TH2
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.53Å | 1.56Å | |
C1 | C10 | sing | 1.53Å | 1.58Å | |
C1 | H1C1 | sing | 1.09Å | 1.10Å | |
C1 | H1C2 | sing | 1.09Å | 1.10Å | |
C2 | C3 | sing | 1.52Å | 1.52Å | |
C2 | H2C1 | sing | 1.09Å | 1.10Å | |
C2 | H2C2 | sing | 1.09Å | 1.10Å | |
C3 | O3 | doub | 1.21Å | 1.20Å | |
C3 | C4 | sing | 1.47Å | 1.47Å | |
C4 | C5 | doub | 1.33Å | 1.37Å | |
C4 | H4 | sing | 1.08Å | 1.08Å | |
C5 | C6 | sing | 1.52Å | 1.53Å | |
C5 | C10 | sing | 1.49Å | 1.57Å | |
C6 | C7 | sing | 1.53Å | 1.54Å | |
C6 | H6C1 | sing | 1.09Å | 1.10Å | |
C6 | H6C2 | sing | 1.09Å | 1.10Å | |
C7 | C8 | sing | 1.53Å | 1.55Å | |
C7 | H7C1 | sing | 1.09Å | 1.10Å | |
C7 | H7C2 | sing | 1.09Å | 1.10Å | |
C8 | C9 | sing | 1.54Å | 1.55Å | |
C8 | C14 | sing | 1.53Å | 1.54Å | |
C8 | H8 | sing | 1.09Å | 1.10Å | |
C9 | C10 | sing | 1.53Å | 1.58Å | |
C9 | C11 | sing | 1.53Å | 1.58Å | |
C9 | H9 | sing | 1.09Å | 1.10Å | |
C10 | C19 | sing | 1.53Å | 1.56Å | |
C11 | C12 | sing | 1.54Å | 1.56Å | |
C11 | H111 | sing | 1.09Å | 1.10Å | |
C11 | H112 | sing | 1.09Å | 1.10Å | |
C12 | C13 | sing | 1.52Å | 1.55Å | |
C12 | H121 | sing | 1.09Å | 1.10Å | |
C12 | H122 | sing | 1.09Å | 1.10Å | |
C13 | C14 | sing | 1.55Å | 1.56Å | |
C13 | C17 | sing | 1.52Å | 1.54Å | |
C13 | C18 | sing | 1.53Å | 1.57Å | |
C14 | C15 | sing | 1.53Å | 1.55Å | |
C14 | H14 | sing | 1.09Å | 1.10Å | |
C15 | C16 | sing | 1.55Å | 1.55Å | |
C15 | H151 | sing | 1.09Å | 1.10Å | |
C15 | H152 | sing | 1.09Å | 1.10Å | |
C16 | C17 | sing | 1.56Å | 1.56Å | |
C16 | H161 | sing | 1.09Å | 1.10Å | |
C16 | H162 | sing | 1.09Å | 1.10Å | |
C17 | O17 | sing | 1.45Å | 1.44Å | |
C17 | H17 | sing | 1.09Å | 1.10Å | |
O17 | C20 | sing | 1.34Å | 1.16Å | |
C18 | H181 | sing | 1.09Å | 1.10Å | |
C18 | H182 | sing | 1.09Å | 1.10Å | |
C18 | H183 | sing | 1.09Å | 1.10Å | |
C20 | O20 | doub | 1.21Å | 1.26Å | |
C20 | C22 | sing | 1.51Å | 1.49Å | |
C21 | C22 | sing | 1.53Å | 1.54Å | |
C21 | C23 | sing | 1.51Å | 1.51Å | |
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 | |
C23 | O23 | doub | 1.21Å | 1.25Å | |
C23 | O24 | sing | 1.34Å | 1.27Å | |
O24 | H24 | sing | 0.97Å | 0.95Å | |
C19 | H191 | sing | 1.09Å | 1.10Å | |
C19 | H192 | sing | 1.09Å | 1.10Å | |
C19 | H193 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | C10 | 114.5° | 111.6° |
