S5H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.57Å | |
| C1 | C10 | sing | 1.53Å | 1.59Å | |
| C1 | H11 | sing | 1.09Å | 1.11Å | |
| C1 | H12 | sing | 1.09Å | 1.11Å | |
| C2 | C3 | sing | 1.53Å | 1.55Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| C3 | O3 | sing | 1.45Å | 1.44Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C3 | H3 | sing | 1.09Å | 1.11Å | |
| O3 | CH1 | sing | 1.34Å | 1.26Å | |
| C4 | C5 | sing | 1.53Å | 1.52Å | |
| C4 | H41 | sing | 1.09Å | 1.12Å | |
| C4 | H42 | sing | 1.09Å | 1.12Å | |
| C5 | C6 | sing | 1.53Å | 1.49Å | |
| C5 | C10 | sing | 1.53Å | 1.55Å | |
| C5 | H5 | sing | 1.09Å | 1.11Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C6 | H61 | sing | 1.09Å | 1.12Å | |
| C6 | H62 | sing | 1.09Å | 1.12Å | |
| C7 | C8 | sing | 1.53Å | 1.54Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.11Å | |
| C8 | C9 | sing | 1.54Å | 1.55Å | |
| C8 | C14 | sing | 1.52Å | 1.50Å | |
| C8 | H8 | sing | 1.09Å | 1.12Å | |
| C9 | C10 | sing | 1.53Å | 1.55Å | |
| C9 | C11 | sing | 1.52Å | 1.52Å | |
| C9 | H9 | sing | 1.09Å | 1.11Å | |
| C10 | C19 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | sing | 1.54Å | 1.56Å | |
| C11 | H111 | sing | 1.09Å | 1.11Å | |
| C11 | H112 | sing | 1.09Å | 1.12Å | |
| C12 | C13 | sing | 1.52Å | 1.55Å | |
| C12 | H121 | sing | 1.09Å | 1.11Å | |
| C12 | H122 | sing | 1.09Å | 1.11Å | |
| C13 | C14 | sing | 1.55Å | 1.46Å | |
| C13 | C17 | sing | 1.52Å | 1.52Å | |
| C13 | C18 | sing | 1.53Å | 1.53Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | H14 | sing | 1.09Å | 1.11Å | |
| C15 | C16 | sing | 1.55Å | 1.55Å | |
| C15 | H151 | sing | 1.09Å | 1.12Å | |
| C15 | H152 | sing | 1.09Å | 1.11Å | |
| C16 | C17 | sing | 1.55Å | 1.55Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C17 | C20 | sing | 1.51Å | 1.51Å | |
| C17 | H17 | sing | 1.09Å | 1.11Å | |
| C18 | H181 | sing | 1.09Å | 1.12Å | |
| C18 | H182 | sing | 1.09Å | 1.11Å | |
| C18 | H183 | sing | 1.09Å | 1.12Å | |
| C19 | H191 | sing | 1.09Å | 1.12Å | |
| C19 | H192 | sing | 1.09Å | 1.11Å | |
| C19 | H193 | sing | 1.09Å | 1.12Å | |
| C20 | O20 | doub | 1.21Å | 1.22Å | |
| C20 | C21 | sing | 1.51Å | 1.48Å | |
| C21 | H211 | sing | 1.09Å | 1.12Å | |
| C21 | H212 | sing | 1.09Å | 1.11Å | |
| C21 | H213 | sing | 1.09Å | 1.11Å | |
| CH1 | OH1 | doub | 1.21Å | 1.26Å | |
| CH1 | CH2 | sing | 1.51Å | 1.53Å | |
| CH2 | CH3 | sing | 1.53Å | 1.50Å | |
| CH2 | HH21 | sing | 1.09Å | 1.12Å | |
| CH2 | HH22 | sing | 1.09Å | 1.11Å | |
| CH3 | CH4 | sing | 1.51Å | 1.51Å | |
| CH3 | HH31 | sing | 1.09Å | 1.12Å | |
| CH3 | HH32 | sing | 1.09Å | 1.11Å | |
| CH4 | OH4 | doub | 1.21Å | 1.27Å | |
| CH4 | OH5 | sing | 1.34Å | 1.28Å | |
| OH5 | HOH5 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C10 | 118.3° | 109.4° |
