YSS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C11 | sing | 1.52Å | 1.45Å | |
| C10 | C09 | sing | 1.55Å | 1.56Å | |
| O4 | C11 | doub | 1.21Å | 1.27Å | |
| O3 | C09 | sing | 1.43Å | 1.41Å | |
| C11 | C12 | sing | 1.52Å | 1.47Å | |
| C09 | C08 | sing | 1.54Å | 1.58Å | |
| C12 | C08 | sing | 1.54Å | 1.52Å | |
| C12 | C13 | sing | 1.51Å | 1.48Å | |
| C08 | C07 | sing | 1.53Å | 1.57Å | |
| C13 | C14 | doub | 1.31Å | 1.37Å | |
| C07 | C06 | sing | 1.51Å | 1.49Å | |
| C14 | C15 | sing | 1.51Å | 1.55Å | |
| C06 | C05 | doub | 1.31Å | 1.38Å | |
| C21 | C15 | sing | 1.53Å | 1.53Å | |
| O5 | C15 | sing | 1.43Å | 1.43Å | |
| C15 | C16 | sing | 1.53Å | 1.56Å | |
| C05 | C04 | sing | 1.51Å | 1.49Å | |
| C04 | C03 | sing | 1.53Å | 1.56Å | |
| C03 | C02 | sing | 1.53Å | 1.54Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| O2 | C01 | doub | 1.21Å | 1.26Å | |
| C02 | C01 | sing | 1.51Å | 1.56Å | |
| C01 | O1 | sing | 1.34Å | 1.27Å | |
| C17 | C18 | sing | 1.53Å | 1.56Å | |
| C18 | C19 | sing | 1.53Å | 1.55Å | |
| C19 | C20 | sing | 1.53Å | 1.54Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.08Å | 1.08Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C02 | H11 | sing | 1.09Å | 1.10Å | |
| C02 | H12 | sing | 1.09Å | 1.10Å | |
| C03 | H13 | sing | 1.09Å | 1.10Å | |
| C03 | H14 | sing | 1.09Å | 1.10Å | |
| C04 | H15 | sing | 1.09Å | 1.10Å | |
| C04 | H16 | sing | 1.09Å | 1.10Å | |
| C05 | H17 | sing | 1.08Å | 1.08Å | |
| C06 | H18 | sing | 1.08Å | 1.08Å | |
| C07 | H19 | sing | 1.09Å | 1.10Å | |
| C07 | H20 | sing | 1.09Å | 1.10Å | |
| C08 | H21 | sing | 1.09Å | 1.10Å | |
| C09 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C14 | H24 | sing | 1.08Å | 1.08Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| O1 | H30 | sing | 0.97Å | 0.95Å | |
| O3 | H31 | sing | 0.97Å | 0.95Å | |
| O5 | H32 | sing | 0.97Å | 0.95Å | |
| C17 | H33 | sing | 1.09Å | 1.10Å | |
| C16 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | C10 | C09 | 104.2° | 102.9° |
| C10 | C11 | O4 | 123.9° | 127.5° |
| C10 | C11 | C12 | 111.9° | 104.8° |
| C11 | C10 | H1 | 110.8° | 110.8° |
| C11 | C10 | H2 | 110.8° | 110.7° |
| C10 | C09 | O3 | 110.2° | 110.5° |
| C10 | C09 | C08 | 105.8° | 103.7° |
| C09 | C10 | H1 | 110.8° | 110.7° |
| C09 | C10 | H2 | 110.8° | 110.7° |