C2 | C1 | H1C1 | 106.7° | 109.0° |
C2 | C1 | H1C2 | 107.8° | 109.1° |
C1 | C2 | C3 | 114.7° | 107.4° |
C1 | C2 | H2C1 | 106.5° | 109.8° |
C1 | C2 | H2C2 | 107.7° | 109.8° |
C10 | C1 | H1C1 | 106.6° | 109.0° |
C10 | C1 | H1C2 | 107.8° | 109.3° |
C1 | C10 | C5 | 108.3° | 114.1° |
C1 | C10 | C9 | 109.3° | 108.5° |
C1 | C10 | C19 | 111.3° | 108.1° |
H1C1 | C1 | H1C2 | 113.5° | 108.9° |
C3 | C2 | H2C1 | 106.6° | 109.9° |
C3 | C2 | H2C2 | 107.8° | 109.9° |
C2 | C3 | O3 | 123.1° | 121.8° |
C2 | C3 | C4 | 117.5° | 116.4° |
H2C1 | C2 | H2C2 | 113.7° | 109.9° |
O3 | C3 | C4 | 119.4° | 121.8° |
C3 | C4 | C5 | 124.6° | 120.0° |
C3 | C4 | H4 | 117.7° | 120.0° |
C5 | C4 | H4 | 117.7° | 120.0° |
C4 | C5 | C6 | 118.5° | 117.7° |
C4 | C5 | C10 | 121.9° | 123.9° |
C6 | C5 | C10 | 119.5° | 118.4° |
C5 | C6 | C7 | 115.1° | 108.6° |
C5 | C6 | H6C1 | 106.3° | 109.6° |
C5 | C6 | H6C2 | 107.6° | 109.6° |
C5 | C10 | C9 | 110.7° | 110.5° |
C5 | C10 | C19 | 106.1° | 107.4° |
C7 | C6 | H6C1 | 106.3° | 109.6° |
C7 | C6 | H6C2 | 107.6° | 109.6° |
C6 | C7 | C8 | 111.8° | 109.1° |
C6 | C7 | H7C1 | 108.2° | 109.5° |
C6 | C7 | H7C2 | 108.7° | 109.5° |
H6C1 | C6 | H6C2 | 114.0° | 109.8° |
C8 | C7 | H7C1 | 108.1° | 109.5° |
C8 | C7 | H7C2 | 108.7° | 109.6° |
C7 | C8 | C9 | 111.4° | 109.1° |
C7 | C8 | C14 | 112.8° | 110.0° |
C7 | C8 | H8 | 105.3° | 109.9° |
H7C1 | C7 | H7C2 | 111.3° | 109.6° |
C9 | C8 | C14 | 108.0° | 107.1° |
C9 | C8 | H8 | 110.5° | 109.9° |
C8 | C9 | C10 | 113.1° | 108.8° |
C8 | C9 | C11 | 115.8° | 111.8° |
C8 | C9 | H9 | 101.6° | 109.0° |
C14 | C8 | H8 | 108.9° | 110.7° |
C8 | C14 | C13 | 113.1° | 106.9° |
C8 | C14 | C15 | 118.4° | 115.6° |
C8 | C14 | H14 | 98.7° | 110.4° |
C10 | C9 | C11 | 107.6° | 109.1° |
C10 | C9 | H9 | 110.8° | 109.0° |
C9 | C10 | C19 | 111.0° | 108.0° |
C11 | C9 | H9 | 107.7° | 109.0° |
C9 | C11 | C12 | 109.2° | 111.7° |
C9 | C11 | H111 | 109.6° | 109.1° |
C9 | C11 | H112 | 109.5° | 109.0° |
C10 | C19 | H191 | 109.4° | 109.5° |
C10 | C19 | H192 | 109.5° | 109.5° |
C10 | C19 | H193 | 109.5° | 109.5° |
C12 | C11 | H111 | 109.6° | 109.0° |
C12 | C11 | H112 | 109.6° | 109.0° |
C11 | C12 | C13 | 111.9° | 107.1° |
C11 | C12 | H121 | 108.2° | 110.0° |
C11 | C12 | H122 | 108.7° | 110.0° |
H111 | C11 | H112 | 109.3° | 109.0° |