| C2 | C1 | H11 | 109.1° | 109.4° |
| C2 | C1 | H12 | 109.0° | 109.5° |
| C1 | C2 | C3 | 115.4° | 109.5° |
| C1 | C2 | H21 | 110.1° | 109.5° |
| C1 | C2 | H22 | 110.1° | 109.5° |
| C10 | C1 | H11 | 109.0° | 109.5° |
| C10 | C1 | H12 | 109.0° | 109.5° |
| C1 | C10 | C5 | 110.1° | 109.6° |
| C1 | C10 | C9 | 107.7° | 109.4° |
| C1 | C10 | C19 | 110.9° | 109.4° |
| H11 | C1 | H12 | 101.1° | 109.5° |
| C3 | C2 | H21 | 110.0° | 109.5° |
| C3 | C2 | H22 | 110.0° | 109.4° |
| C2 | C3 | O3 | 112.1° | 109.5° |
| C2 | C3 | C4 | 108.3° | 109.5° |
| C2 | C3 | H3 | 108.8° | 109.4° |
| H21 | C2 | H22 | 100.2° | 109.4° |
| O3 | C3 | C4 | 110.3° | 109.5° |
| O3 | C3 | H3 | 106.7° | 109.4° |
| C3 | O3 | CH1 | 124.2° | 120.1° |
| C4 | C3 | H3 | 110.7° | 109.5° |
| C3 | C4 | C5 | 108.4° | 109.5° |
| C3 | C4 | H41 | 112.6° | 109.5° |
| C3 | C4 | H42 | 112.6° | 109.4° |
| O3 | CH1 | OH1 | 122.8° | 119.9° |
| O3 | CH1 | CH2 | 119.9° | 120.1° |
| C5 | C4 | H41 | 112.6° | 109.5° |
| C5 | C4 | H42 | 112.6° | 109.4° |
| C4 | C5 | C6 | 112.4° | 109.5° |
| C4 | C5 | C10 | 110.5° | 109.5° |
| C4 | C5 | H5 | 106.6° | 109.4° |
| H41 | C4 | H42 | 97.8° | 109.5° |
| C6 | C5 | C10 | 109.1° | 109.6° |
| C6 | C5 | H5 | 108.0° | 109.4° |
| C5 | C6 | C7 | 111.3° | 109.6° |
| C5 | C6 | H61 | 111.5° | 109.5° |
| C5 | C6 | H62 | 111.6° | 109.4° |
| C10 | C5 | H5 | 110.1° | 109.4° |
| C5 | C10 | C9 | 107.1° | 110.2° |
| C5 | C10 | C19 | 110.9° | 109.6° |
| C7 | C6 | H61 | 111.6° | 109.6° |
| C7 | C6 | H62 | 111.6° | 109.4° |
| C6 | C7 | C8 | 114.9° | 109.5° |
| C6 | C7 | H71 | 110.2° | 109.4° |
| C6 | C7 | H72 | 110.2° | 109.5° |
| H61 | C6 | H62 | 98.8° | 109.4° |
| C8 | C7 | H71 | 110.2° | 109.5° |
| C8 | C7 | H72 | 110.3° | 109.5° |
| C7 | C8 | C9 | 111.4° | 109.9° |
| C7 | C8 | C14 | 108.5° | 110.4° |
| C7 | C8 | H8 | 107.8° | 109.7° |
| H71 | C7 | H72 | 100.0° | 109.5° |
| C9 | C8 | C14 | 106.3° | 107.3° |
| C9 | C8 | H8 | 110.0° | 109.8° |
| C8 | C9 | C10 | 110.0° | 109.2° |
| C8 | C9 | C11 | 110.6° | 111.8° |
| C8 | C9 | H9 | 110.6° | 108.0° |
| C14 | C8 | H8 | 112.8° | 109.7° |
| C8 | C14 | C13 | 110.1° | 107.7° |
| C8 | C14 | C15 | 120.6° | 115.9° |
| C8 | C14 | H14 | 99.5° | 110.4° |
| C10 | C9 | C11 | 115.2° | 110.0° |
| C10 | C9 | H9 | 105.4° | 108.9° |
| C9 | C10 | C19 | 110.0° | 108.7° |
| C11 | C9 | H9 | 104.8° | 108.8° |
| C9 | C11 | C12 | 113.5° | 111.4° |
| C9 | C11 | H111 | 110.7° | 109.1° |
| C9 | C11 | H112 | 110.7° | 109.1° |
| C10 | C19 | H191 | 111.0° | 109.5° |
| C10 | C19 | H192 | 111.7° | 109.5° |
| C10 | C19 | H193 | 111.7° | 109.5° |
| C12 | C11 | H111 | 110.8° | 109.0° |
| C12 | C11 | H112 | 110.7° | 109.1° |
| C11 | C12 | C13 | 113.0° | 108.7° |
| C11 | C12 | H121 | 110.9° | 109.9° |