| C10 | C09 | H22 | 109.9° | 110.6° |
| O4 | C11 | C12 | 124.2° | 127.7° |
| O3 | C09 | C08 | 108.7° | 110.6° |
| O3 | C09 | H22 | 112.2° | 110.6° |
| C09 | O3 | H31 | 109.5° | 114.0° |
| C11 | C12 | C08 | 104.3° | 106.8° |
| C11 | C12 | C13 | 113.6° | 110.0° |
| C11 | C12 | H23 | 105.4° | 110.0° |
| C09 | C08 | C12 | 102.6° | 106.0° |
| C09 | C08 | C07 | 114.9° | 110.1° |
| C09 | C08 | H21 | 108.0° | 110.1° |
| C08 | C09 | H22 | 109.7° | 110.6° |
| C08 | C12 | C13 | 122.1° | 110.0° |
| C12 | C08 | C07 | 114.2° | 110.1° |
| C12 | C08 | H21 | 108.7° | 110.2° |
| C08 | C12 | H23 | 104.8° | 110.0° |
| C12 | C13 | C14 | 134.4° | 120.1° |
| C12 | C13 | H3 | 112.8° | 120.0° |
| C13 | C12 | H23 | 105.2° | 110.0° |
| C08 | C07 | C06 | 112.9° | 109.4° |
| C08 | C07 | H19 | 108.6° | 109.4° |
| C08 | C07 | H20 | 108.6° | 109.5° |
| C07 | C08 | H21 | 108.1° | 110.1° |
| C13 | C14 | C15 | 115.8° | 120.1° |
| C14 | C13 | H3 | 112.8° | 120.0° |
| C13 | C14 | H24 | 122.0° | 120.0° |
| C07 | C06 | C05 | 117.2° | 120.0° |
| C07 | C06 | H18 | 121.4° | 120.0° |
| C06 | C07 | H19 | 108.6° | 109.5° |
| C06 | C07 | H20 | 108.6° | 109.5° |
| C14 | C15 | C21 | 103.5° | 109.5° |
| C14 | C15 | O5 | 106.6° | 109.4° |
| C14 | C15 | C16 | 111.8° | 109.5° |
| C15 | C14 | H24 | 122.1° | 120.0° |
| C06 | C05 | C04 | 133.2° | 120.0° |
| C06 | C05 | H17 | 113.4° | 120.0° |
| C05 | C06 | H18 | 121.4° | 120.1° |
| C21 | C15 | O5 | 110.4° | 109.5° |
| C21 | C15 | C16 | 114.5° | 109.5° |
| C15 | C21 | H8 | 109.5° | 109.4° |
| C15 | C21 | H9 | 109.5° | 109.5° |
| C15 | C21 | H10 | 109.5° | 109.5° |
| O5 | C15 | C16 | 109.6° | 109.4° |
| C15 | O5 | H32 | 109.5° | 114.0° |
| C15 | C16 | C17 | 118.1° | 109.5° |
| C15 | C16 | H25 | 107.3° | 109.4° |
| C15 | C16 | H34 | 107.3° | 109.5° |
| C05 | C04 | C03 | 118.6° | 109.5° |
| C05 | C04 | H15 | 107.1° | 109.5° |
| C05 | C04 | H16 | 107.2° | 109.5° |
| C04 | C05 | H17 | 113.4° | 120.0° |
| C04 | C03 | C02 | 114.9° | 109.5° |
| C04 | C03 | H13 | 108.1° | 109.5° |
| C04 | C03 | H14 | 108.1° | 109.5° |
| C03 | C04 | H15 | 107.2° | 109.4° |
| C03 | C04 | H16 | 107.1° | 109.5° |
| C03 | C02 | C01 | 115.4° | 109.5° |
| C03 | C02 | H11 | 108.0° | 109.4° |
| C03 | C02 | H12 | 108.0° | 109.5° |
| C02 | C03 | H13 | 108.1° | 109.4° |
| C02 | C03 | H14 | 108.1° | 109.4° |