C13 | C12 | H121 | 108.1° | 109.9° |
C13 | C12 | H122 | 108.7° | 109.9° |
C12 | C13 | C14 | 107.9° | 107.2° |
C12 | C13 | C17 | 115.9° | 116.7° |
C12 | C13 | C18 | 110.3° | 109.7° |
H121 | C12 | H122 | 111.3° | 110.0° |
C14 | C13 | C17 | 97.4° | 103.4° |
C14 | C13 | C18 | 113.7° | 109.8° |
C13 | C14 | C15 | 104.7° | 102.1° |
C13 | C14 | H14 | 114.0° | 111.0° |
C17 | C13 | C18 | 111.1° | 109.8° |
C13 | C17 | C16 | 103.7° | 105.4° |
C13 | C17 | O17 | 111.3° | 110.7° |
C13 | C17 | H17 | 112.9° | 109.8° |
C13 | C18 | H181 | 109.4° | 109.5° |
C13 | C18 | H182 | 109.5° | 109.4° |
C13 | C18 | H183 | 109.5° | 109.5° |
C15 | C14 | H14 | 108.2° | 110.5° |
C14 | C15 | C16 | 103.4° | 103.0° |
C14 | C15 | H151 | 112.9° | 110.7° |
C14 | C15 | H152 | 111.5° | 110.7° |
C16 | C15 | H151 | 112.9° | 110.7° |
C16 | C15 | H152 | 111.6° | 110.7° |
C15 | C16 | C17 | 105.7° | 106.2° |
C15 | C16 | H161 | 111.5° | 110.1° |
C15 | C16 | H162 | 110.7° | 110.1° |
H151 | C15 | H152 | 104.8° | 110.8° |
C17 | C16 | H161 | 111.6° | 110.0° |
C17 | C16 | H162 | 110.7° | 110.3° |
C16 | C17 | O17 | 111.9° | 110.3° |
C16 | C17 | H17 | 112.4° | 110.3° |
H161 | C16 | H162 | 106.6° | 110.1° |
O17 | C17 | H17 | 104.9° | 110.3° |
C17 | O17 | C20 | 127.1° | 120.0° |
O17 | C20 | O20 | 122.7° | 120.0° |
O17 | C20 | C22 | 127.8° | 120.0° |
H181 | C18 | H182 | 109.5° | 109.5° |
H181 | C18 | H183 | 109.4° | 109.5° |
H182 | C18 | H183 | 109.4° | 109.5° |
O20 | C20 | C22 | 109.4° | 120.1° |
C20 | C22 | C21 | 107.2° | 109.4° |
C20 | C22 | H221 | 110.7° | 109.5° |
C20 | C22 | H222 | 110.3° | 109.5° |
C22 | C21 | C23 | 110.0° | 109.4° |
C22 | C21 | H211 | 109.2° | 109.5° |
C22 | C21 | H212 | 109.3° | 109.5° |
C21 | C22 | H221 | 110.8° | 109.5° |
C21 | C22 | H222 | 110.2° | 109.5° |
C23 | C21 | H211 | 109.1° | 109.5° |
C23 | C21 | H212 | 109.3° | 109.5° |
C21 | C23 | O23 | 115.8° | 120.1° |
C21 | C23 | O24 | 119.0° | 120.0° |
H211 | C21 | H212 | 109.9° | 109.5° |
H221 | C22 | H222 | 107.7° | 109.5° |
O23 | C23 | O24 | 124.9° | 120.0° |
C23 | O24 | H24 | 109.5° | 120.0° |
H191 | C19 | H192 | 109.5° | 109.4° |
H191 | C19 | H193 | 109.5° | 109.4° |
H192 | C19 | H193 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | C10 | H1C1 | 117.8° | 120.4° |
C2 | C1 | C10 | H1C2 | 120.0° | 120.7° |