| C11 | C12 | H122 | 110.9° | 109.9° |
| H111 | C11 | H112 | 99.6° | 109.0° |
| C13 | C12 | H121 | 110.9° | 107.5° |
| C13 | C12 | H122 | 110.9° | 110.9° |
| C12 | C13 | C14 | 110.2° | 108.5° |
| C12 | C13 | C17 | 114.8° | 118.1° |
| C12 | C13 | C18 | 107.3° | 109.8° |
| H121 | C12 | H122 | 99.4° | 110.0° |
| C14 | C13 | C17 | 106.2° | 103.2° |
| C14 | C13 | C18 | 108.2° | 106.6° |
| C13 | C14 | C15 | 104.6° | 101.7° |
| C13 | C14 | H14 | 117.1° | 110.4° |
| C17 | C13 | C18 | 110.0° | 109.9° |
| C13 | C17 | C16 | 102.2° | 105.4° |
| C13 | C17 | C20 | 113.3° | 110.3° |
| C13 | C17 | H17 | 113.4° | 110.3° |
| C13 | C18 | H181 | 107.4° | 109.5° |
| C13 | C18 | H182 | 113.0° | 109.4° |
| C13 | C18 | H183 | 113.0° | 109.5° |
| C15 | C14 | H14 | 105.6° | 110.4° |
| C14 | C15 | C16 | 104.7° | 102.9° |
| C14 | C15 | H151 | 114.0° | 110.7° |
| C14 | C15 | H152 | 114.0° | 110.8° |
| C16 | C15 | H151 | 114.0° | 110.7° |
| C16 | C15 | H152 | 114.0° | 110.7° |
| C15 | C16 | C17 | 106.7° | 106.4° |
| C15 | C16 | H161 | 113.2° | 110.1° |
| C15 | C16 | H162 | 113.2° | 110.1° |
| H151 | C15 | H152 | 96.4° | 110.8° |
| C17 | C16 | H161 | 113.2° | 110.1° |
| C17 | C16 | H162 | 113.2° | 110.1° |
| C16 | C17 | C20 | 113.7° | 110.2° |
| C16 | C17 | H17 | 113.0° | 110.3° |
| H161 | C16 | H162 | 97.3° | 110.0° |
| C20 | C17 | H17 | 101.7° | 110.2° |
| C17 | C20 | O20 | 122.0° | 120.0° |
| C17 | C20 | C21 | 120.0° | 120.0° |
| H181 | C18 | H182 | 113.0° | 109.4° |
| H181 | C18 | H183 | 112.9° | 109.5° |
| H182 | C18 | H183 | 97.4° | 109.5° |
| H191 | C19 | H192 | 111.7° | 109.5° |
| H191 | C19 | H193 | 111.6° | 109.5° |
| H192 | C19 | H193 | 98.7° | 109.4° |
| O20 | C20 | C21 | 118.0° | 120.0° |
| C20 | C21 | H211 | 119.9° | 109.5° |
| C20 | C21 | H212 | 108.4° | 109.5° |
| C20 | C21 | H213 | 108.4° | 109.4° |
| H211 | C21 | H212 | 108.5° | 109.5° |
| H211 | C21 | H213 | 108.5° | 109.5° |
| H212 | C21 | H213 | 101.6° | 109.5° |
| OH1 | CH1 | CH2 | 117.2° | 120.0° |
| CH1 | CH2 | CH3 | 111.7° | 109.6° |
| CH1 | CH2 | HH21 | 111.4° | 109.4° |
| CH1 | CH2 | HH22 | 111.4° | 109.5° |
| CH3 | CH2 | HH21 | 111.3° | 109.4° |
| CH3 | CH2 | HH22 | 111.4° | 109.5° |
| CH2 | CH3 | CH4 | 110.6° | 109.5° |
| CH2 | CH3 | HH31 | 111.8° | 109.4° |
| CH2 | CH3 | HH32 | 111.8° | 109.5° |
| HH21 | CH2 | HH22 | 99.0° | 109.5° |
| CH4 | CH3 | HH31 | 111.7° | 109.5° |
| CH4 | CH3 | HH32 | 111.8° | 109.4° |
| CH3 | CH4 | OH4 | 115.5° | 120.0° |
| CH3 | CH4 | OH5 | 119.6° | 120.0° |
| HH31 | CH3 | HH32 | 98.6° | 109.5° |
| OH4 | CH4 | OH5 | 124.9° | 120.0° |
| CH4 | OH5 | HOH5 | 119.6° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C10 | H11 | 125.3° | 119.9° |
| C2 | C1 | C10 | H12 | 125.2° | 120.0° |
| C2 | C1 | H11 | H12 | 114.8° | 120.0° |