| C16 | C17 | C18 | 116.0° | 109.5° |
| C16 | C17 | H4 | 107.8° | 109.5° |
| C17 | C16 | H25 | 107.3° | 109.5° |
| C16 | C17 | H33 | 107.8° | 109.5° |
| C17 | C16 | H34 | 107.3° | 109.5° |
| O2 | C01 | C02 | 118.5° | 120.0° |
| O2 | C01 | O1 | 122.3° | 120.0° |
| C02 | C01 | O1 | 119.2° | 120.0° |
| C01 | C02 | H11 | 108.0° | 109.5° |
| C01 | C02 | H12 | 108.0° | 109.5° |
| C01 | O1 | H30 | 109.5° | 117.0° |
| C17 | C18 | C19 | 116.1° | 109.5° |
| C18 | C17 | H4 | 107.8° | 109.5° |
| C17 | C18 | H26 | 107.8° | 109.5° |
| C17 | C18 | H27 | 107.8° | 109.5° |
| C18 | C17 | H33 | 107.8° | 109.4° |
| C18 | C19 | C20 | 115.3° | 109.5° |
| C19 | C18 | H26 | 107.8° | 109.5° |
| C19 | C18 | H27 | 107.8° | 109.4° |
| C18 | C19 | H28 | 108.0° | 109.4° |
| C18 | C19 | H29 | 108.0° | 109.5° |
| C19 | C20 | H5 | 109.5° | 109.5° |
| C19 | C20 | H6 | 109.5° | 109.5° |
| C19 | C20 | H7 | 109.5° | 109.5° |
| C20 | C19 | H28 | 108.0° | 109.5° |
| C20 | C19 | H29 | 108.0° | 109.5° |
| H1 | C10 | H2 | 109.5° | 110.8° |
| H4 | C17 | H33 | 109.5° | 109.5° |
| H5 | C20 | H6 | 109.5° | 109.4° |
| H5 | C20 | H7 | 109.4° | 109.5° |
| H6 | C20 | H7 | 109.5° | 109.5° |
| H8 | C21 | H9 | 109.4° | 109.5° |
| H8 | C21 | H10 | 109.5° | 109.5° |
| H9 | C21 | H10 | 109.5° | 109.5° |
| H11 | C02 | H12 | 109.4° | 109.5° |
| H13 | C03 | H14 | 109.5° | 109.5° |
| H15 | C04 | H16 | 109.4° | 109.4° |
| H19 | C07 | H20 | 109.5° | 109.5° |
| H25 | C16 | H34 | 109.5° | 109.5° |
| H26 | C18 | H27 | 109.5° | 109.4° |
| H28 | C19 | H29 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | C10 | C09 | H1 | 119.2° | 118.4° |
| C11 | C10 | C09 | H2 | 119.1° | 118.4° |
| C10 | C11 | O4 | C12 | 179.6° | 179.9° |
| C11 | C10 | C09 | O3 | 110.1° | 80.8° |
| C11 | C10 | C09 | C08 | 7.2° | 37.7° |
| C10 | C11 | C12 | C08 | 30.9° | 24.3° |
| C10 | C11 | C12 | C13 | 166.1° | 95.1° |
| C11 | C10 | H1 | H2 | 122.4° | 123.3° |
| C11 | C10 | C09 | H22 | 125.7° | 156.3° |
| C10 | C11 | C12 | H23 | 79.2° | 143.6° |
| C09 | C10 | C11 | O4 | 166.0° | 141.6° |
| C10 | C09 | O3 | C08 | 115.6° | 114.3° |
| C10 | C09 | O3 | H22 | 122.9° | 122.8° |
| C09 | C10 | C11 | C12 | 14.4° | 38.4° |
| C10 | C09 | C08 | H22 | 118.6° | 118.6° |
| C10 | C09 | C08 | C12 | 24.7° | 23.0° |
| C10 | C09 | C08 | C07 | 149.3° | 142.1° |