C2 | C1 | H1C1 | H1C2 | 118.6° | 118.9° |
C1 | C2 | C3 | H2C1 | 117.6° | 119.5° |
C1 | C2 | C3 | H2C2 | 120.0° | 119.5° |
C1 | C2 | H2C1 | H2C2 | 118.5° | 121.0° |
C1 | C2 | C3 | O3 | 164.1° | 130.3° |
C1 | C2 | C3 | C4 | 17.5° | 49.7° |
C2 | C1 | C10 | C5 | 47.6° | 38.7° |
C2 | C1 | C10 | C9 | 168.4° | 162.4° |
C2 | C1 | C10 | C19 | 68.7° | 80.7° |
C10 | C1 | H1C1 | H1C2 | 118.6° | 119.1° |
C10 | C1 | C2 | C3 | 45.2° | 57.4° |
C10 | C1 | C2 | H2C1 | 162.8° | 176.9° |
C10 | C1 | C2 | H2C2 | 74.8° | 62.1° |
C1 | C10 | C5 | C4 | 26.4° | 8.9° |
C1 | C10 | C5 | C6 | 155.8° | 171.6° |
C1 | C10 | C5 | C9 | 119.8° | 122.6° |
C1 | C10 | C5 | C19 | 119.6° | 119.8° |
C1 | C10 | C9 | C8 | 165.8° | 179.1° |
C1 | C10 | C9 | C19 | 123.1° | 117.0° |
C1 | C10 | C9 | C11 | 65.0° | 58.7° |
C1 | C10 | C9 | H9 | 52.5° | 60.3° |
C1 | C10 | C19 | H191 | 108.1° | 60.0° |
C1 | C10 | C19 | H192 | 131.9° | 180.0° |
C1 | C10 | C19 | H193 | 11.9° | 60.0° |
H1C1 | C1 | C2 | C3 | 162.9° | 63.0° |
H1C1 | C1 | C2 | H2C1 | 79.5° | 56.5° |
H1C1 | C1 | C2 | H2C2 | 42.9° | 177.5° |
H1C1 | C1 | C10 | C5 | 165.4° | 81.7° |
H1C1 | C1 | C10 | C9 | 73.9° | 41.9° |
H1C1 | C1 | C10 | C19 | 49.1° | 158.9° |
H1C2 | C1 | C2 | C3 | 74.9° | 178.3° |
H1C2 | C1 | C2 | H2C1 | 42.8° | 62.2° |
H1C2 | C1 | C2 | H2C2 | 165.2° | 58.8° |
H1C2 | C1 | C10 | C5 | 72.4° | 159.4° |
H1C2 | C1 | C10 | C9 | 48.3° | 76.9° |
H1C2 | C1 | C10 | C19 | 171.3° | 40.0° |
C3 | C2 | H2C1 | H2C2 | 118.6° | 121.1° |
C2 | C3 | O3 | C4 | 178.4° | 180.0° |
C2 | C3 | C4 | C5 | 5.1° | 21.6° |
C2 | C3 | C4 | H4 | 174.9° | 158.4° |
H2C1 | C2 | C3 | O3 | 46.5° | 10.9° |
H2C1 | C2 | C3 | C4 | 135.1° | 169.2° |
H2C2 | C2 | C3 | O3 | 75.9° | 110.2° |
H2C2 | C2 | C3 | C4 | 102.5° | 69.8° |
O3 | C3 | C4 | C5 | 173.3° | 158.4° |
O3 | C3 | C4 | H4 | 6.7° | 21.6° |
C3 | C4 | C5 | H4 | 180.0° | 180.0° |
C3 | C4 | C5 | C6 | 178.2° | 179.2° |
C3 | C4 | C5 | C10 | 0.4° | 0.3° |
C4 | C5 | C6 | C10 | 177.9° | 179.6° |
C4 | C5 | C6 | C7 | 145.9° | 130.6° |
C4 | C5 | C6 | H6C1 | 28.5° | 10.9° |
C4 | C5 | C6 | H6C2 | 94.1° | 109.6° |
C4 | C5 | C10 | C9 | 146.3° | 131.5° |
C4 | C5 | C10 | C19 | 93.1° | 110.9° |
H4 | C4 | C5 | C6 | 1.8° | 0.8° |
H4 | C4 | C5 | C10 | 179.6° | 179.7° |
C5 | C6 | C7 | H6C1 | 117.4° | 119.7° |
C5 | C6 | C7 | H6C2 | 120.0° | 119.7° |