| C1 | C2 | C3 | H21 | 125.3° | 120.0° |
| C1 | C2 | C3 | H22 | 125.3° | 120.0° |
| C1 | C2 | H21 | H22 | 115.9° | 120.0° |
| C1 | C2 | C3 | O3 | 167.4° | 179.9° |
| C1 | C2 | C3 | C4 | 45.5° | 60.0° |
| C1 | C2 | C3 | H3 | 74.8° | 60.0° |
| C2 | C1 | C10 | C5 | 33.8° | 60.0° |
| C2 | C1 | C10 | C9 | 150.3° | 179.2° |
| C2 | C1 | C10 | C19 | 89.3° | 60.1° |
| C10 | C1 | H11 | H12 | 114.8° | 120.1° |
| C10 | C1 | C2 | C3 | 31.9° | 60.0° |
| C10 | C1 | C2 | H21 | 93.4° | 180.0° |
| C10 | C1 | C2 | H22 | 157.2° | 60.1° |
| C1 | C10 | C5 | C4 | 52.8° | 60.0° |
| C1 | C10 | C5 | C6 | 176.9° | 179.9° |
| C1 | C10 | C5 | C9 | 116.8° | 120.4° |
| C1 | C10 | C5 | C19 | 123.1° | 120.1° |
| C1 | C10 | C5 | H5 | 64.6° | 59.9° |
| C1 | C10 | C9 | C8 | 179.4° | 179.5° |
| C1 | C10 | C9 | C19 | 121.1° | 119.5° |
| C1 | C10 | C9 | C11 | 53.6° | 57.5° |
| C1 | C10 | C9 | H9 | 61.4° | 61.7° |
| C1 | C10 | C19 | H191 | 180.0° | 60.0° |
| C1 | C10 | C19 | H192 | 54.7° | 179.9° |
| C1 | C10 | C19 | H193 | 54.7° | 60.0° |
| H11 | C1 | C2 | C3 | 93.4° | 60.0° |
| H11 | C1 | C2 | H21 | 141.4° | 60.0° |
| H11 | C1 | C2 | H22 | 31.9° | 180.0° |
| H11 | C1 | C10 | C5 | 91.5° | 59.9° |
| H11 | C1 | C10 | C9 | 25.0° | 60.9° |
| H11 | C1 | C10 | C19 | 145.5° | 179.9° |
| H12 | C1 | C2 | C3 | 157.1° | 180.0° |
| H12 | C1 | C2 | H21 | 31.9° | 59.9° |
| H12 | C1 | C2 | H22 | 77.6° | 60.0° |
| H12 | C1 | C10 | C5 | 159.0° | 180.0° |
| H12 | C1 | C10 | C9 | 84.5° | 59.1° |
| H12 | C1 | C10 | C19 | 36.0° | 59.9° |
| C3 | C2 | H21 | H22 | 115.8° | 120.0° |
| C2 | C3 | O3 | C4 | 120.7° | 120.1° |
| C2 | C3 | O3 | H3 | 119.0° | 120.0° |
| C2 | C3 | C4 | H3 | 119.1° | 119.9° |
| C2 | C3 | O3 | CH1 | 9.1° | 90.0° |
| C2 | C3 | C4 | C5 | 65.2° | 59.9° |
| C2 | C3 | C4 | H41 | 60.0° | 180.0° |
| C2 | C3 | C4 | H42 | 169.5° | 60.0° |
| H21 | C2 | C3 | O3 | 42.1° | 59.9° |
| H21 | C2 | C3 | C4 | 79.8° | 180.0° |
| H21 | C2 | C3 | H3 | 159.9° | 60.1° |
| H22 | C2 | C3 | O3 | 67.3° | 60.0° |
| H22 | C2 | C3 | C4 | 170.8° | 60.0° |
| H22 | C2 | C3 | H3 | 50.5° | 180.0° |
| O3 | C3 | C4 | H3 | 117.9° | 119.9° |
| O3 | C3 | C4 | C5 | 171.7° | 179.9° |
| O3 | C3 | C4 | H41 | 63.0° | 59.9° |
| O3 | C3 | C4 | H42 | 46.4° | 60.1° |
| C3 | O3 | CH1 | OH1 | 68.5° | 0.0° |
| C3 | O3 | CH1 | CH2 | 114.9° | 179.9° |
| C4 | C3 | O3 | CH1 | 129.8° | 150.0° |
| C3 | C4 | C5 | H41 | 125.3° | 120.0° |
| C3 | C4 | C5 | H42 | 125.3° | 119.9° |
| C3 | C4 | H41 | H42 | 118.5° | 120.0° |
| C3 | C4 | C5 | C6 | 166.7° | 179.9° |
| C3 | C4 | C5 | C10 | 71.1° | 60.0° |
| C3 | C4 | C5 | H5 | 48.5° | 60.0° |
| H3 | C3 | O3 | CH1 | 109.9° | 30.0° |
| H3 | C3 | C4 | C5 | 53.9° | 60.0° |
| H3 | C3 | C4 | H41 | 179.2° | 60.0° |
| H3 | C3 | C4 | H42 | 71.4° | 179.9° |
