QU7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.42Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.42Å | Aromatic |
| C17 | C16 | doub | 1.40Å | 1.41Å | Aromatic |
| C21 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C28 | C27 | sing | 1.53Å | 1.51Å | |
| C16 | C15 | sing | 1.48Å | 1.55Å | |
| C27 | C26 | sing | 1.53Å | 1.53Å | |
| C14 | C07 | doub | 1.33Å | 1.36Å | |
| C25 | C26 | sing | 1.53Å | 1.55Å | |
| C25 | C24 | sing | 1.53Å | 1.54Å | |
| C15 | C06 | sing | 1.51Å | 1.60Å | |
| C15 | C22 | doub | 1.32Å | 1.38Å | |
| C07 | C08 | sing | 1.48Å | 1.54Å | |
| C07 | C06 | sing | 1.51Å | 1.56Å | |
| C05 | C06 | sing | 1.54Å | 1.54Å | |
| C05 | C04 | sing | 1.54Å | 1.50Å | |
| C08 | C09 | doub | 1.39Å | 1.40Å | Aromatic |
| C08 | C13 | sing | 1.40Å | 1.40Å | Aromatic |
| C06 | C01 | sing | 1.55Å | 1.60Å | |
| C24 | C23 | sing | 1.53Å | 1.56Å | |
| C23 | C22 | sing | 1.51Å | 1.53Å | |
| C09 | C10 | sing | 1.38Å | 1.42Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.42Å | Aromatic |
| C22 | C29 | sing | 1.51Å | 1.53Å | |
| C10 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C04 | C02 | sing | 1.53Å | 1.51Å | |
| C01 | C29 | sing | 1.55Å | 1.53Å | |
| C01 | C02 | sing | 1.54Å | 1.56Å | |
| C02 | O03 | sing | 1.43Å | 1.44Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C02 | H2 | sing | 1.09Å | 1.10Å | |
| C04 | H3 | sing | 1.09Å | 1.10Å | |
| C04 | H4 | sing | 1.09Å | 1.10Å | |
| C05 | H5 | sing | 1.09Å | 1.10Å | |
| C05 | H6 | sing | 1.09Å | 1.10Å | |
| C09 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | H13 | sing | 1.08Å | 1.08Å | |
| C17 | H15 | sing | 1.08Å | 1.08Å | |
| C18 | H16 | sing | 1.08Å | 1.08Å | |
| C19 | H17 | sing | 1.08Å | 1.08Å | |
| C20 | H18 | sing | 1.08Å | 1.08Å | |
| C21 | H19 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H29 | sing | 1.09Å | 1.10Å | |
| C28 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| C29 | H32 | sing | 1.09Å | 1.10Å | |
| C29 | H33 | sing | 1.09Å | 1.10Å | |
| O03 | H34 | sing | 0.97Å | 0.95Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C19 | C20 | 118.0° | 120.3° |
| C19 | C18 | C17 | 120.5° | 120.1° |
| C19 | C18 | H16 | 119.8° | 120.0° |
| C18 | C19 | H17 | 121.0° | 119.9° |
| C19 | C20 | C21 | 119.9° | 120.1° |
| C20 | C19 | H17 | 121.0° | 119.8° |