C5 | C6 | H6C1 | H6C2 | 118.4° | 120.5° |
C5 | C6 | C7 | C8 | 45.1° | 55.5° |
C5 | C6 | C7 | H7C1 | 73.9° | 64.4° |
C5 | C6 | C7 | H7C2 | 165.1° | 175.4° |
C6 | C5 | C10 | C9 | 35.9° | 49.0° |
C6 | C5 | C10 | C19 | 84.7° | 68.6° |
C10 | C5 | C6 | C7 | 36.2° | 49.8° |
C10 | C5 | C6 | H6C1 | 153.7° | 169.5° |
C10 | C5 | C6 | H6C2 | 83.8° | 69.9° |
C5 | C10 | C9 | C8 | 46.5° | 53.3° |
C5 | C10 | C9 | C19 | 117.6° | 117.2° |
C5 | C10 | C9 | C11 | 175.7° | 175.5° |
C5 | C10 | C9 | H9 | 66.7° | 65.5° |
C5 | C10 | C19 | H191 | 134.3° | 63.6° |
C5 | C10 | C19 | H192 | 14.2° | 56.4° |
C5 | C10 | C19 | H193 | 105.7° | 176.5° |
C7 | C6 | H6C1 | H6C2 | 118.4° | 120.4° |
C6 | C7 | C8 | H7C1 | 119.0° | 119.9° |
C6 | C7 | C8 | H7C2 | 120.0° | 119.8° |
C6 | C7 | H7C1 | H7C2 | 119.3° | 120.1° |
C6 | C7 | C8 | C9 | 56.9° | 65.3° |
C6 | C7 | C8 | C14 | 178.5° | 177.6° |
C6 | C7 | C8 | H8 | 62.9° | 55.4° |
H6C1 | C6 | C7 | C8 | 162.5° | 175.3° |
H6C1 | C6 | C7 | H7C1 | 43.5° | 55.3° |
H6C1 | C6 | C7 | H7C2 | 77.4° | 64.9° |
H6C2 | C6 | C7 | C8 | 74.9° | 64.2° |
H6C2 | C6 | C7 | H7C1 | 166.1° | 175.9° |
H6C2 | C6 | C7 | H7C2 | 45.1° | 55.7° |
C8 | C7 | H7C1 | H7C2 | 119.4° | 120.2° |
C7 | C8 | C9 | C14 | 124.4° | 119.0° |
C7 | C8 | C9 | H8 | 116.6° | 120.6° |
C7 | C8 | C14 | H8 | 116.5° | 121.7° |
C7 | C8 | C9 | C10 | 58.9° | 63.3° |
C7 | C8 | C9 | C11 | 176.2° | 176.1° |
C7 | C8 | C9 | H9 | 59.9° | 55.5° |
C7 | C8 | C14 | C13 | 179.8° | 177.2° |
C7 | C8 | C14 | C15 | 56.8° | 64.3° |
C7 | C8 | C14 | H14 | 59.4° | 62.0° |
H7C1 | C7 | C8 | C9 | 62.1° | 54.7° |
H7C1 | C7 | C8 | C14 | 59.5° | 62.5° |
H7C1 | C7 | C8 | H8 | 178.1° | 175.3° |
H7C2 | C7 | C8 | C9 | 176.9° | 174.9° |
H7C2 | C7 | C8 | C14 | 61.5° | 57.7° |
H7C2 | C7 | C8 | H8 | 57.1° | 64.5° |
C9 | C8 | C14 | H8 | 120.0° | 119.9° |
C8 | C9 | C10 | C11 | 129.2° | 122.2° |
C8 | C9 | C10 | H9 | 113.3° | 118.8° |
C8 | C9 | C11 | H9 | 112.9° | 120.6° |
C8 | C9 | C10 | C19 | 71.1° | 63.9° |
C8 | C9 | C11 | C12 | 51.3° | 54.4° |
C8 | C9 | C11 | H111 | 68.8° | 66.2° |
C8 | C9 | C11 | H112 | 171.3° | 174.9° |
C9 | C8 | C14 | C13 | 56.7° | 64.4° |
C9 | C8 | C14 | C15 | 179.7° | 177.2° |
C9 | C8 | C14 | H14 | 64.1° | 56.5° |
C14 | C8 | C9 | C10 | 176.7° | 177.7° |
C14 | C8 | C9 | C11 | 51.8° | 57.1° |
