0AS
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O28 | C28 | doub | 1.21Å | 1.25Å | |
O29 | C28 | sing | 1.34Å | 1.25Å | |
C28 | C17 | sing | 1.51Å | 1.55Å | |
C26 | C8 | sing | 1.54Å | 1.55Å | |
C25 | C10 | sing | 1.52Å | 1.54Å | |
C24 | C4 | sing | 1.53Å | 1.54Å | |
C6 | C7 | sing | 1.54Å | 1.54Å | |
C6 | C5 | sing | 1.53Å | 1.55Å | |
C17 | C22 | sing | 1.53Å | 1.54Å | |
C17 | C18 | sing | 1.53Å | 1.56Å | |
C17 | C16 | sing | 1.52Å | 1.55Å | |
C8 | C7 | sing | 1.52Å | 1.56Å | |
C8 | C9 | sing | 1.52Å | 1.58Å | |
C8 | C14 | sing | 1.54Å | 1.56Å | |
C10 | C9 | sing | 1.53Å | 1.56Å | |
C10 | C5 | sing | 1.52Å | 1.57Å | |
C10 | C1 | sing | 1.54Å | 1.55Å | |
C22 | C21 | sing | 1.53Å | 1.54Å | |
C11 | C12 | sing | 1.50Å | 1.39Å | |
C11 | C9 | sing | 1.53Å | 1.56Å | |
C12 | C13 | doub | 1.31Å | 1.40Å | |
C15 | C16 | sing | 1.53Å | 1.54Å | |
C15 | C14 | sing | 1.52Å | 1.54Å | |
C18 | C13 | sing | 1.52Å | 1.56Å | |
C18 | C19 | sing | 1.52Å | 1.56Å | |
C13 | C14 | sing | 1.50Å | 1.57Å | |
C5 | C4 | sing | 1.51Å | 1.57Å | |
C4 | C23 | sing | 1.55Å | 1.54Å | |
C4 | C3 | sing | 1.53Å | 1.55Å | |
C14 | C27 | sing | 1.54Å | 1.55Å | |
C2 | C1 | sing | 1.53Å | 1.54Å | |
C2 | C3 | sing | 1.52Å | 1.54Å | |
C2 | O2 | sing | 1.44Å | 1.43Å | |
C23 | O23 | sing | 1.43Å | 1.43Å | |
O3 | C3 | sing | 1.43Å | 1.43Å | |
C21 | C20 | sing | 1.53Å | 1.54Å | |
C19 | C29 | sing | 1.53Å | 1.54Å | |
C19 | C20 | sing | 1.53Å | 1.55Å | |
C20 | C30 | sing | 1.53Å | 1.54Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
C3 | H3 | sing | 1.10Å | 1.10Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
C1 | H11 | sing | 1.09Å | 1.10Å | |
C1 | H12A | sing | 1.09Å | 1.10Å | |
C25 | H251 | sing | 1.09Å | 1.10Å | |
C25 | H252 | sing | 1.09Å | 1.10Å | |
C25 | H253 | sing | 1.09Å | 1.10Å | |
C9 | H9 | sing | 1.11Å | 1.10Å | |
C11 | H111 | sing | 1.10Å | 1.10Å | |
C11 | H112 | sing | 1.09Å | 1.10Å | |
C12 | H12 | sing | 1.08Å | 1.08Å | |
C18 | H18 | sing | 1.10Å | 1.10Å | |
C19 | H19 | sing | 1.09Å | 1.10Å | |
C29 | H291 | sing | 1.09Å | 1.10Å | |
C29 | H292 | sing | 1.09Å | 1.10Å | |
C29 | H293 | sing | 1.09Å | 1.10Å | |
C20 | H20 | sing | 1.09Å | 1.10Å | |
C30 | H301 | sing | 1.09Å | 1.10Å | |
C30 | H302 | sing | 1.09Å | 1.10Å | |
C30 | H303 | sing | 1.09Å | 1.10Å | |
C21 | H211 | sing | 1.09Å | 1.10Å | |
C21 | H212 | sing | 1.09Å | 1.10Å | |
C22 | H221 | sing | 1.09Å | 1.10Å | |
C22 | H222 | sing | 1.09Å | 1.10Å | |
O29 | HO29 | sing | 0.97Å | 0.95Å | |
C16 | H161 | sing | 1.09Å | 1.10Å | |
C16 | H162 | sing | 1.10Å | 1.10Å | |
C15 | H151 | sing | 1.11Å | 1.10Å | |
C15 | H152 | sing | 1.08Å | 1.10Å | |
C27 | H271 | sing | 1.09Å | 1.10Å | |
C27 | H272 | sing | 1.09Å | 1.10Å | |
C27 | H273 | sing | 1.09Å | 1.10Å | |
C26 | H261 | sing | 1.09Å | 1.10Å | |
C26 | H262 | sing | 1.09Å | 1.10Å | |
C26 | H263 | sing | 1.09Å | 1.10Å | |
C7 | H71 | sing | 1.09Å | 1.10Å | |
C7 | H72 | sing | 1.09Å | 1.10Å | |
C6 | H61 | sing | 1.09Å | 1.10Å | |
C6 | H62 | sing | 1.08Å | 1.10Å | |
C5 | H5 | sing | 1.12Å | 1.10Å | |
C24 | H241 | sing | 1.09Å | 1.10Å | |
C24 | H242 | sing | 1.09Å | 1.10Å | |
C24 | H243 | sing | 1.09Å | 1.10Å | |
C23 | H231 | sing | 1.09Å | 1.10Å | |
C23 | H232 | sing | 1.09Å | 1.10Å | |
O23 | HO23 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O28 | C28 | O29 | 124.8° | 120.0° |