| C19 | C20 | H18 | 120.1° | 119.9° |
| C18 | C17 | C16 | 123.5° | 119.9° |
| C18 | C17 | H15 | 118.3° | 120.1° |
| C17 | C18 | H16 | 119.8° | 119.9° |
| C20 | C21 | C16 | 124.5° | 119.9° |
| C21 | C20 | H18 | 120.1° | 120.0° |
| C20 | C21 | H19 | 117.7° | 120.0° |
| C17 | C16 | C21 | 113.7° | 119.7° |
| C17 | C16 | C15 | 125.6° | 120.2° |
| C16 | C17 | H15 | 118.3° | 120.0° |
| C21 | C16 | C15 | 120.7° | 120.1° |
| C16 | C21 | H19 | 117.7° | 120.1° |
| C28 | C27 | C26 | 115.6° | 109.5° |
| C28 | C27 | H27 | 107.9° | 109.4° |
| C28 | C27 | H28 | 107.9° | 109.4° |
| C27 | C28 | H29 | 109.5° | 109.5° |
| C27 | C28 | H30 | 109.5° | 109.5° |
| C27 | C28 | H31 | 109.5° | 109.5° |
| C16 | C15 | C06 | 121.3° | 124.6° |
| C16 | C15 | C22 | 129.0° | 124.5° |
| C27 | C26 | C25 | 115.3° | 109.4° |
| C27 | C26 | H25 | 108.0° | 109.5° |
| C27 | C26 | H26 | 108.0° | 109.5° |
| C26 | C27 | H27 | 107.9° | 109.5° |
| C26 | C27 | H28 | 107.9° | 109.5° |
| C14 | C07 | C08 | 119.2° | 120.0° |
| C14 | C07 | C06 | 114.4° | 120.0° |
| C07 | C14 | H12 | 120.0° | 120.1° |
| C07 | C14 | H13 | 120.0° | 120.0° |
| C26 | C25 | C24 | 115.9° | 109.5° |
| C26 | C25 | H24 | 107.8° | 109.5° |
| C25 | C26 | H25 | 108.0° | 109.5° |
| C25 | C26 | H26 | 108.0° | 109.5° |
| C26 | C25 | H20 | 107.8° | 109.5° |
| C25 | C24 | C23 | 117.1° | 109.5° |
| C25 | C24 | H23 | 107.5° | 109.5° |
| C24 | C25 | H24 | 107.8° | 109.5° |
| C25 | C24 | H14 | 107.6° | 109.4° |
| C24 | C25 | H20 | 107.8° | 109.4° |
| C06 | C15 | C22 | 106.4° | 110.9° |
| C15 | C06 | C07 | 114.8° | 112.7° |
| C15 | C06 | C05 | 113.5° | 110.1° |
| C15 | C06 | C01 | 106.9° | 104.7° |
| C15 | C22 | C23 | 128.2° | 124.6° |
| C15 | C22 | C29 | 111.7° | 110.8° |
| C08 | C07 | C06 | 126.4° | 120.0° |
| C07 | C08 | C09 | 122.8° | 120.1° |
| C07 | C08 | C13 | 122.4° | 120.1° |
| C07 | C06 | C05 | 107.8° | 111.9° |
| C07 | C06 | C01 | 113.6° | 112.0° |
| C06 | C05 | C04 | 111.1° | 106.1° |
| C05 | C06 | C01 | 99.4° | 104.9° |
| C06 | C05 | H5 | 109.0° | 110.1° |
| C06 | C05 | H6 | 109.0° | 110.1° |
| C05 | C04 | C02 | 107.5° | 107.2° |
| C05 | C04 | H3 | 110.0° | 109.9° |
| C05 | C04 | H4 | 110.0° | 110.0° |
| C04 | C05 | H5 | 109.1° | 110.1° |
| C04 | C05 | H6 | 109.1° | 110.1° |
| C09 | C08 | C13 | 114.8° | 119.7° |
| C08 | C09 | C10 | 123.4° | 119.9° |