C14 | C8 | C9 | H9 | 64.6° | 63.5° |
C8 | C14 | C13 | C12 | 61.6° | 70.5° |
C8 | C14 | C13 | C15 | 130.3° | 121.8° |
C8 | C14 | C13 | H14 | 111.7° | 120.5° |
C8 | C14 | C13 | C17 | 178.0° | 165.7° |
C8 | C14 | C13 | C18 | 61.1° | 48.6° |
C8 | C14 | C15 | H14 | 111.0° | 126.3° |
C8 | C14 | C15 | C16 | 157.6° | 157.0° |
C8 | C14 | C15 | H151 | 80.1° | 38.6° |
C8 | C14 | C15 | H152 | 37.6° | 84.7° |
H8 | C8 | C9 | C10 | 57.7° | 57.3° |
H8 | C8 | C9 | C11 | 67.1° | 63.2° |
H8 | C8 | C9 | H9 | 176.5° | 176.1° |
H8 | C8 | C14 | C13 | 63.2° | 55.5° |
H8 | C8 | C14 | C15 | 59.8° | 57.4° |
H8 | C8 | C14 | H14 | 176.0° | 176.3° |
C10 | C9 | C11 | H9 | 119.5° | 119.0° |
C10 | C9 | C11 | C12 | 178.9° | 174.8° |
C10 | C9 | C11 | H111 | 58.8° | 54.3° |
C10 | C9 | C11 | H112 | 61.1° | 64.6° |
C9 | C10 | C19 | H191 | 13.9° | 177.2° |
C9 | C10 | C19 | H192 | 106.1° | 62.8° |
C9 | C10 | C19 | H193 | 133.9° | 57.3° |
C11 | C9 | C10 | C19 | 58.1° | 58.3° |
C9 | C11 | C12 | H111 | 120.1° | 120.6° |
C9 | C11 | C12 | H112 | 120.0° | 120.5° |
C9 | C11 | H111 | H112 | 120.0° | 118.9° |
C9 | C11 | C12 | C13 | 54.2° | 57.5° |
C9 | C11 | C12 | H121 | 173.2° | 176.8° |
C9 | C11 | C12 | H122 | 65.8° | 61.9° |
H9 | C9 | C10 | C19 | 175.6° | 177.3° |
H9 | C9 | C11 | C12 | 61.5° | 66.2° |
H9 | C9 | C11 | H111 | 178.4° | 173.2° |
H9 | C9 | C11 | H112 | 58.5° | 54.4° |
C10 | C19 | H191 | H192 | 120.0° | 120.1° |
C10 | C19 | H191 | H193 | 120.0° | 120.0° |
C10 | C19 | H192 | H193 | 120.0° | 120.0° |
C12 | C11 | H111 | H112 | 120.1° | 118.9° |
C11 | C12 | C13 | H121 | 119.0° | 119.4° |
C11 | C12 | C13 | H122 | 120.0° | 119.4° |
C11 | C12 | H121 | H122 | 119.4° | 121.2° |
C11 | C12 | C13 | C14 | 59.5° | 65.0° |
C11 | C12 | C13 | C17 | 167.4° | 179.7° |
C11 | C12 | C13 | C18 | 65.3° | 54.1° |
H111 | C11 | C12 | C13 | 65.9° | 63.1° |
H111 | C11 | C12 | H121 | 53.1° | 56.2° |
H111 | C11 | C12 | H122 | 174.1° | 177.5° |
H112 | C11 | C12 | C13 | 174.2° | 178.0° |
H112 | C11 | C12 | H121 | 66.8° | 62.7° |
H112 | C11 | C12 | H122 | 54.2° | 58.6° |
C13 | C12 | H121 | H122 | 119.3° | 121.1° |
C12 | C13 | C14 | C17 | 120.3° | 123.8° |
C12 | C13 | C14 | C18 | 122.7° | 119.1° |
C12 | C13 | C17 | C18 | 126.9° | 125.6° |
C12 | C13 | C14 | C15 | 168.1° | 167.7° |
C12 | C13 | C14 | H14 | 50.1° | 49.9° |