O28 | C28 | C17 | 118.1° | 120.0° |
O29 | C28 | C17 | 117.0° | 120.0° |
C28 | O29 | HO29 | 109.5° | 117.0° |
C28 | C17 | C22 | 108.1° | 107.8° |
C28 | C17 | C18 | 109.8° | 109.0° |
C28 | C17 | C16 | 108.1° | 109.7° |
C26 | C8 | C7 | 106.4° | 108.1° |
C26 | C8 | C9 | 113.2° | 109.9° |
C26 | C8 | C14 | 109.9° | 106.9° |
C8 | C26 | H261 | 109.5° | 109.4° |
C8 | C26 | H262 | 109.5° | 109.4° |
C8 | C26 | H263 | 109.4° | 109.5° |
C25 | C10 | C9 | 111.3° | 111.5° |
C25 | C10 | C5 | 112.8° | 112.5° |
C25 | C10 | C1 | 109.1° | 108.0° |
C10 | C25 | H251 | 109.5° | 109.5° |
C10 | C25 | H252 | 109.4° | 109.5° |
C10 | C25 | H253 | 109.5° | 109.5° |
C24 | C4 | C5 | 112.6° | 112.9° |
C24 | C4 | C23 | 106.0° | 106.9° |
C24 | C4 | C3 | 110.6° | 110.0° |
C4 | C24 | H241 | 109.5° | 109.5° |
C4 | C24 | H242 | 109.5° | 109.5° |
C4 | C24 | H243 | 109.5° | 109.5° |
C7 | C6 | C5 | 109.3° | 107.4° |
C6 | C7 | C8 | 113.8° | 111.1° |
C6 | C7 | H71 | 108.0° | 107.0° |
C6 | C7 | H72 | 107.1° | 108.2° |
C7 | C6 | H61 | 109.5° | 107.9° |
C7 | C6 | H62 | 109.6° | 110.3° |
C6 | C5 | C10 | 112.3° | 109.3° |
C6 | C5 | C4 | 114.4° | 113.1° |
C5 | C6 | H61 | 109.5° | 110.1° |
C5 | C6 | H62 | 109.5° | 112.1° |
C6 | C5 | H5 | 106.7° | 105.6° |
C22 | C17 | C18 | 111.3° | 110.5° |
C22 | C17 | C16 | 108.0° | 110.5° |
C17 | C22 | C21 | 111.8° | 110.6° |
C17 | C22 | H221 | 108.7° | 109.4° |
C17 | C22 | H222 | 108.2° | 109.1° |
C18 | C17 | C16 | 111.3° | 109.3° |
C17 | C18 | C13 | 110.4° | 108.7° |
C17 | C18 | C19 | 117.2° | 110.9° |
C17 | C18 | H18 | 103.7° | 108.6° |
C17 | C16 | C15 | 112.5° | 111.0° |
C17 | C16 | H161 | 108.4° | 110.0° |
C17 | C16 | H162 | 107.8° | 108.8° |
C7 | C8 | C9 | 110.6° | 112.8° |
C7 | C8 | C14 | 108.9° | 110.1° |
C8 | C7 | H71 | 108.1° | 112.3° |
C8 | C7 | H72 | 107.0° | 109.4° |
C9 | C8 | C14 | 107.8° | 108.9° |
C8 | C9 | C10 | 117.3° | 115.2° |
C8 | C9 | C11 | 113.3° | 109.7° |
C8 | C9 | H9 | 101.6° | 108.5° |
C8 | C14 | C15 | 109.5° | 110.9° |
C8 | C14 | C13 | 107.4° | 110.8° |
C8 | C14 | C27 | 110.8° | 107.6° |
C9 | C10 | C5 | 106.8° | 108.4° |
C9 | C10 | C1 | 108.2° | 107.8° |
C10 | C9 | C11 | 112.6° | 111.0° |
C10 | C9 | H9 | 102.6° | 105.3° |
C5 | C10 | C1 | 108.4° | 108.5° |
C10 | C5 | C4 | 116.5° | 116.0° |
C10 | C5 | H5 | 104.0° | 105.6° |
C10 | C1 | C2 | 113.1° | 109.6° |
C10 | C1 | H11 | 108.3° | 109.0° |
C10 | C1 | H12A | 107.4° | 109.0° |
C22 | C21 | C20 | 112.4° | 109.1° |
C22 | C21 | H211 | 108.5° | 109.8° |
C22 | C21 | H212 | 107.8° | 109.5° |
C21 | C22 | H221 | 108.7° | 109.5° |
C21 | C22 | H222 | 108.2° | 109.2° |
C12 | C11 | C9 | 112.6° | 110.0° |
C11 | C12 | C13 | 128.2° | 124.9° |
C12 | C11 | H111 | 108.4° | 108.3° |
C12 | C11 | H112 | 107.8° | 108.9° |
C11 | C12 | H12 | 115.9° | 117.8° |
C11 | C9 | H9 | 107.7° | 106.6° |
C9 | C11 | H111 | 108.4° | 109.0° |
C9 | C11 | H112 | 107.8° | 112.5° |
C12 | C13 | C18 | 117.0° | 116.2° |
C12 | C13 | C14 | 120.1° | 123.0° |
C13 | C12 | H12 | 115.9° | 117.3° |
C16 | C15 | C14 | 113.6° | 112.4° |
C15 | C16 | H161 | 108.5° | 109.9° |
C15 | C16 | H162 | 107.8° | 108.8° |
C16 | C15 | H151 | 108.1° | 107.3° |
C16 | C15 | H152 | 107.2° | 109.2° |
C15 | C14 | C13 | 112.0° | 112.8° |
C15 | C14 | C27 | 108.6° | 107.1° |