| C09 | C10 | H1 | H2 | 122.4° | 123.2° |
| C10 | C09 | C08 | H21 | 90.0° | 96.3° |
| C10 | C09 | O3 | H31 | 180.0° | 61.5° |
| O4 | C11 | C12 | C08 | 149.4° | 155.8° |
| O4 | C11 | C12 | C13 | 14.2° | 84.8° |
| O4 | C11 | C10 | H1 | 74.9° | 100.0° |
| O4 | C11 | C10 | H2 | 46.8° | 23.3° |
| O4 | C11 | C12 | H23 | 100.5° | 36.4° |
| O3 | C09 | C08 | H22 | 123.1° | 122.9° |
| O3 | C09 | C08 | C12 | 93.6° | 95.6° |
| O3 | C09 | C08 | C07 | 30.9° | 23.6° |
| O3 | C09 | C10 | H1 | 9.1° | 160.8° |
| O3 | C09 | C10 | H2 | 130.8° | 37.6° |
| O3 | C09 | C08 | H21 | 151.7° | 145.2° |
| C11 | C12 | C08 | C09 | 32.8° | 0.5° |
| C11 | C12 | C08 | C13 | 130.4° | 119.4° |
| C11 | C12 | C08 | H23 | 110.5° | 119.3° |
| C11 | C12 | C13 | H23 | 114.8° | 121.3° |
| C11 | C12 | C08 | C07 | 157.9° | 118.7° |
| C11 | C12 | C13 | C14 | 99.3° | 121.4° |
| C12 | C11 | C10 | H1 | 104.8° | 79.9° |
| C12 | C11 | C10 | H2 | 133.5° | 156.7° |
| C11 | C12 | C13 | H3 | 80.7° | 58.6° |
| C11 | C12 | C08 | H21 | 81.3° | 119.6° |
| C09 | C08 | C12 | C07 | 125.0° | 119.1° |
| C09 | C08 | C12 | H21 | 114.2° | 119.2° |
| C09 | C08 | C12 | C13 | 163.2° | 118.9° |
| C09 | C08 | C07 | H21 | 120.7° | 121.6° |
| C09 | C08 | C07 | C06 | 81.3° | 67.3° |
| C08 | C09 | C10 | H1 | 126.4° | 80.6° |
| C08 | C09 | C10 | H2 | 111.9° | 156.1° |
| C09 | C08 | C07 | H19 | 158.2° | 52.6° |
| C09 | C08 | C07 | H20 | 39.2° | 172.7° |
| C09 | C08 | C12 | H23 | 77.7° | 119.8° |
| C08 | C09 | O3 | H31 | 64.4° | 175.7° |
| C08 | C12 | C13 | H23 | 118.9° | 121.3° |
| C12 | C08 | C07 | H21 | 121.1° | 121.8° |
| C08 | C12 | C13 | C14 | 134.4° | 121.2° |
| C12 | C08 | C07 | C06 | 160.5° | 176.1° |
| C08 | C12 | C13 | H3 | 45.7° | 58.8° |
| C12 | C08 | C07 | H19 | 40.0° | 64.0° |
| C12 | C08 | C07 | H20 | 79.0° | 56.1° |
| C12 | C08 | C09 | H22 | 143.3° | 141.5° |
| C13 | C12 | C08 | C07 | 71.8° | 122.0° |
| C12 | C13 | C14 | H3 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 177.5° | 180.0° |
| C13 | C12 | C08 | H21 | 49.0° | 0.3° |
| C12 | C13 | C14 | H24 | 2.5° | 0.0° |
| C08 | C07 | C06 | H19 | 120.5° | 120.0° |
| C08 | C07 | C06 | H20 | 120.5° | 120.0° |
| C08 | C07 | C06 | C05 | 80.4° | 126.3° |
| C08 | C07 | C06 | H18 | 99.6° | 53.7° |
| C08 | C07 | H19 | H20 | 118.4° | 120.0° |