| O3 | CH1 | OH1 | CH2 | 176.7° | 180.0° |
| O3 | CH1 | CH2 | CH3 | 79.6° | 180.0° |
| O3 | CH1 | CH2 | HH21 | 45.7° | 60.0° |
| O3 | CH1 | CH2 | HH22 | 155.2° | 59.9° |
| C5 | C4 | H41 | H42 | 118.5° | 120.0° |
| C4 | C5 | C6 | C10 | 123.0° | 120.1° |
| C4 | C5 | C6 | H5 | 117.3° | 119.9° |
| C4 | C5 | C10 | H5 | 117.5° | 119.9° |
| C4 | C5 | C6 | C7 | 177.2° | 179.8° |
| C4 | C5 | C6 | H61 | 57.5° | 60.0° |
| C4 | C5 | C6 | H62 | 51.9° | 59.9° |
| C4 | C5 | C10 | C9 | 169.7° | 179.6° |
| C4 | C5 | C10 | C19 | 70.3° | 60.1° |
| H41 | C4 | C5 | C6 | 68.0° | 59.8° |
| H41 | C4 | C5 | C10 | 54.1° | 180.0° |
| H41 | C4 | C5 | H5 | 173.8° | 60.1° |
| H42 | C4 | C5 | C6 | 41.4° | 60.2° |
| H42 | C4 | C5 | C10 | 163.6° | 60.0° |
| H42 | C4 | C5 | H5 | 76.8° | 179.9° |
| C6 | C5 | C10 | H5 | 118.4° | 120.0° |
| C5 | C6 | C7 | H61 | 125.3° | 120.1° |
| C5 | C6 | C7 | H62 | 125.3° | 119.9° |
| C5 | C6 | H61 | H62 | 117.4° | 119.9° |
| C5 | C6 | C7 | C8 | 50.2° | 60.0° |
| C5 | C6 | C7 | H71 | 175.5° | 60.0° |
| C5 | C6 | C7 | H72 | 75.1° | 180.0° |
| C6 | C5 | C10 | C9 | 66.2° | 59.5° |
| C6 | C5 | C10 | C19 | 53.8° | 60.0° |
| C10 | C5 | C6 | C7 | 59.8° | 59.7° |
| C10 | C5 | C6 | H61 | 65.4° | 179.9° |
| C10 | C5 | C6 | H62 | 174.9° | 60.2° |
| C5 | C10 | C9 | C8 | 62.2° | 59.0° |
| C5 | C10 | C9 | C19 | 120.6° | 120.1° |
| C5 | C10 | C9 | C11 | 172.0° | 178.0° |
| C5 | C10 | C9 | H9 | 57.0° | 58.8° |
| C5 | C10 | C19 | H191 | 57.3° | 60.1° |
| C5 | C10 | C19 | H192 | 177.3° | 59.9° |
| C5 | C10 | C19 | H193 | 67.9° | 179.9° |
| H5 | C5 | C6 | C7 | 59.9° | 60.3° |
| H5 | C5 | C6 | H61 | 174.8° | 59.9° |
| H5 | C5 | C6 | H62 | 65.4° | 179.8° |
| H5 | C5 | C10 | C9 | 52.2° | 60.5° |
| H5 | C5 | C10 | C19 | 172.2° | 180.0° |
| C7 | C6 | H61 | H62 | 117.4° | 119.9° |
| C6 | C7 | C8 | H71 | 125.2° | 119.9° |
| C6 | C7 | C8 | H72 | 125.3° | 120.0° |
| C6 | C7 | H71 | H72 | 116.1° | 120.0° |
| C6 | C7 | C8 | C9 | 46.1° | 59.9° |
| C6 | C7 | C8 | C14 | 162.8° | 178.0° |
| C6 | C7 | C8 | H8 | 74.7° | 60.9° |
| H61 | C6 | C7 | C8 | 75.1° | 179.9° |
| H61 | C6 | C7 | H71 | 50.2° | 60.1° |
| H61 | C6 | C7 | H72 | 159.7° | 59.9° |
| H62 | C6 | C7 | C8 | 175.5° | 60.0° |
| H62 | C6 | C7 | H71 | 59.2° | 179.9° |
| H62 | C6 | C7 | H72 | 50.2° | 60.1° |
| C8 | C7 | H71 | H72 | 116.1° | 120.1° |
| C7 | C8 | C9 | C14 | 118.1° | 120.0° |
| C7 | C8 | C9 | H8 | 119.5° | 120.8° |
| C7 | C8 | C14 | H8 | 119.4° | 121.1° |
| C7 | C8 | C9 | C10 | 52.2° | 59.2° |
| C7 | C8 | C9 | C11 | 179.3° | 178.8° |
| C7 | C8 | C9 | H9 | 63.8° | 59.1° |
| C7 | C8 | C14 | C13 | 169.7° | 176.2° |
| C7 | C8 | C14 | C15 | 47.9° | 63.2° |
| C7 | C8 | C14 | H14 | 66.7° | 63.2° |
| H71 | C7 | C8 | C9 | 171.3° | 60.1° |
| H71 | C7 | C8 | C14 | 72.0° | 58.1° |