C14 | C15 | H151 | 108.1° | 107.8° |
C14 | C15 | H152 | 107.2° | 113.6° |
C13 | C18 | C19 | 110.7° | 111.0° |
C18 | C13 | C14 | 122.9° | 120.8° |
C13 | C18 | H18 | 111.2° | 108.8° |
C18 | C19 | C29 | 109.6° | 110.1° |
C18 | C19 | C20 | 116.9° | 109.8° |
C19 | C18 | H18 | 103.3° | 108.8° |
C18 | C19 | H19 | 103.9° | 110.6° |
C13 | C14 | C27 | 108.6° | 107.4° |
C5 | C4 | C23 | 109.4° | 108.1° |
C5 | C4 | C3 | 109.3° | 112.4° |
C4 | C5 | H5 | 101.2° | 106.3° |
C23 | C4 | C3 | 108.7° | 106.2° |
C4 | C23 | O23 | 111.8° | 109.5° |
C4 | C23 | H231 | 108.7° | 109.5° |
C4 | C23 | H232 | 108.2° | 109.5° |
C4 | C3 | C2 | 112.6° | 112.3° |
C4 | C3 | O3 | 111.1° | 109.0° |
C4 | C3 | H3 | 106.2° | 108.8° |
C14 | C27 | H271 | 109.5° | 109.5° |
C14 | C27 | H272 | 109.4° | 109.5° |
C14 | C27 | H273 | 109.4° | 109.5° |
C1 | C2 | C3 | 112.0° | 110.0° |
C1 | C2 | O2 | 109.1° | 108.6° |
C1 | C2 | H2 | 108.1° | 111.1° |
C2 | C1 | H11 | 108.3° | 109.8° |
C2 | C1 | H12A | 107.5° | 109.7° |
C3 | C2 | O2 | 109.6° | 108.8° |
C2 | C3 | O3 | 109.6° | 109.2° |
C2 | C3 | H3 | 107.8° | 109.1° |
C3 | C2 | H2 | 107.6° | 110.4° |
O2 | C2 | H2 | 110.5° | 107.9° |
C2 | O2 | HO2 | 109.5° | 114.0° |
O23 | C23 | H231 | 108.7° | 109.5° |
O23 | C23 | H232 | 108.1° | 109.5° |
C23 | O23 | HO23 | 109.5° | 114.0° |
C3 | O3 | HO3 | 109.5° | 114.0° |
O3 | C3 | H3 | 109.4° | 108.3° |
C21 | C20 | C19 | 115.0° | 108.9° |
C21 | C20 | C30 | 109.6° | 109.6° |
C21 | C20 | H20 | 105.8° | 109.9° |
C20 | C21 | H211 | 108.5° | 109.6° |
C20 | C21 | H212 | 107.8° | 109.3° |
C29 | C19 | C20 | 108.9° | 108.6° |
C29 | C19 | H19 | 112.8° | 109.5° |
C19 | C29 | H291 | 109.5° | 109.5° |
C19 | C29 | H292 | 109.5° | 109.5° |
C19 | C29 | H293 | 109.5° | 109.4° |
C19 | C20 | C30 | 110.5° | 109.3° |
C20 | C19 | H19 | 104.7° | 108.1° |
C19 | C20 | H20 | 104.8° | 109.4° |
C30 | C20 | H20 | 110.8° | 109.8° |
C20 | C30 | H301 | 109.5° | 109.5° |
C20 | C30 | H302 | 109.5° | 109.5° |
C20 | C30 | H303 | 109.5° | 109.5° |
H11 | C1 | H12A | 112.3° | 109.7° |
H251 | C25 | H252 | 109.5° | 109.5° |
H251 | C25 | H253 | 109.5° | 109.4° |
H252 | C25 | H253 | 109.4° | 109.5° |
H111 | C11 | H112 | 111.9° | 108.1° |
H291 | C29 | H292 | 109.4° | 109.5° |
H291 | C29 | H293 | 109.5° | 109.5° |
H292 | C29 | H293 | 109.5° | 109.5° |
H301 | C30 | H302 | 109.5° | 109.5° |
H301 | C30 | H303 | 109.5° | 109.4° |
H302 | C30 | H303 | 109.5° | 109.4° |
H211 | C21 | H212 | 111.8° | 109.4° |
H221 | C22 | H222 | 111.3° | 109.1° |
H161 | C16 | H162 | 111.9° | 108.2° |
H151 | C15 | H152 | 112.8° | 106.1° |
H271 | C27 | H272 | 109.5° | 109.4° |
H271 | C27 | H273 | 109.5° | 109.5° |
H272 | C27 | H273 | 109.5° | 109.5° |
H261 | C26 | H262 | 109.5° | 109.5° |
H261 | C26 | H263 | 109.4° | 109.5° |
H262 | C26 | H263 | 109.5° | 109.5° |
H71 | C7 | H72 | 112.9° | 108.6° |
H61 | C6 | H62 | 109.3° | 109.0° |
H241 | C24 | H242 | 109.5° | 109.5° |
H241 | C24 | H243 | 109.4° | 109.5° |
H242 | C24 | H243 | 109.5° | 109.5° |
H231 | C23 | H232 | 111.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O28 | C28 | O29 | C17 | 179.9° | 180.0° |
O28 | C28 | C17 | C22 | 104.2° | 120.0° |
O28 | C28 | C17 | C18 | 17.5° | 0.0° |
O28 | C28 | C17 | C16 | 139.1° | 119.6° |
O28 | C28 | O29 | HO29 | 0.0° | 0.1° |
O29 | C28 | C17 | C22 | 75.8° | 60.0° |