| C08 | C09 | H7 | 118.3° | 120.1° |
| C08 | C13 | C12 | 123.3° | 119.8° |
| C08 | C13 | H11 | 118.4° | 120.1° |
| C06 | C01 | C29 | 101.8° | 101.2° |
| C06 | C01 | C02 | 110.8° | 105.6° |
| C06 | C01 | H1 | 110.1° | 114.1° |
| C24 | C23 | C22 | 119.6° | 109.5° |
| C24 | C23 | H21 | 106.9° | 109.5° |
| C24 | C23 | H22 | 106.9° | 109.5° |
| C23 | C24 | H23 | 107.5° | 109.5° |
| C23 | C24 | H14 | 107.5° | 109.5° |
| C23 | C22 | C29 | 120.1° | 124.6° |
| C22 | C23 | H21 | 106.9° | 109.5° |
| C22 | C23 | H22 | 106.9° | 109.5° |
| C09 | C10 | C11 | 120.1° | 120.1° |
| C10 | C09 | H7 | 118.3° | 120.0° |
| C09 | C10 | H8 | 119.9° | 120.0° |
| C13 | C12 | C11 | 120.2° | 120.1° |
| C13 | C12 | H10 | 119.9° | 119.9° |
| C12 | C13 | H11 | 118.4° | 120.1° |
| C22 | C29 | C01 | 110.1° | 104.9° |
| C22 | C29 | H32 | 109.3° | 110.4° |
| C22 | C29 | H33 | 109.3° | 110.4° |
| C10 | C11 | C12 | 118.2° | 120.3° |
| C11 | C10 | H8 | 119.9° | 119.9° |
| C10 | C11 | H9 | 120.9° | 119.9° |
| C12 | C11 | H9 | 120.9° | 119.8° |
| C11 | C12 | H10 | 119.9° | 120.0° |
| C04 | C02 | C01 | 100.1° | 107.5° |
| C04 | C02 | O03 | 109.1° | 109.9° |
| C04 | C02 | H2 | 110.8° | 109.9° |
| C02 | C04 | H3 | 110.0° | 109.9° |
| C02 | C04 | H4 | 110.0° | 109.9° |
| C29 | C01 | C02 | 112.2° | 108.6° |
| C29 | C01 | H1 | 111.0° | 113.3° |
| C01 | C29 | H32 | 109.3° | 110.4° |
| C01 | C29 | H33 | 109.3° | 110.4° |
| C01 | C02 | O03 | 114.3° | 109.9° |
| C02 | C01 | H1 | 110.6° | 113.1° |
| C01 | C02 | H2 | 110.1° | 109.8° |
| O03 | C02 | H2 | 111.8° | 109.8° |
| C02 | O03 | H34 | 109.5° | 114.1° |
| H3 | C04 | H4 | 109.5° | 109.9° |
| H5 | C05 | H6 | 109.5° | 110.2° |
| H12 | C14 | H13 | 120.0° | 119.9° |
| H21 | C23 | H22 | 109.5° | 109.4° |
| H23 | C24 | H14 | 109.5° | 109.5° |
| H24 | C25 | H20 | 109.5° | 109.4° |
| H25 | C26 | H26 | 109.5° | 109.5° |
| H27 | C27 | H28 | 109.5° | 109.4° |
| H29 | C28 | H30 | 109.5° | 109.4° |
| H29 | C28 | H31 | 109.4° | 109.5° |
| H30 | C28 | H31 | 109.5° | 109.4° |
| H32 | C29 | H33 | 109.5° | 110.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C19 | C20 | H17 | 180.0° | 180.0° |
| C19 | C18 | C17 | H16 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.0° | 0.2° |
| C19 | C18 | C17 | C16 | 0.2° | 0.0° |
| C19 | C18 | C17 | H15 | 179.8° | 179.9° |
