48.8° | 60.0° |
C28 | C31 | C34 | H34A | 71.2° | 60.0° |
C31 | C34 | C20 | H34 | 120.0° | 120.0° |
C31 | C34 | C20 | H34A | 120.0° | 119.9° |
C31 | C34 | C20 | C21 | 150.5° | 180.0° |
C34 | C31 | C28 | H28 | 1.0° | 60.0° |
C34 | C31 | C28 | H28A | 121.0° | 60.0° |
C34 | C31 | H31 | H26 | 116.0° | 120.0° |
C31 | C34 | H34 | H34A | 120.0° | 120.0° |
C31 | C34 | C20 | H341 | 30.5° | 60.0° |
C31 | C34 | C20 | H35 | 89.5° | 60.0° |
C34 | C20 | C21 | H341 | 120.0° | 120.0° |
C34 | C20 | C21 | H35 | 120.0° | 120.0° |
C34 | C20 | C21 | H38 | 180.0° | 180.0° |
C20 | C34 | C31 | H31 | 71.2° | 60.0° |
C20 | C34 | C31 | H26 | 48.8° | 60.0° |
C20 | C34 | H34 | H34A | 120.0° | 120.0° |
C34 | C20 | H341 | H35 | 120.0° | 120.0° |
C34 | C20 | C21 | H36 | 60.0° | 60.0° |
C34 | C20 | C21 | H37 | 60.0° | 60.0° |
O49 | C1 | C2 | H2 | 69.1° | 57.1° |
O49 | C1 | C6 | H6 | 65.0° | 57.6° |
O61 | C57 | C4 | H4 | 71.3° | 55.9° |
O61 | C57 | H57 | H57A | 118.5° | 120.0° |
C20 | C21 | H38 | H36 | 120.0° | 120.0° |
C20 | C21 | H38 | H37 | 120.0° | 120.1° |
C21 | C20 | C34 | H34 | 89.5° | 60.0° |
C21 | C20 | C34 | H34A | 30.5° | 60.0° |
C21 | C20 | H341 | H35 | 120.0° | 120.0° |
C20 | C21 | H36 | H37 | 120.0° | 120.1° |
H38 | C21 | C20 | H341 | 60.1° | 60.0° |
H38 | C21 | C20 | H35 | 60.0° | 60.0° |
H38 | C21 | H36 | H37 | 120.0° | 119.9° |
H1 | C1 | C2 | H2 | 172.2° | 177.2° |
H1 | C1 | C6 | H6 | 176.3° | 177.7° |
H1 | C1 | O49 | HO49 | 61.0° | 59.8° |
H2 | C2 | C3 | H3 | 175.6° | 177.1° |
H2 | C2 | O55 | HO55 | 58.1° | 60.3° |
HO2 | O2 | C8 | H8 | 63.0° | 60.1° |
H3 | C3 | C4 | H4 | 178.8° | 177.6° |
HO3 | O3 | C5 | H5 | 60.7° | 59.9° |
H4 | C4 | C57 | H57 | 48.7° | 64.1° |
H4 | C4 | C57 | H57A | 168.7° | 175.9° |
HO4 | O4 | C7 | H7 | 60.7° | 60.2° |
H5 | C5 | C7 | H7 | 119.5° | 177.0° |
H5 | C5 | C10 | H10 | 55.5° | 57.6° |
H101 | O6 | C11 | H11 | 60.0° | 60.0° |
H101 | O6 | C11 | H16 | 60.0° | 60.0° |
H7 | C7 | C8 | H8 | 172.0° | 177.1° |
H8 | C8 | C9 | H9 | 167.9° | 177.7° |
H9 | C9 | C11 | H11 | 77.0° | 175.0° |
H9 | C9 | C11 | H16 | 43.0° | 64.9° |
H18 | C18 | C19 | H19 | 141.4° | 180.0° |
H18 | C18 | C19 | H19A | 98.6° | 60.0° |
H18A | C18 | C19 | H19 | 21.4° | 60.0° |
H18A | C18 | C19 | H19A | 141.4° | 179.9° |
H19 | C19 | C22 | H22 | 149.5° | 180.0° |
H19 | C19 | C22 | H20 | 90.5° | 60.0° |
H19A | C19 | C22 | H22 | 29.5° | 59.9° |
H19A | C19 | C22 | H20 | 149.5° | 180.0° |
H22 | C22 | C25 | H25 | 175.8° | 179.9° |
H22 | C22 | C25 | H221 | 64.2° | 60.0° |
H20 | C22 | C25 | H25 | 55.8° | 60.0° |
H20 | C22 | C25 | H221 | 175.8° | 180.0° |
H25 | C25 | C28 | H28 | 149.5° | 179.9° |
H25 | C25 | C28 | H28A | 90.4° | 60.0° |
H221 | C25 | C28 | H28 | 29.5° | 60.0° |
H221 | C25 | C28 | H28A | 149.5° | 180.0° |
H28 | C28 | C31 | H31 | 119.0° | 180.0° |
H28 | C28 | C31 | H26 | 121.0° | 60.0° |
H28A | C28 | C31 | H31 | 1.0° | 60.0° |
H28A | C28 | C31 | H26 | 119.0° | 180.0° |
H31 | C31 | C34 | H34 | 168.8° | 180.0° |
H31 | C31 | C34 | H34A | 48.8° | 60.0° |
H26 | C31 | C34 | H34 | 71.2° | 60.0° |
H26 | C31 | C34 | H34A | 168.8° | 180.0° |
H34 | C34 | C20 | H341 | 150.5° | 180.0° |
H34 | C34 | C20 | H35 | 30.5° | 60.0° |
H34A | C34 | C20 | H341 | 89.5° | 60.0° |
H34A | C34 | C20 | H35 | 150.5° | 180.0° |
H57 | C57 | O61 | HO61 | 60.0° | 59.9° |
H57A | C57 | O61 | HO61 | 60.0° | 60.1° |
H341 | C20 | C21 | H36 | 180.0° | 179.9° |
H341 | C20 | C21 | H37 | 60.0° | 60.0° |
H35 | C20 | C21 | H36 | 60.0° | 60.0° |
H35 | C20 | C21 | H37 | 180.0° | 180.0° |