| H71 | C7 | C8 | H8 | 50.5° | 179.1° |
| H72 | C7 | C8 | C9 | 79.2° | 179.9° |
| H72 | C7 | C8 | C14 | 37.5° | 61.9° |
| H72 | C7 | C8 | H8 | 160.0° | 59.1° |
| C9 | C8 | C14 | H8 | 120.7° | 119.2° |
| C8 | C9 | C10 | C11 | 125.8° | 123.1° |
| C8 | C9 | C10 | H9 | 119.2° | 117.7° |
| C8 | C9 | C11 | H9 | 119.1° | 119.3° |
| C8 | C9 | C10 | C19 | 58.4° | 61.1° |
| C8 | C9 | C11 | C12 | 48.5° | 54.7° |
| C8 | C9 | C11 | H111 | 173.8° | 175.1° |
| C8 | C9 | C11 | H112 | 76.7° | 65.8° |
| C9 | C8 | C14 | C13 | 70.3° | 64.1° |
| C9 | C8 | C14 | C15 | 167.9° | 177.0° |
| C9 | C8 | C14 | H14 | 53.3° | 56.5° |
| C14 | C8 | C9 | C10 | 170.3° | 179.2° |
| C14 | C8 | C9 | C11 | 61.3° | 58.8° |
| C14 | C8 | C9 | H9 | 54.3° | 60.9° |
| C8 | C14 | C13 | C12 | 63.7° | 67.3° |
| C8 | C14 | C13 | C15 | 130.9° | 122.2° |
| C8 | C14 | C13 | H14 | 112.7° | 120.6° |
| C8 | C14 | C13 | C17 | 171.5° | 166.6° |
| C8 | C14 | C13 | C18 | 53.4° | 50.8° |
| C8 | C14 | C15 | H14 | 111.4° | 126.4° |
| C8 | C14 | C15 | C16 | 152.1° | 158.0° |
| C8 | C14 | C15 | H151 | 26.8° | 83.7° |
| C8 | C14 | C15 | H152 | 82.6° | 39.6° |
| H8 | C8 | C9 | C10 | 67.3° | 61.6° |
| H8 | C8 | C9 | C11 | 61.2° | 60.4° |
| H8 | C8 | C9 | H9 | 176.8° | 179.9° |
| H8 | C8 | C14 | C13 | 50.4° | 55.1° |
| H8 | C8 | C14 | C15 | 71.4° | 57.9° |
| H8 | C8 | C14 | H14 | 174.0° | 175.7° |
| C10 | C9 | C11 | H9 | 115.3° | 119.2° |
| C10 | C9 | C11 | C12 | 174.0° | 176.2° |
| C10 | C9 | C11 | H111 | 60.7° | 63.3° |
| C10 | C9 | C11 | H112 | 48.8° | 55.7° |
| C9 | C10 | C19 | H191 | 60.9° | 179.5° |
| C9 | C10 | C19 | H192 | 64.4° | 60.5° |
| C9 | C10 | C19 | H193 | 173.8° | 59.5° |
| C11 | C9 | C10 | C19 | 67.4° | 62.0° |
| C9 | C11 | C12 | H111 | 125.3° | 120.5° |
| C9 | C11 | C12 | H112 | 125.2° | 120.5° |
| C9 | C11 | H111 | H112 | 116.6° | 119.1° |
| C9 | C11 | C12 | C13 | 41.3° | 55.3° |
| C9 | C11 | C12 | H121 | 83.9° | 62.0° |
| C9 | C11 | C12 | H122 | 166.6° | 176.8° |
| H9 | C9 | C10 | C19 | 177.6° | 178.8° |
| H9 | C9 | C11 | C12 | 70.6° | 64.6° |
| H9 | C9 | C11 | H111 | 54.6° | 55.9° |
| H9 | C9 | C11 | H112 | 164.1° | 174.9° |
| C10 | C19 | H191 | H192 | 125.3° | 120.1° |
| C10 | C19 | H191 | H193 | 125.2° | 120.0° |
| C10 | C19 | H192 | H193 | 117.6° | 120.0° |
| C12 | C11 | H111 | H112 | 116.6° | 119.0° |
| C11 | C12 | C13 | H121 | 125.3° | 118.9° |
| C11 | C12 | C13 | H122 | 125.2° | 120.9° |
| C11 | C12 | H121 | H122 | 116.8° | 121.1° |
| C11 | C12 | C13 | C14 | 47.9° | 61.3° |
| C11 | C12 | C13 | C17 | 167.7° | 178.2° |
| C11 | C12 | C13 | C18 | 69.7° | 54.9° |
| H111 | C11 | C12 | C13 | 166.6° | 175.8° |
| H111 | C11 | C12 | H121 | 41.3° | 58.5° |
| H111 | C11 | C12 | H122 | 68.2° | 62.7° |
| H112 | C11 | C12 | C13 | 83.9° | 65.2° |