| C18 | C19 | C20 | H18 | 180.0° | 180.0° |
| C20 | C19 | C18 | C17 | 0.0° | 0.1° |
| C19 | C20 | C21 | H18 | 180.0° | 179.9° |
| C19 | C20 | C21 | C16 | 0.1° | 0.4° |
| C20 | C19 | C18 | H16 | 180.0° | 180.0° |
| C19 | C20 | C21 | H19 | 179.8° | 180.0° |
| C18 | C17 | C16 | H15 | 180.0° | 180.0° |
| C18 | C17 | C16 | C21 | 0.3° | 0.2° |
| C18 | C17 | C16 | C15 | 179.9° | 179.9° |
| C17 | C18 | C19 | H17 | 180.0° | 180.0° |
| C20 | C21 | C16 | C17 | 0.3° | 0.4° |
| C20 | C21 | C16 | H19 | 180.0° | 179.6° |
| C20 | C21 | C16 | C15 | 179.9° | 179.8° |
| C21 | C20 | C19 | H17 | 180.0° | 179.8° |
| C17 | C16 | C21 | C15 | 179.6° | 179.7° |
| C17 | C16 | C15 | C06 | 63.4° | 113.8° |
| C17 | C16 | C15 | C22 | 93.2° | 66.2° |
| C16 | C17 | C18 | H16 | 179.9° | 180.0° |
| C17 | C16 | C21 | H19 | 179.7° | 179.9° |
| C21 | C16 | C15 | C06 | 117.0° | 65.9° |
| C21 | C16 | C15 | C22 | 86.4° | 114.1° |
| C21 | C16 | C17 | H15 | 179.7° | 179.8° |
| C16 | C21 | C20 | H18 | 179.9° | 179.7° |
| C28 | C27 | C26 | H27 | 120.9° | 120.0° |
| C28 | C27 | C26 | H28 | 120.9° | 120.0° |
| C28 | C27 | C26 | C25 | 145.3° | 180.0° |
| C28 | C27 | C26 | H25 | 93.9° | 60.0° |
| C28 | C27 | C26 | H26 | 24.4° | 60.0° |
| C28 | C27 | H27 | H28 | 117.2° | 119.9° |
| C27 | C28 | H29 | H30 | 120.0° | 120.0° |
| C27 | C28 | H29 | H31 | 120.0° | 120.1° |
| C27 | C28 | H30 | H31 | 120.0° | 120.0° |
| C16 | C15 | C06 | C22 | 161.2° | 180.0° |
| C16 | C15 | C06 | C07 | 52.7° | 75.1° |
| C16 | C15 | C06 | C05 | 71.9° | 50.6° |
| C16 | C15 | C06 | C01 | 179.6° | 162.9° |
| C16 | C15 | C22 | C23 | 3.5° | 0.1° |
| C16 | C15 | C22 | C29 | 175.1° | 179.9° |
| C15 | C16 | C17 | H15 | 0.1° | 0.1° |
| C15 | C16 | C21 | H19 | 0.1° | 0.2° |
| C27 | C26 | C25 | H25 | 120.9° | 120.0° |
| C27 | C26 | C25 | H26 | 120.9° | 120.0° |
| C27 | C26 | C25 | C24 | 120.8° | 180.0° |
| C27 | C26 | C25 | H24 | 118.3° | 60.0° |
| C27 | C26 | H25 | H26 | 117.3° | 120.0° |
| C26 | C27 | H27 | H28 | 117.2° | 120.1° |
| C26 | C27 | C28 | H29 | 180.0° | 60.0° |
| C26 | C27 | C28 | H30 | 60.0° | 60.0° |
| C26 | C27 | C28 | H31 | 60.0° | 180.0° |
| C27 | C26 | C25 | H20 | 0.1° | 60.0° |
| C14 | C07 | C06 | C15 | 101.3° | 118.7° |
| C14 | C07 | C08 | C06 | 179.6° | 180.0° |
| C14 | C07 | C06 | C05 | 26.2° | 6.0° |