O29 | C28 | C17 | C18 | 162.5° | 180.0° |
O29 | C28 | C17 | C16 | 40.9° | 60.4° |
C28 | C17 | C22 | C18 | 120.8° | 119.0° |
C28 | C17 | C22 | C16 | 116.8° | 119.9° |
C28 | C17 | C18 | C16 | 119.7° | 119.9° |
C28 | C17 | C22 | C21 | 177.0° | 175.5° |
C28 | C17 | C16 | C15 | 59.3° | 54.9° |
C28 | C17 | C18 | C13 | 72.3° | 63.9° |
C28 | C17 | C18 | C19 | 159.9° | 173.9° |
C28 | C17 | C18 | H18 | 46.9° | 54.4° |
C28 | C17 | C22 | H221 | 57.0° | 63.8° |
C28 | C17 | C22 | H222 | 64.0° | 55.4° |
C17 | C28 | O29 | HO29 | 179.9° | 180.0° |
C28 | C17 | C16 | H161 | 179.3° | 176.8° |
C28 | C17 | C16 | H162 | 59.4° | 64.8° |
C26 | C8 | C7 | C6 | 75.6° | 72.4° |
C26 | C8 | C7 | C9 | 123.4° | 121.8° |
C26 | C8 | C7 | C14 | 118.4° | 116.4° |
C26 | C8 | C9 | C14 | 121.7° | 116.7° |
C26 | C8 | C9 | C10 | 73.3° | 75.4° |
C26 | C8 | C9 | C11 | 60.5° | 50.8° |
C26 | C8 | C14 | C15 | 53.9° | 56.1° |
C26 | C8 | C14 | C13 | 67.9° | 70.0° |
C26 | C8 | C14 | C27 | 173.6° | 172.9° |
C26 | C8 | C9 | H9 | 175.8° | 166.9° |
C8 | C26 | H261 | H262 | 120.0° | 119.9° |
C8 | C26 | H261 | H263 | 120.0° | 120.0° |
C8 | C26 | H262 | H263 | 120.0° | 120.0° |
C26 | C8 | C7 | H71 | 44.4° | 167.8° |
C26 | C8 | C7 | H72 | 166.4° | 47.1° |
C25 | C10 | C5 | C6 | 64.8° | 62.2° |
C25 | C10 | C9 | C8 | 73.3° | 73.5° |
C25 | C10 | C9 | C5 | 123.6° | 124.4° |
C25 | C10 | C9 | C1 | 119.9° | 118.4° |
C25 | C10 | C5 | C1 | 121.0° | 119.4° |
C25 | C10 | C9 | C11 | 60.9° | 52.0° |
C25 | C10 | C5 | C4 | 69.9° | 67.2° |
C25 | C10 | C1 | C2 | 70.7° | 63.0° |
C25 | C10 | C1 | H11 | 49.3° | 176.8° |
C25 | C10 | C1 | H12A | 170.8° | 57.1° |
C10 | C25 | H251 | H252 | 120.0° | 120.0° |
C10 | C25 | H251 | H253 | 120.0° | 120.0° |
C10 | C25 | H252 | H253 | 120.0° | 120.0° |
C25 | C10 | C9 | H9 | 176.4° | 167.0° |
C25 | C10 | C5 | H5 | 179.7° | 175.3° |
C24 | C4 | C5 | C6 | 61.3° | 49.0° |
C24 | C4 | C5 | C10 | 72.4° | 78.6° |
C24 | C4 | C5 | C23 | 117.7° | 118.0° |
C24 | C4 | C5 | C3 | 123.4° | 125.1° |
C24 | C4 | C23 | C3 | 119.0° | 117.4° |
C24 | C4 | C3 | C2 | 72.9° | 79.4° |
C24 | C4 | C23 | O23 | 176.0° | 58.2° |
C24 | C4 | C3 | O3 | 50.5° | 41.8° |
C24 | C4 | C3 | H3 | 169.3° | 159.8° |
C24 | C4 | C5 | H5 | 175.6° | 164.4° |
C4 | C24 | H241 | H242 | 120.0° | 120.0° |
C4 | C24 | H241 | H243 | 120.0° | 120.0° |
C4 | C24 | H242 | H243 | 120.0° | 120.0° |
C24 | C4 | C23 | H231 | 56.0° | 178.2° |
C24 | C4 | C23 | H232 | 65.1° | 61.8° |
C7 | C6 | C5 | H61 | 120.0° | 117.2° |
C7 | C6 | C5 | H62 | 120.1° | 121.2° |
C6 | C7 | C8 | H71 | 120.0° | 119.8° |
C6 | C7 | C8 | H72 | 118.1° | 119.5° |
C6 | C7 | C8 | C9 | 47.8° | 49.4° |
C6 | C7 | C8 | C14 | 166.1° | 171.2° |
C7 | C6 | C5 | C10 | 62.8° | 67.2° |
C7 | C6 | C5 | C4 | 161.6° | 161.8° |
C6 | C7 | H71 | H72 | 118.2° | 116.6° |
C7 | C6 | H61 | H62 | 120.1° | 119.7° |
C7 | C6 | C5 | H5 | 50.5° | 46.0° |
C5 | C6 | C7 | C8 | 56.9° | 60.1° |
C6 | C5 | C10 | C9 | 57.9° | 61.6° |
C6 | C5 | C10 | C4 | 134.7° | 129.4° |
C6 | C5 | C10 | H5 | 115.0° | 113.2° |
C6 | C5 | C10 | C1 | 174.3° | 178.4° |
C6 | C5 | C4 | H5 | 114.3° | 115.4° |
C6 | C5 | C4 | C23 | 56.4° | 69.0° |
C6 | C5 | C4 | C3 | 175.3° | 174.0° |
C5 | C6 | C7 | H71 | 176.9° | 62.9° |
C5 | C6 | C7 | H72 | 61.2° | 179.8° |
C5 | C6 | H61 | H62 | 120.0° | 123.3° |