| C07 | C08 | C09 | H22 | 92.1° | 99.3° |
| C07 | C08 | C12 | H23 | 47.3° | 0.7° |
| C13 | C14 | C15 | H24 | 180.0° | 180.0° |
| C13 | C14 | C15 | C21 | 151.0° | 120.0° |
| C13 | C14 | C15 | O5 | 34.5° | 0.0° |
| C13 | C14 | C15 | C16 | 85.3° | 119.9° |
| C14 | C13 | C12 | H23 | 15.5° | 0.2° |
| C07 | C06 | C05 | H18 | 180.0° | 180.0° |
| C07 | C06 | C05 | C04 | 0.8° | 7.5° |
| C07 | C06 | C05 | H17 | 179.2° | 172.4° |
| C06 | C07 | H19 | H20 | 118.4° | 120.1° |
| C06 | C07 | C08 | H21 | 39.4° | 54.3° |
| C14 | C15 | C21 | O5 | 113.8° | 120.0° |
| C14 | C15 | C21 | C16 | 121.9° | 120.1° |
| C14 | C15 | O5 | C16 | 121.2° | 120.0° |
| C14 | C15 | C16 | C17 | 161.2° | 175.0° |
| C15 | C14 | C13 | H3 | 2.5° | 0.0° |
| C14 | C15 | C21 | H8 | 180.0° | 179.9° |
| C14 | C15 | C21 | H9 | 60.0° | 60.0° |
| C14 | C15 | C21 | H10 | 60.0° | 60.0° |
| C14 | C15 | C16 | H25 | 77.6° | 55.0° |
| C14 | C15 | O5 | H32 | 180.0° | 60.0° |
| C14 | C15 | C16 | H34 | 39.9° | 64.9° |
| C06 | C05 | C04 | H17 | 180.0° | 179.9° |
| C06 | C05 | C04 | C03 | 127.6° | 127.6° |
| C06 | C05 | C04 | H15 | 6.3° | 7.7° |
| C06 | C05 | C04 | H16 | 111.1° | 112.3° |
| C05 | C06 | C07 | H19 | 40.0° | 113.7° |
| C05 | C06 | C07 | H20 | 159.1° | 6.4° |
| C21 | C15 | O5 | C16 | 127.1° | 120.0° |
| C21 | C15 | C16 | C17 | 81.6° | 55.0° |
| C15 | C21 | H8 | H9 | 120.0° | 120.0° |
| C15 | C21 | H8 | H10 | 120.0° | 120.0° |
| C15 | C21 | H9 | H10 | 120.0° | 120.0° |
| C21 | C15 | C14 | H24 | 29.0° | 60.0° |
| C21 | C15 | C16 | H25 | 39.7° | 65.0° |
| C21 | C15 | O5 | H32 | 68.2° | 180.0° |
| C21 | C15 | C16 | H34 | 157.2° | 175.0° |
| O5 | C15 | C16 | C17 | 43.2° | 65.0° |
| O5 | C15 | C21 | H8 | 66.2° | 60.0° |
| O5 | C15 | C21 | H9 | 53.8° | 60.0° |
| O5 | C15 | C21 | H10 | 173.8° | 180.0° |
| O5 | C15 | C14 | H24 | 145.5° | 180.0° |
| O5 | C15 | C16 | H25 | 164.4° | 175.0° |
| O5 | C15 | C16 | H34 | 78.1° | 55.0° |
| C15 | C16 | C17 | H25 | 121.3° | 119.9° |
| C15 | C16 | C17 | H34 | 121.2° | 120.0° |
| C15 | C16 | C17 | C18 | 163.7° | 180.0° |
| C15 | C16 | C17 | H4 | 42.8° | 60.1° |
| C16 | C15 | C21 | H8 | 58.1° | 60.0° |
| C16 | C15 | C21 | H9 | 178.1° | 180.0° |
| C16 | C15 | C21 | H10 | 61.9° | 60.0° |
| C16 | C15 | C14 | H24 | 94.7° | 60.0° |
| C15 | C16 | H25 | H34 | 116.1° | 120.0° |