| C14 | C07 | C08 | C09 | 141.0° | 67.8° |
| C14 | C07 | C08 | C13 | 38.9° | 112.5° |
| C14 | C07 | C06 | C01 | 135.3° | 123.5° |
| C07 | C14 | H12 | H13 | 179.9° | 180.0° |
| C26 | C25 | C24 | H24 | 120.9° | 120.0° |
| C26 | C25 | C24 | H20 | 120.9° | 120.0° |
| C26 | C25 | C24 | C23 | 171.9° | 180.0° |
| C26 | C25 | C24 | H23 | 67.0° | 60.0° |
| C26 | C25 | H24 | H20 | 117.1° | 120.0° |
| C25 | C26 | H25 | H26 | 117.3° | 120.0° |
| C25 | C26 | C27 | H27 | 24.4° | 60.0° |
| C25 | C26 | C27 | H28 | 93.8° | 60.0° |
| C26 | C25 | C24 | H14 | 50.8° | 60.0° |
| C25 | C24 | C23 | H23 | 121.1° | 120.0° |
| C25 | C24 | C23 | H14 | 121.1° | 120.0° |
| C25 | C24 | C23 | C22 | 70.8° | 180.0° |
| C25 | C24 | C23 | H21 | 50.7° | 60.0° |
| C25 | C24 | C23 | H22 | 167.8° | 60.0° |
| C25 | C24 | H23 | H14 | 116.6° | 120.0° |
| C24 | C25 | H24 | H20 | 117.1° | 120.0° |
| C24 | C25 | C26 | H25 | 0.1° | 60.0° |
| C24 | C25 | C26 | H26 | 118.4° | 60.0° |
| C15 | C06 | C07 | C08 | 78.3° | 61.3° |
| C15 | C06 | C07 | C05 | 127.5° | 124.7° |
| C15 | C06 | C07 | C01 | 123.4° | 117.8° |
| C15 | C06 | C05 | C01 | 113.1° | 112.2° |
| C15 | C06 | C05 | C04 | 122.8° | 83.5° |
| C06 | C15 | C22 | C23 | 162.8° | 179.9° |
| C06 | C15 | C22 | C29 | 15.8° | 0.1° |
| C15 | C06 | C01 | C29 | 13.1° | 25.6° |
| C15 | C06 | C01 | C02 | 106.4° | 87.5° |
| C15 | C06 | C01 | H1 | 131.0° | 147.7° |
| C15 | C06 | C05 | H5 | 117.0° | 35.7° |
| C15 | C06 | C05 | H6 | 2.5° | 157.4° |
| C22 | C15 | C06 | C07 | 108.5° | 104.9° |
| C22 | C15 | C06 | C05 | 126.9° | 129.4° |
| C22 | C15 | C06 | C01 | 18.3° | 17.1° |
| C15 | C22 | C23 | C24 | 98.5° | 95.0° |
| C15 | C22 | C23 | C29 | 178.5° | 180.0° |
| C15 | C22 | C29 | C01 | 7.5° | 17.1° |
| C15 | C22 | C23 | H21 | 22.9° | 145.0° |
| C15 | C22 | C23 | H22 | 140.1° | 25.0° |
| C15 | C22 | C29 | H32 | 112.6° | 101.8° |
| C15 | C22 | C29 | H33 | 127.6° | 135.9° |
| C08 | C07 | C06 | C05 | 154.2° | 174.0° |
| C07 | C08 | C09 | C13 | 179.9° | 179.8° |
| C08 | C07 | C06 | C01 | 45.1° | 56.5° |
| C07 | C08 | C09 | C10 | 179.9° | 180.0° |
| C07 | C08 | C13 | C12 | 180.0° | 179.7° |
| C07 | C08 | C09 | H7 | 0.1° | 0.0° |
| C07 | C08 | C13 | H11 | 0.0° | 0.0° |
| C08 | C07 | C14 | H12 | 179.7° | 177.6° |
| C08 | C07 | C14 | H13 | 0.4° | 2.4° |