C22 | C17 | C18 | C16 | 120.6° | 121.8° |
C17 | C22 | C21 | H221 | 120.0° | 120.6° |
C17 | C22 | C21 | H222 | 119.0° | 120.1° |
C22 | C17 | C16 | C15 | 176.0° | 173.7° |
C22 | C17 | C18 | C13 | 168.0° | 177.8° |
C22 | C17 | C18 | C19 | 40.1° | 55.6° |
C17 | C22 | C21 | C20 | 60.4° | 59.7° |
C22 | C17 | C18 | H18 | 72.9° | 63.9° |
C17 | C22 | C21 | H211 | 179.6° | 60.6° |
C17 | C22 | C21 | H212 | 58.4° | 179.3° |
C17 | C22 | H221 | H222 | 119.0° | 119.2° |
C22 | C17 | C16 | H161 | 63.9° | 64.5° |
C22 | C17 | C16 | H162 | 57.4° | 54.0° |
C18 | C17 | C22 | C21 | 56.2° | 56.5° |
C17 | C18 | C13 | C12 | 144.8° | 134.5° |
C18 | C17 | C16 | C15 | 61.5° | 64.5° |
C17 | C18 | C13 | C19 | 131.3° | 122.2° |
C17 | C18 | C13 | H18 | 114.5° | 118.1° |
C17 | C18 | C19 | H18 | 113.2° | 119.4° |
C17 | C18 | C13 | C14 | 34.5° | 45.0° |
C17 | C18 | C19 | C29 | 152.1° | 177.6° |
C17 | C18 | C19 | C20 | 27.6° | 58.0° |
C17 | C18 | C19 | H19 | 87.1° | 61.2° |
C18 | C17 | C22 | H221 | 63.8° | 177.2° |
C18 | C17 | C22 | H222 | 175.2° | 63.6° |
C18 | C17 | C16 | H161 | 58.5° | 57.4° |
C18 | C17 | C16 | H162 | 179.9° | 175.8° |
C16 | C17 | C22 | C21 | 66.2° | 64.6° |
C17 | C16 | C15 | H161 | 120.0° | 121.9° |
C17 | C16 | C15 | H162 | 118.7° | 119.7° |
C17 | C16 | C15 | C14 | 57.4° | 56.1° |
C16 | C17 | C18 | C13 | 47.4° | 56.0° |
C16 | C17 | C18 | C19 | 80.5° | 66.2° |
C16 | C17 | C18 | H18 | 166.6° | 174.2° |
C16 | C17 | C22 | H221 | 173.8° | 56.1° |
C16 | C17 | C22 | H222 | 52.8° | 175.3° |
C17 | C16 | H161 | H162 | 118.7° | 118.8° |
C17 | C16 | C15 | H151 | 177.4° | 174.4° |
C17 | C16 | C15 | H152 | 60.8° | 71.0° |
C7 | C8 | C9 | C14 | 118.9° | 122.5° |
C7 | C8 | C9 | C10 | 46.1° | 45.4° |
C7 | C8 | C9 | C11 | 179.9° | 171.6° |
C7 | C8 | C14 | C15 | 62.3° | 61.1° |
C7 | C8 | C14 | C13 | 175.9° | 172.8° |
C7 | C8 | C14 | C27 | 57.4° | 55.6° |
C7 | C8 | C9 | H9 | 64.9° | 72.3° |
C7 | C8 | C26 | H261 | 25.3° | 67.0° |
C7 | C8 | C26 | H262 | 94.8° | 173.0° |
C7 | C8 | C26 | H263 | 145.2° | 53.0° |
C8 | C7 | H71 | H72 | 118.2° | 121.2° |
C8 | C7 | C6 | H61 | 176.9° | 178.7° |
C8 | C7 | C6 | H62 | 63.2° | 62.3° |
C8 | C9 | C10 | C11 | 134.1° | 125.5° |
C8 | C9 | C10 | H9 | 110.4° | 119.5° |
C8 | C9 | C10 | C5 | 50.3° | 50.8° |
C8 | C9 | C10 | C1 | 166.8° | 168.1° |
C8 | C9 | C11 | C12 | 32.5° | 48.0° |
C8 | C9 | C11 | H9 | 111.6° | 117.3° |
C9 | C8 | C14 | C15 | 177.7° | 174.7° |
C9 | C8 | C14 | C13 | 55.9° | 48.6° |
C9 | C8 | C14 | C27 | 62.5° | 68.5° |
C8 | C9 | C11 | H111 | 87.5° | 166.5° |
C8 | C9 | C11 | H112 | 151.1° | 73.6° |
C9 | C8 | C26 | H261 | 96.4° | 169.4° |
C9 | C8 | C26 | H262 | 143.6° | 49.5° |
C9 | C8 | C26 | H263 | 23.5° | 70.5° |
C9 | C8 | C7 | H71 | 167.8° | 70.5° |
C9 | C8 | C7 | H72 | 70.3° | 168.8° |
C14 | C8 | C9 | C10 | 165.0° | 167.9° |
C14 | C8 | C9 | C11 | 61.2° | 65.9° |
C8 | C14 | C13 | C12 | 28.6° | 17.1° |
C8 | C14 | C15 | C16 | 158.5° | 165.6° |
C8 | C14 | C15 | C13 | 119.0° | 125.0° |
C8 | C14 | C15 | C27 | 121.1° | 117.1° |
C8 | C14 | C13 | C18 | 150.7° | 162.4° |
C8 | C14 | C13 | C27 | 119.9° | 117.3° |
C14 | C8 | C9 | H9 | 54.1° | 50.2° |
C8 | C14 | C15 | H151 | 81.5° | 76.3° |
C8 | C14 | C15 | H152 | 40.4° | 40.9° |
C8 | C14 | C27 | H271 | 145.3° | 174.0° |
C8 | C14 | C27 | H272 | 94.7° | 54.1° |