C12 | C13 | C17 | C16 | 160.6° | 145.9° |
C12 | C13 | C17 | O17 | 79.0° | 94.8° |
C12 | C13 | C17 | H17 | 38.7° | 27.2° |
C12 | C13 | C18 | H181 | 100.6° | 56.3° |
C12 | C13 | C18 | H182 | 139.4° | 176.3° |
C12 | C13 | C18 | H183 | 19.4° | 63.7° |
H121 | C12 | C13 | C14 | 178.5° | 175.6° |
H121 | C12 | C13 | C17 | 73.6° | 60.3° |
H121 | C12 | C13 | C18 | 53.7° | 65.3° |
H122 | C12 | C13 | C14 | 60.5° | 54.4° |
H122 | C12 | C13 | C17 | 47.4° | 60.8° |
H122 | C12 | C13 | C18 | 174.7° | 173.5° |
C14 | C13 | C17 | C18 | 119.0° | 117.1° |
C13 | C14 | C15 | H14 | 121.9° | 118.1° |
C13 | C14 | C15 | C16 | 30.5° | 41.4° |
C13 | C14 | C15 | H151 | 152.8° | 77.0° |
C13 | C14 | C15 | H152 | 89.5° | 159.8° |
C14 | C13 | C17 | C16 | 46.5° | 28.6° |
C14 | C13 | C17 | O17 | 166.9° | 147.8° |
C14 | C13 | C17 | H17 | 75.4° | 90.2° |
C14 | C13 | C18 | H181 | 138.1° | 61.2° |
C14 | C13 | C18 | H182 | 18.0° | 58.7° |
C14 | C13 | C18 | H183 | 102.0° | 178.8° |
C17 | C13 | C14 | C15 | 47.8° | 43.9° |
C17 | C13 | C14 | H14 | 70.2° | 73.9° |
C13 | C17 | C16 | C15 | 29.5° | 3.0° |
C13 | C17 | C16 | O17 | 120.1° | 119.5° |
C13 | C17 | C16 | H17 | 122.3° | 118.5° |
C13 | C17 | C16 | H161 | 150.9° | 116.1° |
C13 | C17 | C16 | H162 | 90.5° | 122.3° |
C13 | C17 | O17 | H17 | 122.4° | 121.8° |
C13 | C17 | O17 | C20 | 179.5° | 152.3° |
C17 | C13 | C18 | H181 | 29.4° | 174.2° |
C17 | C13 | C18 | H182 | 90.7° | 54.2° |
C17 | C13 | C18 | H183 | 149.4° | 65.8° |
C18 | C13 | C14 | C15 | 69.2° | 73.2° |
C18 | C13 | C14 | H14 | 172.8° | 169.1° |
C18 | C13 | C17 | C16 | 72.5° | 88.5° |
C18 | C13 | C17 | O17 | 48.0° | 30.8° |
C18 | C13 | C17 | H17 | 165.6° | 152.8° |
C13 | C18 | H181 | H182 | 120.0° | 120.0° |
C13 | C18 | H181 | H183 | 120.0° | 120.0° |
C13 | C18 | H182 | H183 | 120.0° | 120.0° |
C14 | C15 | C16 | H151 | 122.3° | 118.4° |
C14 | C15 | C16 | H152 | 120.0° | 118.3° |
C14 | C15 | H151 | H152 | 121.6° | 123.1° |
C14 | C15 | C16 | C17 | 0.7° | 23.9° |
C14 | C15 | C16 | H161 | 120.7° | 143.0° |
C14 | C15 | C16 | H162 | 120.7° | 95.4° |
H14 | C14 | C15 | C16 | 91.4° | 76.8° |
H14 | C14 | C15 | H151 | 30.9° | 164.8° |
H14 | C14 | C15 | H152 | 148.6° | 41.6° |
C16 | C15 | H151 | H152 | 121.7° | 123.3° |
C15 | C16 | C17 | H161 | 121.4° | 119.1° |
C15 | C16 | C17 | H162 | 120.0° | 119.2° |