| C16 | C15 | O5 | H32 | 58.8° | 60.0° |
| C15 | C16 | C17 | H33 | 75.3° | 60.0° |
| C05 | C04 | C03 | H15 | 121.3° | 120.0° |
| C05 | C04 | C03 | H16 | 121.3° | 120.1° |
| C05 | C04 | C03 | C02 | 60.8° | 180.0° |
| C05 | C04 | C03 | H13 | 60.0° | 60.1° |
| C05 | C04 | C03 | H14 | 178.4° | 60.0° |
| C05 | C04 | H15 | H16 | 115.9° | 120.0° |
| C04 | C05 | C06 | H18 | 179.2° | 172.5° |
| C04 | C03 | C02 | H13 | 120.8° | 120.0° |
| C04 | C03 | C02 | H14 | 120.8° | 120.1° |
| C04 | C03 | C02 | C01 | 173.6° | 180.0° |
| C04 | C03 | C02 | H11 | 65.5° | 60.0° |
| C04 | C03 | C02 | H12 | 52.7° | 60.0° |
| C04 | C03 | H13 | H14 | 117.5° | 120.1° |
| C03 | C04 | H15 | H16 | 115.9° | 120.0° |
| C03 | C04 | C05 | H17 | 52.4° | 52.5° |
| C03 | C02 | C01 | O2 | 28.1° | 0.0° |
| C03 | C02 | C01 | H11 | 120.9° | 120.0° |
| C03 | C02 | C01 | H12 | 120.9° | 120.0° |
| C03 | C02 | C01 | O1 | 151.7° | 180.0° |
| C03 | C02 | H11 | H12 | 117.3° | 120.0° |
| C02 | C03 | H13 | H14 | 117.5° | 119.9° |
| C02 | C03 | C04 | H15 | 177.9° | 60.0° |
| C02 | C03 | C04 | H16 | 60.5° | 59.9° |
| C16 | C17 | C18 | H4 | 121.0° | 120.0° |
| C16 | C17 | C18 | H33 | 121.0° | 120.0° |
| C16 | C17 | C18 | C19 | 98.2° | 180.0° |
| C16 | C17 | H4 | H33 | 117.0° | 120.0° |
| C17 | C16 | H25 | H34 | 116.0° | 120.0° |
| C16 | C17 | C18 | H26 | 140.8° | 60.0° |
| C16 | C17 | C18 | H27 | 22.7° | 60.0° |
| O2 | C01 | C02 | O1 | 179.7° | 180.0° |
| O2 | C01 | C02 | H11 | 92.8° | 120.0° |
| O2 | C01 | C02 | H12 | 148.9° | 120.0° |
| O2 | C01 | O1 | H30 | 0.0° | 0.0° |
| C01 | C02 | H11 | H12 | 117.3° | 120.0° |
| C01 | C02 | C03 | H13 | 52.8° | 60.0° |
| C01 | C02 | C03 | H14 | 65.6° | 60.0° |
| C02 | C01 | O1 | H30 | 179.7° | 180.0° |
| O1 | C01 | C02 | H11 | 87.5° | 60.0° |
| O1 | C01 | C02 | H12 | 30.8° | 60.0° |
| C17 | C18 | C19 | H26 | 121.0° | 120.1° |
| C17 | C18 | C19 | H27 | 121.0° | 120.0° |
| C17 | C18 | C19 | C20 | 58.2° | 180.0° |
| C18 | C17 | H4 | H33 | 117.0° | 120.0° |
| C18 | C17 | C16 | H25 | 75.0° | 60.0° |
| C17 | C18 | H26 | H27 | 117.0° | 120.0° |
| C17 | C18 | C19 | H28 | 179.1° | 60.0° |
| C17 | C18 | C19 | H29 | 62.6° | 60.0° |
| C18 | C17 | C16 | H34 | 42.5° | 60.0° |
| C18 | C19 | C20 | H28 | 120.9° | 120.0° |
| C18 | C19 | C20 | H29 | 120.9° | 120.0° |
| C19 | C18 | C17 | H4 | 22.7° | 60.0° |