C8 | C14 | C27 | H273 | 25.3° | 65.9° |
C14 | C8 | C26 | H261 | 143.0° | 51.5° |
C14 | C8 | C26 | H262 | 23.0° | 68.5° |
C14 | C8 | C26 | H263 | 97.0° | 171.5° |
C14 | C8 | C7 | H71 | 73.9° | 51.3° |
C14 | C8 | C7 | H72 | 48.0° | 69.4° |
C9 | C10 | C5 | C1 | 116.4° | 116.8° |
C10 | C9 | C11 | C12 | 168.4° | 176.5° |
C10 | C9 | C11 | H9 | 112.4° | 114.2° |
C9 | C10 | C5 | C4 | 167.4° | 169.0° |
C9 | C10 | C1 | C2 | 168.0° | 176.4° |
C9 | C10 | C1 | H11 | 72.0° | 56.2° |
C9 | C10 | C1 | H12A | 49.5° | 63.5° |
C9 | C10 | C25 | H251 | 55.1° | 49.7° |
C9 | C10 | C25 | H252 | 64.9° | 169.7° |
C9 | C10 | C25 | H253 | 175.1° | 70.3° |
C10 | C9 | C11 | H111 | 48.5° | 64.9° |
C10 | C9 | C11 | H112 | 72.9° | 55.0° |
C9 | C10 | C5 | H5 | 57.1° | 51.5° |
C5 | C10 | C9 | C11 | 175.6° | 176.3° |
C10 | C5 | C4 | H5 | 112.0° | 117.0° |
C10 | C5 | C4 | C23 | 169.9° | 163.4° |
C10 | C5 | C4 | C3 | 51.0° | 46.5° |
C5 | C10 | C1 | C2 | 52.5° | 59.2° |
C5 | C10 | C1 | H11 | 172.5° | 61.0° |
C5 | C10 | C1 | H12A | 66.0° | 179.3° |
C5 | C10 | C25 | H251 | 65.0° | 171.7° |
C5 | C10 | C25 | H252 | 175.0° | 68.2° |
C5 | C10 | C25 | H253 | 55.0° | 51.8° |
C5 | C10 | C9 | H9 | 60.1° | 68.7° |
C10 | C5 | C6 | H61 | 177.2° | 175.6° |
C10 | C5 | C6 | H62 | 57.3° | 54.0° |
C1 | C10 | C9 | C11 | 59.1° | 66.4° |
C1 | C10 | C5 | C4 | 51.1° | 52.2° |
C10 | C1 | C2 | H11 | 120.0° | 119.7° |
C10 | C1 | C2 | H12A | 118.4° | 119.7° |
C10 | C1 | C2 | C3 | 57.1° | 62.8° |
C10 | C1 | C2 | O2 | 178.6° | 178.2° |
C10 | C1 | C2 | H2 | 61.2° | 59.7° |
C10 | C1 | H11 | H12A | 118.5° | 119.2° |
C1 | C10 | C25 | H251 | 174.5° | 68.5° |
C1 | C10 | C25 | H252 | 54.4° | 51.5° |
C1 | C10 | C25 | H253 | 65.5° | 171.5° |
C1 | C10 | C9 | H9 | 56.4° | 48.6° |
C1 | C10 | C5 | H5 | 59.3° | 65.2° |
C22 | C21 | C20 | H211 | 120.0° | 120.3° |
C22 | C21 | C20 | H212 | 118.7° | 119.8° |
C22 | C21 | C20 | C19 | 46.2° | 61.4° |
C22 | C21 | C20 | C30 | 171.5° | 179.1° |
C22 | C21 | C20 | H20 | 69.1° | 58.4° |
C22 | C21 | H211 | H212 | 118.8° | 120.2° |
C21 | C22 | H221 | H222 | 119.0° | 119.4° |
C12 | C11 | C9 | H111 | 120.0° | 118.5° |
C12 | C11 | C9 | H112 | 118.7° | 121.6° |
C11 | C12 | C13 | H12 | 180.0° | 179.8° |
C11 | C12 | C13 | C18 | 179.3° | 179.0° |
C11 | C12 | C13 | C14 | 0.0° | 0.5° |
C12 | C11 | C9 | H9 | 79.2° | 69.3° |
C12 | C11 | H111 | H112 | 118.8° | 117.8° |
C9 | C11 | C12 | C13 | 1.5° | 16.1° |
C9 | C11 | H111 | H112 | 118.7° | 122.5° |
C9 | C11 | C12 | H12 | 178.5° | 164.1° |
C12 | C13 | C14 | C15 | 148.9° | 142.1° |
C12 | C13 | C18 | C14 | 179.3° | 179.6° |
C12 | C13 | C18 | C19 | 83.8° | 103.3° |
C12 | C13 | C14 | C27 | 91.2° | 100.1° |
C13 | C12 | C11 | H111 | 118.5° | 135.1° |
C13 | C12 | C11 | H112 | 120.1° | 107.6° |
C12 | C13 | C18 | H18 | 30.4° | 16.4° |
C16 | C15 | C14 | H151 | 120.0° | 118.1° |
C16 | C15 | C14 | H152 | 118.2° | 124.7° |
C16 | C15 | C14 | C13 | 39.5° | 40.7° |
C16 | C15 | C14 | C27 | 80.4° | 77.3° |
C15 | C16 | H161 | H162 | 118.8° | 118.6° |
C16 | C15 | H151 | H152 | 118.3° | 116.7° |
C15 | C14 | C13 | C18 | 30.4° | 37.4° |
C15 | C14 | C13 | C27 | 119.9° | 117.7° |
C14 | C15 | C16 | H161 | 62.6° | 65.9° |
C14 | C15 | C16 | H162 | 176.1° | 175.8° |
C14 | C15 | H151 | H152 | 118.3° | 122.0° |
C15 | C14 | C27 | H271 | 94.4° | 54.8° |