| C07 | C06 | C05 | C01 | 118.6° | 121.7° |
| C07 | C06 | C05 | C04 | 108.9° | 150.4° |
| C06 | C07 | C08 | C09 | 38.6° | 112.2° |
| C06 | C07 | C08 | C13 | 141.5° | 67.5° |
| C07 | C06 | C01 | C29 | 114.5° | 96.8° |
| C07 | C06 | C01 | C02 | 126.0° | 150.0° |
| C07 | C06 | C01 | H1 | 3.4° | 25.2° |
| C07 | C06 | C05 | H5 | 11.3° | 90.5° |
| C07 | C06 | C05 | H6 | 130.8° | 31.3° |
| C06 | C07 | C14 | H12 | 0.0° | 2.4° |
| C06 | C07 | C14 | H13 | 180.0° | 177.6° |
| C06 | C05 | C04 | H5 | 120.2° | 119.2° |
| C06 | C05 | C04 | H6 | 120.2° | 119.2° |
| C06 | C05 | C04 | C02 | 28.6° | 18.1° |
| C05 | C06 | C01 | C29 | 131.3° | 141.6° |
| C05 | C06 | C01 | C02 | 11.8° | 28.4° |
| C05 | C06 | C01 | H1 | 110.8° | 96.4° |
| C06 | C05 | C04 | H3 | 91.1° | 101.3° |
| C06 | C05 | C04 | H4 | 148.2° | 137.6° |
| C06 | C05 | H5 | H6 | 119.2° | 121.7° |
| C04 | C05 | C06 | C01 | 9.7° | 28.7° |
| C05 | C04 | C02 | H3 | 119.7° | 119.4° |
| C05 | C04 | C02 | H4 | 119.7° | 119.6° |
| C05 | C04 | C02 | C01 | 33.0° | 0.2° |
| C05 | C04 | C02 | O03 | 153.3° | 119.3° |
| C05 | C04 | C02 | H2 | 83.2° | 119.8° |
| C05 | C04 | H3 | H4 | 120.9° | 121.2° |
| C04 | C05 | H5 | H6 | 119.3° | 121.6° |
| C08 | C09 | C10 | H7 | 180.0° | 180.0° |
| C09 | C08 | C13 | C12 | 0.1° | 0.5° |
| C08 | C09 | C10 | C11 | 0.2° | 0.0° |
| C08 | C09 | C10 | H8 | 179.8° | 180.0° |
| C09 | C08 | C13 | H11 | 179.9° | 179.8° |
| C13 | C08 | C09 | C10 | 0.2° | 0.2° |
| C08 | C13 | C12 | H11 | 180.0° | 179.7° |
| C08 | C13 | C12 | C11 | 0.1° | 0.6° |
| C13 | C08 | C09 | H7 | 179.8° | 179.8° |
| C08 | C13 | C12 | H10 | 179.9° | 179.8° |
| C06 | C01 | C29 | C22 | 4.5° | 25.6° |
| C06 | C01 | C02 | C04 | 27.7° | 17.4° |
| C06 | C01 | C29 | C02 | 118.6° | 110.9° |
| C06 | C01 | C29 | H1 | 117.1° | 122.6° |
| C06 | C01 | C02 | H1 | 122.3° | 125.4° |
| C06 | C01 | C02 | O03 | 144.2° | 137.0° |
| C06 | C01 | C02 | H2 | 88.9° | 102.1° |
| C01 | C06 | C05 | H5 | 129.9° | 147.8° |
| C01 | C06 | C05 | H6 | 110.6° | 90.4° |
| C06 | C01 | C29 | H32 | 124.5° | 93.2° |
| C06 | C01 | C29 | H33 | 115.6° | 144.5° |
| C24 | C23 | C22 | H21 | 121.4° | 120.0° |
| C24 | C23 | C22 | H22 | 121.4° | 120.0° |
| C24 | C23 | C22 | C29 | 80.0° | 85.0° |
| C24 | C23 | H21 | H22 | 115.4° | 120.0° |
| C23 | C24 | H23 | H14 | 116.5° | 120.0° |