C15 | C16 | H161 | H162 | 121.0° | 121.5° |
C15 | C16 | C17 | O17 | 149.6° | 122.6° |
C15 | C16 | C17 | H17 | 92.8° | 115.4° |
H151 | C15 | C16 | C17 | 123.0° | 94.4° |
H151 | C15 | C16 | H161 | 1.6° | 24.7° |
H151 | C15 | C16 | H162 | 117.0° | 146.2° |
H152 | C15 | C16 | C17 | 119.2° | 142.3° |
H152 | C15 | C16 | H161 | 119.3° | 98.6° |
H152 | C15 | C16 | H162 | 0.7° | 22.9° |
C17 | C16 | H161 | H162 | 121.0° | 121.8° |
C16 | C17 | O17 | H17 | 122.1° | 122.0° |
C16 | C17 | O17 | C20 | 64.0° | 91.4° |
H161 | C16 | C17 | O17 | 89.0° | 3.5° |
H161 | C16 | C17 | H17 | 28.7° | 125.5° |
H162 | C16 | C17 | O17 | 29.6° | 118.2° |
H162 | C16 | C17 | H17 | 147.3° | 3.8° |
C17 | O17 | C20 | O20 | 19.6° | 0.0° |
C17 | O17 | C20 | C22 | 164.1° | 180.0° |
H17 | C17 | O17 | C20 | 58.1° | 30.6° |
O17 | C20 | O20 | C22 | 176.9° | 180.0° |
O17 | C20 | C22 | C21 | 52.6° | 180.0° |
O17 | C20 | C22 | H221 | 68.4° | 60.0° |
O17 | C20 | C22 | H222 | 172.5° | 60.0° |
H181 | C18 | H182 | H183 | 120.0° | 120.0° |
O20 | C20 | C22 | C21 | 130.8° | 0.0° |
O20 | C20 | C22 | H221 | 108.3° | 120.0° |
O20 | C20 | C22 | H222 | 10.8° | 120.0° |
C20 | C22 | C21 | H221 | 120.9° | 119.9° |
C20 | C22 | C21 | H222 | 120.0° | 120.0° |
C20 | C22 | C21 | C23 | 167.3° | 180.0° |
C20 | C22 | C21 | H211 | 73.0° | 60.0° |
C20 | C22 | C21 | H212 | 47.3° | 60.0° |
C20 | C22 | H221 | H222 | 120.6° | 120.0° |
C22 | C21 | C23 | H211 | 119.8° | 120.0° |
C22 | C21 | C23 | H212 | 120.0° | 120.0° |
C22 | C21 | H211 | H212 | 119.9° | 120.0° |
C21 | C22 | H221 | H222 | 120.6° | 120.0° |
C22 | C21 | C23 | O23 | 155.2° | 0.0° |
C22 | C21 | C23 | O24 | 18.8° | 180.0° |
C23 | C21 | H211 | H212 | 119.9° | 120.0° |
C23 | C21 | C22 | H221 | 46.4° | 60.1° |
C23 | C21 | C22 | H222 | 72.7° | 60.0° |
C21 | C23 | O23 | O24 | 173.6° | 180.0° |
C21 | C23 | O24 | H24 | 173.4° | 180.0° |
H211 | C21 | C22 | H221 | 166.1° | 180.0° |
H211 | C21 | C22 | H222 | 47.0° | 60.0° |
H211 | C21 | C23 | O23 | 35.5° | 120.0° |
H211 | C21 | C23 | O24 | 138.5° | 60.0° |
H212 | C21 | C22 | H221 | 73.6° | 60.0° |
H212 | C21 | C22 | H222 | 167.3° | 180.0° |
H212 | C21 | C23 | O23 | 84.8° | 120.0° |
H212 | C21 | C23 | O24 | 101.2° | 60.0° |
O23 | C23 | O24 | H24 | 0.0° | 0.0° |
H191 | C19 | H192 | H193 | 120.0° | 120.0° |