C15 | C14 | C27 | H272 | 25.6° | 65.2° |
C15 | C14 | C27 | H273 | 145.6° | 174.9° |
C13 | C18 | C19 | H18 | 119.1° | 119.7° |
C18 | C13 | C14 | C27 | 89.5° | 80.3° |
C13 | C18 | C19 | C29 | 80.2° | 61.5° |
C13 | C18 | C19 | C20 | 155.3° | 178.9° |
C18 | C13 | C12 | H12 | 0.7° | 0.8° |
C13 | C18 | C19 | H19 | 40.6° | 59.7° |
C19 | C18 | C13 | C14 | 96.8° | 77.2° |
C18 | C19 | C20 | C21 | 30.1° | 60.8° |
C18 | C19 | C29 | C20 | 129.1° | 120.3° |
C18 | C19 | C29 | H19 | 115.2° | 121.8° |
C18 | C19 | C20 | H19 | 114.3° | 120.7° |
C18 | C19 | C20 | C30 | 154.9° | 179.6° |
C18 | C19 | C29 | H291 | 20.6° | 60.0° |
C18 | C19 | C29 | H292 | 140.6° | 179.9° |
C18 | C19 | C29 | H293 | 99.4° | 60.0° |
C18 | C19 | C20 | H20 | 85.7° | 59.3° |
C14 | C13 | C12 | H12 | 180.0° | 179.7° |
C14 | C13 | C18 | H18 | 149.0° | 163.1° |
C13 | C14 | C15 | H151 | 159.5° | 158.7° |
C13 | C14 | C15 | H152 | 78.7° | 84.1° |
C13 | C14 | C27 | H271 | 27.6° | 66.6° |
C13 | C14 | C27 | H272 | 147.6° | 173.4° |
C13 | C14 | C27 | H273 | 92.4° | 53.4° |
C5 | C4 | C23 | C3 | 119.3° | 120.8° |
C5 | C4 | C3 | C2 | 51.7° | 47.3° |
C5 | C4 | C23 | O23 | 54.2° | 180.0° |
C5 | C4 | C3 | O3 | 175.0° | 168.5° |
C5 | C4 | C3 | H3 | 66.1° | 73.6° |
C4 | C5 | C6 | H61 | 41.5° | 44.6° |
C4 | C5 | C6 | H62 | 78.3° | 77.0° |
C5 | C4 | C24 | H241 | 149.2° | 66.5° |
C5 | C4 | C24 | H242 | 29.2° | 173.5° |
C5 | C4 | C24 | H243 | 90.9° | 53.5° |
C5 | C4 | C23 | H231 | 65.8° | 60.0° |
C5 | C4 | C23 | H232 | 173.2° | 60.0° |
C23 | C4 | C3 | C2 | 171.1° | 165.3° |
C4 | C23 | O23 | H231 | 120.0° | 120.0° |
C4 | C23 | O23 | H232 | 119.0° | 120.0° |
C23 | C4 | C3 | O3 | 65.6° | 73.5° |
C23 | C4 | C3 | H3 | 53.3° | 44.5° |
C23 | C4 | C5 | H5 | 57.9° | 46.4° |
C23 | C4 | C24 | H241 | 29.5° | 174.7° |
C23 | C4 | C24 | H242 | 90.5° | 54.7° |
C23 | C4 | C24 | H243 | 149.4° | 65.3° |
C4 | C23 | H231 | H232 | 119.0° | 120.0° |
C4 | C23 | O23 | HO23 | 68.5° | 180.0° |
C4 | C3 | C2 | C1 | 56.3° | 56.3° |
C4 | C3 | C2 | O3 | 124.2° | 121.1° |
C4 | C3 | C2 | H3 | 116.8° | 120.7° |
C4 | C3 | C2 | O2 | 177.5° | 175.2° |
C3 | C4 | C23 | O23 | 65.0° | 59.2° |
C4 | C3 | O3 | H3 | 116.9° | 118.3° |
C4 | C3 | O3 | HO3 | 124.1° | 178.2° |
C4 | C3 | C2 | H2 | 62.3° | 66.6° |
C3 | C4 | C5 | H5 | 61.0° | 70.5° |
C3 | C4 | C24 | H241 | 88.2° | 59.8° |
C3 | C4 | C24 | H242 | 151.8° | 60.2° |
C3 | C4 | C24 | H243 | 31.7° | 179.8° |
C3 | C4 | C23 | H231 | 175.0° | 60.8° |
C3 | C4 | C23 | H232 | 53.9° | 179.2° |
C27 | C14 | C15 | H151 | 39.6° | 40.8° |
C27 | C14 | C15 | H152 | 161.4° | 158.0° |
C14 | C27 | H271 | H272 | 120.0° | 120.0° |
C14 | C27 | H271 | H273 | 120.0° | 120.1° |
C14 | C27 | H272 | H273 | 120.0° | 120.0° |
C1 | C2 | C3 | O2 | 121.2° | 118.9° |
C1 | C2 | C3 | H2 | 118.6° | 122.9° |
C1 | C2 | O2 | H2 | 118.7° | 120.5° |
C1 | C2 | C3 | O3 | 179.5° | 177.4° |
C1 | C2 | C3 | H3 | 60.5° | 64.4° |
C1 | C2 | O2 | HO2 | 111.9° | 180.0° |
C2 | C1 | H11 | H12A | 118.5° | 120.7° |
C3 | C2 | O2 | H2 | 118.4° | 119.8° |
C2 | C3 | O3 | H3 | 118.0° | 118.7° |
C2 | C3 | O3 | HO3 | 110.8° | 58.7° |
C3 | C2 | O2 | HO2 | 125.2° | 60.3° |
C3 | C2 | C1 | H11 | 177.2° | 56.8° |
C3 | C2 | C1 | H12A | 61.3° | 177.5° |
O2 | C2 | C3 | O3 | 58.4° | 63.8° |
O2 | C2 | C3 | H3 | 60.6° | 54.5° |