| H112 | C11 | C12 | H121 | 150.9° | 177.4° |
| H112 | C11 | C12 | H122 | 41.4° | 56.3° |
| C13 | C12 | H121 | H122 | 116.8° | 120.8° |
| C12 | C13 | C14 | C17 | 124.9° | 126.1° |
| C12 | C13 | C14 | C18 | 117.1° | 118.2° |
| C12 | C13 | C17 | C18 | 121.2° | 126.9° |
| C12 | C13 | C14 | C15 | 165.5° | 170.5° |
| C12 | C13 | C14 | H14 | 49.0° | 53.2° |
| C12 | C13 | C17 | C16 | 158.2° | 148.9° |
| C12 | C13 | C17 | C20 | 79.0° | 92.2° |
| C12 | C13 | C17 | H17 | 36.3° | 29.9° |
| C12 | C13 | C18 | H181 | 180.0° | 53.9° |
| C12 | C13 | C18 | H182 | 54.7° | 173.8° |
| C12 | C13 | C18 | H183 | 54.7° | 66.2° |
| H121 | C12 | C13 | C14 | 77.4° | 57.6° |
| H121 | C12 | C13 | C17 | 42.4° | 59.3° |
| H121 | C12 | C13 | C18 | 165.0° | 173.8° |
| H122 | C12 | C13 | C14 | 173.1° | 177.8° |
| H122 | C12 | C13 | C17 | 67.1° | 60.9° |
| H122 | C12 | C13 | C18 | 55.5° | 66.0° |
| C14 | C13 | C17 | C18 | 116.8° | 113.4° |
| C13 | C14 | C15 | H14 | 124.2° | 117.2° |
| C13 | C14 | C15 | C16 | 27.7° | 41.6° |
| C13 | C14 | C15 | H151 | 97.6° | 159.9° |
| C13 | C14 | C15 | H152 | 153.0° | 76.8° |
| C14 | C13 | C17 | C16 | 36.1° | 29.2° |
| C14 | C13 | C17 | C20 | 158.9° | 148.2° |
| C14 | C13 | C17 | H17 | 85.8° | 89.8° |
| C14 | C13 | C18 | H181 | 61.0° | 63.4° |
| C14 | C13 | C18 | H182 | 173.7° | 56.5° |
| C14 | C13 | C18 | H183 | 64.2° | 176.5° |
| C17 | C13 | C14 | C15 | 40.6° | 44.4° |
| C17 | C13 | C14 | H14 | 75.9° | 72.9° |
| C13 | C17 | C16 | C15 | 17.9° | 3.5° |
| C13 | C17 | C16 | C20 | 122.5° | 119.0° |
| C13 | C17 | C16 | H17 | 122.2° | 119.1° |
| C13 | C17 | C16 | H161 | 107.3° | 122.7° |
| C13 | C17 | C16 | H162 | 143.2° | 115.9° |
| C13 | C17 | C20 | H17 | 122.1° | 122.0° |
| C17 | C13 | C18 | H181 | 54.5° | 174.7° |
| C17 | C13 | C18 | H182 | 70.8° | 54.7° |
| C17 | C13 | C18 | H183 | 179.8° | 65.3° |
| C13 | C17 | C20 | O20 | 68.0° | 89.5° |
| C13 | C17 | C20 | C21 | 110.9° | 90.5° |
| C18 | C13 | C14 | C15 | 77.4° | 71.4° |
| C18 | C13 | C14 | H14 | 166.1° | 171.4° |
| C18 | C13 | C17 | C16 | 80.7° | 84.2° |
| C18 | C13 | C17 | C20 | 42.1° | 34.7° |
| C18 | C13 | C17 | H17 | 157.4° | 156.8° |
| C13 | C18 | H181 | H182 | 125.3° | 119.9° |
| C13 | C18 | H181 | H183 | 125.3° | 120.0° |
| C13 | C18 | H182 | H183 | 119.0° | 120.0° |
| C14 | C15 | C16 | H151 | 125.3° | 118.4° |
| C14 | C15 | C16 | H152 | 125.3° | 118.4° |
| C14 | C15 | H151 | H152 | 119.9° | 123.3° |
| C14 | C15 | C16 | C17 | 5.3° | 23.9° |
| C14 | C15 | C16 | H161 | 130.6° | 95.3° |
| C14 | C15 | C16 | H162 | 119.9° | 143.2° |
| H14 | C14 | C15 | C16 | 96.5° | 75.6° |
| H14 | C14 | C15 | H151 | 138.2° | 42.7° |
| H14 | C14 | C15 | H152 | 28.8° | 166.0° |
| C16 | C15 | H151 | H152 | 119.9° | 123.2° |
| C15 | C16 | C17 | H161 | 125.2° | 119.2° |