| C18 | C19 | C20 | H5 | 180.0° | 60.0° |
| C18 | C19 | C20 | H6 | 60.0° | 180.0° |
| C18 | C19 | C20 | H7 | 60.0° | 60.0° |
| C19 | C18 | H26 | H27 | 117.0° | 119.9° |
| C18 | C19 | H28 | H29 | 117.3° | 120.0° |
| C19 | C18 | C17 | H33 | 140.8° | 60.0° |
| C19 | C20 | H5 | H6 | 120.0° | 120.0° |
| C19 | C20 | H5 | H7 | 120.0° | 120.0° |
| C19 | C20 | H6 | H7 | 120.0° | 120.0° |
| C20 | C19 | C18 | H26 | 62.7° | 59.9° |
| C20 | C19 | C18 | H27 | 179.2° | 60.0° |
| C20 | C19 | H28 | H29 | 117.3° | 120.0° |
| H1 | C10 | C09 | H22 | 115.1° | 38.0° |
| H2 | C10 | C09 | H22 | 6.5° | 85.3° |
| H3 | C13 | C12 | H23 | 164.6° | 179.8° |
| H3 | C13 | C14 | H24 | 177.5° | 180.0° |
| H4 | C17 | C16 | H25 | 164.0° | 180.0° |
| H4 | C17 | C18 | H26 | 98.2° | 180.0° |
| H4 | C17 | C18 | H27 | 143.7° | 60.0° |
| H4 | C17 | C16 | H34 | 78.5° | 60.0° |
| H5 | C20 | H6 | H7 | 120.0° | 120.0° |
| H5 | C20 | C19 | H28 | 59.1° | 180.0° |
| H5 | C20 | C19 | H29 | 59.2° | 60.0° |
| H6 | C20 | C19 | H28 | 179.1° | 60.0° |
| H6 | C20 | C19 | H29 | 60.9° | 60.0° |
| H7 | C20 | C19 | H28 | 60.9° | 60.0° |
| H7 | C20 | C19 | H29 | 179.1° | 180.0° |
| H8 | C21 | H9 | H10 | 120.0° | 120.1° |
| H11 | C02 | C03 | H13 | 173.7° | 180.0° |
| H11 | C02 | C03 | H14 | 55.3° | 60.1° |
| H12 | C02 | C03 | H13 | 68.1° | 60.0° |
| H12 | C02 | C03 | H14 | 173.5° | 180.0° |
| H13 | C03 | C04 | H15 | 61.4° | 180.0° |
| H13 | C03 | C04 | H16 | 178.7° | 60.0° |
| H14 | C03 | C04 | H15 | 57.0° | 60.0° |
| H14 | C03 | C04 | H16 | 60.3° | 180.0° |
| H15 | C04 | C05 | H17 | 173.7° | 172.4° |
| H16 | C04 | C05 | H17 | 68.9° | 67.6° |
| H17 | C05 | C06 | H18 | 0.8° | 7.6° |
| H18 | C06 | C07 | H19 | 139.9° | 66.3° |
| H18 | C06 | C07 | H20 | 20.9° | 173.7° |
| H19 | C07 | C08 | H21 | 81.1° | 174.3° |
| H20 | C07 | C08 | H21 | 159.9° | 65.7° |
| H21 | C08 | C09 | H22 | 28.6° | 22.3° |
| H21 | C08 | C12 | H23 | 168.1° | 121.1° |
| H22 | C09 | O3 | H31 | 57.1° | 61.4° |
| H25 | C16 | C17 | H33 | 45.9° | 60.0° |
| H26 | C18 | C19 | H28 | 58.1° | 60.1° |
| H26 | C18 | C19 | H29 | 176.4° | 179.9° |
| H26 | C18 | C17 | H33 | 19.8° | 60.0° |
| H27 | C18 | C19 | H28 | 59.9° | 180.0° |
| H27 | C18 | C19 | H29 | 58.3° | 60.0° |
| H27 | C18 | C17 | H33 | 98.2° | 180.0° |
| H33 | C17 | C16 | H34 | 163.4° | 180.0° |