O2 | C2 | C1 | H11 | 61.4° | 62.2° |
O2 | C2 | C1 | H12A | 60.2° | 58.5° |
O23 | C23 | H231 | H232 | 119.0° | 120.0° |
O3 | C3 | C2 | H2 | 61.8° | 54.5° |
C21 | C20 | C19 | C29 | 155.0° | 178.7° |
C21 | C20 | C19 | C30 | 124.8° | 119.6° |
C21 | C20 | C19 | H20 | 115.8° | 120.1° |
C21 | C20 | C30 | H20 | 116.4° | 120.7° |
C21 | C20 | C19 | H19 | 84.2° | 59.9° |
C21 | C20 | C30 | H301 | 168.4° | 179.2° |
C21 | C20 | C30 | H302 | 71.6° | 60.8° |
C21 | C20 | C30 | H303 | 48.4° | 59.2° |
C20 | C21 | H211 | H212 | 118.8° | 119.9° |
C20 | C21 | C22 | H221 | 59.6° | 179.7° |
C20 | C21 | C22 | H222 | 179.4° | 60.4° |
C29 | C19 | C20 | H19 | 120.8° | 118.8° |
C29 | C19 | C20 | C30 | 80.2° | 59.1° |
C29 | C19 | C18 | H18 | 38.9° | 58.2° |
C19 | C29 | H291 | H292 | 120.0° | 120.0° |
C19 | C29 | H291 | H293 | 120.0° | 119.9° |
C19 | C29 | H292 | H293 | 120.0° | 119.9° |
C29 | C19 | C20 | H20 | 39.2° | 61.2° |
C19 | C20 | C30 | H20 | 115.8° | 120.1° |
C20 | C19 | C18 | H18 | 85.6° | 61.4° |
C20 | C19 | C29 | H291 | 108.5° | 60.3° |
C20 | C19 | C29 | H292 | 11.5° | 59.8° |
C20 | C19 | C29 | H293 | 131.5° | 179.7° |
C19 | C20 | C30 | H301 | 40.6° | 60.0° |
C19 | C20 | C30 | H302 | 160.6° | 180.0° |
C19 | C20 | C30 | H303 | 79.4° | 60.0° |
C19 | C20 | C21 | H211 | 166.2° | 58.9° |
C19 | C20 | C21 | H212 | 72.6° | 178.8° |
C30 | C20 | C19 | H19 | 40.6° | 59.7° |
C20 | C30 | H301 | H302 | 120.0° | 120.0° |
C20 | C30 | H301 | H303 | 120.0° | 120.1° |
C20 | C30 | H302 | H303 | 120.0° | 120.0° |
C30 | C20 | C21 | H211 | 68.5° | 60.6° |
C30 | C20 | C21 | H212 | 52.7° | 59.3° |
HO3 | O3 | C3 | H3 | 7.2° | 60.0° |
H3 | C3 | C2 | H2 | 179.2° | 172.7° |
H2 | C2 | O2 | HO2 | 6.8° | 59.5° |
H2 | C2 | C1 | H11 | 58.9° | 179.3° |
H2 | C2 | C1 | H12A | 179.6° | 60.0° |
H251 | C25 | H252 | H253 | 120.0° | 120.0° |
H9 | C9 | C11 | H111 | 160.9° | 49.3° |
H9 | C9 | C11 | H112 | 39.5° | 169.1° |
H111 | C11 | C12 | H12 | 61.5° | 45.1° |
H112 | C11 | C12 | H12 | 59.8° | 72.2° |
H18 | C18 | C19 | H19 | 159.7° | 179.4° |
H19 | C19 | C29 | H291 | 135.8° | 178.1° |
H19 | C19 | C29 | H292 | 104.3° | 58.1° |
H19 | C19 | C29 | H293 | 15.7° | 61.9° |
H19 | C19 | C20 | H20 | 160.0° | 180.0° |
H291 | C29 | H292 | H293 | 120.0° | 120.0° |
H20 | C20 | C30 | H301 | 75.2° | 60.1° |
H20 | C20 | C30 | H302 | 44.8° | 59.9° |
H20 | C20 | C30 | H303 | 164.8° | 179.9° |
H20 | C20 | C21 | H211 | 50.9° | 178.7° |
H20 | C20 | C21 | H212 | 172.2° | 61.4° |
H301 | C30 | H302 | H303 | 120.0° | 119.9° |
H211 | C21 | C22 | H221 | 60.4° | 60.1° |
H211 | C21 | C22 | H222 | 60.6° | 179.4° |
H212 | C21 | C22 | H221 | 178.4° | 60.1° |
H212 | C21 | C22 | H222 | 60.6° | 59.2° |
H161 | C16 | C15 | H151 | 57.4° | 52.5° |
H161 | C16 | C15 | H152 | 179.2° | 167.0° |
H162 | C16 | C15 | H151 | 64.0° | 65.9° |
H162 | C16 | C15 | H152 | 57.9° | 48.7° |
H271 | C27 | H272 | H273 | 120.0° | 120.0° |
H261 | C26 | H262 | H263 | 120.0° | 120.1° |
H71 | C7 | C6 | H61 | 63.1° | 55.8° |
H71 | C7 | C6 | H62 | 56.8° | 174.8° |
H72 | C7 | C6 | H61 | 58.8° | 61.1° |
H72 | C7 | C6 | H62 | 178.7° | 57.9° |
H61 | C6 | C5 | H5 | 69.5° | 71.2° |
H62 | C6 | C5 | H5 | 170.6° | 167.2° |
H241 | C24 | H242 | H243 | 120.0° | 120.0° |
H231 | C23 | O23 | HO23 | 171.5° | 60.0° |
H232 | C23 | O23 | HO23 | 50.5° | 60.0° |