| C15 | C16 | C17 | H162 | 125.3° | 119.3° |
| C15 | C16 | H161 | H162 | 119.2° | 121.6° |
| C15 | C16 | C17 | C20 | 140.4° | 122.4° |
| C15 | C16 | C17 | H17 | 104.3° | 115.6° |
| H151 | C15 | C16 | C17 | 119.9° | 142.3° |
| H151 | C15 | C16 | H161 | 5.3° | 23.1° |
| H151 | C15 | C16 | H162 | 114.8° | 98.4° |
| H152 | C15 | C16 | C17 | 130.6° | 94.5° |
| H152 | C15 | C16 | H161 | 104.1° | 146.3° |
| H152 | C15 | C16 | H162 | 5.4° | 24.8° |
| C17 | C16 | H161 | H162 | 119.2° | 121.5° |
| C16 | C17 | C20 | H17 | 121.8° | 122.0° |
| C16 | C17 | C20 | O20 | 48.1° | 26.4° |
| C16 | C17 | C20 | C21 | 132.9° | 153.6° |
| H161 | C16 | C17 | C20 | 15.2° | 118.4° |
| H161 | C16 | C17 | H17 | 130.5° | 3.6° |
| H162 | C16 | C17 | C20 | 94.3° | 3.1° |
| H162 | C16 | C17 | H17 | 21.0° | 125.1° |
| C17 | C20 | O20 | C21 | 178.9° | 180.0° |
| C17 | C20 | C21 | H211 | 180.0° | 180.0° |
| C17 | C20 | C21 | H212 | 54.7° | 60.1° |
| C17 | C20 | C21 | H213 | 54.8° | 60.0° |
| H17 | C17 | C20 | O20 | 169.9° | 148.4° |
| H17 | C17 | C20 | C21 | 11.2° | 31.6° |
| H181 | C18 | H182 | H183 | 118.8° | 120.1° |
| H191 | C19 | H192 | H193 | 117.5° | 120.0° |
| O20 | C20 | C21 | H211 | 1.0° | 0.0° |
| O20 | C20 | C21 | H212 | 126.3° | 120.0° |
| O20 | C20 | C21 | H213 | 124.2° | 120.0° |
| C20 | C21 | H211 | H212 | 125.2° | 120.0° |
| C20 | C21 | H211 | H213 | 125.2° | 120.0° |
| C20 | C21 | H212 | H213 | 114.1° | 120.0° |
| H211 | C21 | H212 | H213 | 114.2° | 120.0° |
| OH1 | CH1 | CH2 | CH3 | 97.2° | 0.0° |
| OH1 | CH1 | CH2 | HH21 | 137.5° | 120.0° |
| OH1 | CH1 | CH2 | HH22 | 28.0° | 120.0° |
| CH1 | CH2 | CH3 | HH21 | 125.3° | 120.0° |
| CH1 | CH2 | CH3 | HH22 | 125.3° | 120.1° |
| CH1 | CH2 | HH21 | HH22 | 117.3° | 120.0° |
| CH1 | CH2 | CH3 | CH4 | 72.0° | 179.9° |
| CH1 | CH2 | CH3 | HH31 | 162.8° | 60.0° |
| CH1 | CH2 | CH3 | HH32 | 53.3° | 59.9° |
| CH3 | CH2 | HH21 | HH22 | 117.2° | 120.0° |
| CH2 | CH3 | CH4 | HH31 | 125.2° | 120.0° |
| CH2 | CH3 | CH4 | HH32 | 125.3° | 120.0° |
| CH2 | CH3 | HH31 | HH32 | 117.7° | 120.0° |
| CH2 | CH3 | CH4 | OH4 | 25.4° | 0.1° |
| CH2 | CH3 | CH4 | OH5 | 154.4° | 179.9° |
| HH21 | CH2 | CH3 | CH4 | 53.3° | 60.0° |
| HH21 | CH2 | CH3 | HH31 | 71.9° | 180.0° |
| HH21 | CH2 | CH3 | HH32 | 178.6° | 60.0° |
| HH22 | CH2 | CH3 | CH4 | 162.7° | 60.0° |
| HH22 | CH2 | CH3 | HH31 | 37.5° | 60.0° |
| HH22 | CH2 | CH3 | HH32 | 72.0° | NaN° |
| CH4 | CH3 | HH31 | HH32 | 117.7° | 120.0° |
| CH3 | CH4 | OH4 | OH5 | 179.9° | 179.9° |
| CH3 | CH4 | OH5 | HOH5 | 179.9° | 180.0° |
| HH31 | CH3 | CH4 | OH4 | 99.8° | 119.9° |
| HH31 | CH3 | CH4 | OH5 | 80.3° | 59.9° |
| HH32 | CH3 | CH4 | OH4 | 150.7° | 120.1° |
| HH32 | CH3 | CH4 | OH5 | 29.1° | 60.0° |
| OH4 | CH4 | OH5 | HOH5 | 0.2° | 0.1° |