| C23 | C24 | C25 | H24 | 50.9° | 60.0° |
| C23 | C24 | C25 | H20 | 67.2° | 60.0° |
| C23 | C22 | C29 | C01 | 171.2° | 162.9° |
| C22 | C23 | H21 | H22 | 115.4° | 119.9° |
| C22 | C23 | C24 | H23 | 168.1° | 60.0° |
| C23 | C22 | C29 | H32 | 68.7° | 78.2° |
| C23 | C22 | C29 | H33 | 51.1° | 44.1° |
| C22 | C23 | C24 | H14 | 50.4° | 60.0° |
| C09 | C10 | C11 | H8 | 180.0° | 180.0° |
| C09 | C10 | C11 | C12 | 0.1° | 0.0° |
| C09 | C10 | C11 | H9 | 179.9° | 179.9° |
| C13 | C12 | C11 | C10 | 0.1° | 0.3° |
| C13 | C12 | C11 | H10 | 180.0° | 179.6° |
| C13 | C12 | C11 | H9 | 180.0° | 179.8° |
| C22 | C29 | C01 | H32 | 120.1° | 118.9° |
| C22 | C29 | C01 | H33 | 120.1° | 118.8° |
| C22 | C29 | C01 | C02 | 114.1° | 85.2° |
| C22 | C29 | C01 | H1 | 121.6° | 148.2° |
| C29 | C22 | C23 | H21 | 158.6° | 35.0° |
| C29 | C22 | C23 | H22 | 41.4° | 155.0° |
| C22 | C29 | H32 | H33 | 119.7° | 122.2° |
| C10 | C11 | C12 | H9 | 180.0° | 179.9° |
| C11 | C10 | C09 | H7 | 179.8° | 180.0° |
| C10 | C11 | C12 | H10 | 179.9° | 180.0° |
| C12 | C11 | C10 | H8 | 179.9° | 179.9° |
| C11 | C12 | C13 | H11 | 179.9° | 179.7° |
| C04 | C02 | C01 | C29 | 140.9° | 125.4° |
| C04 | C02 | C01 | O03 | 116.5° | 119.5° |
| C04 | C02 | C01 | H2 | 116.7° | 119.6° |
| C04 | C02 | O03 | H2 | 122.9° | 121.0° |
| C04 | C02 | C01 | H1 | 94.6° | 108.0° |
| C02 | C04 | H3 | H4 | 120.9° | 121.1° |
| C02 | C04 | C05 | H5 | 148.8° | 137.2° |
| C02 | C04 | C05 | H6 | 91.7° | 101.1° |
| C04 | C02 | O03 | H34 | 180.0° | 61.9° |
| C29 | C01 | C02 | H1 | 124.6° | 126.6° |
| C29 | C01 | C02 | O03 | 102.7° | 115.1° |
| C29 | C01 | C02 | H2 | 24.2° | 5.8° |
| C01 | C29 | H32 | H33 | 119.7° | 122.3° |
| C01 | C02 | O03 | H2 | 125.9° | 120.9° |
| C01 | C02 | C04 | H3 | 86.7° | 119.1° |
| C01 | C02 | C04 | H4 | 152.7° | 119.8° |
| C02 | C01 | C29 | H32 | 6.0° | 155.9° |
| C02 | C01 | C29 | H33 | 125.8° | 33.6° |
| C01 | C02 | O03 | H34 | 68.9° | 180.0° |
| O03 | C02 | C01 | H1 | 21.9° | 11.5° |
| O03 | C02 | C04 | H3 | 33.6° | 121.3° |
| O03 | C02 | C04 | H4 | 87.0° | 0.3° |
| H1 | C01 | C02 | H2 | 148.7° | 132.4° |
| H1 | C01 | C29 | H32 | 118.3° | 29.4° |
| H1 | C01 | C29 | H33 | 1.5° | 93.0° |
| H2 | C02 | C04 | H3 | 157.1° | 0.4° |
| H2 | C02 | C04 | H4 | 36.5° | 120.7° |
| H2 | C02 | O03 | H34 | 57.1° | 59.1° |
| H3 | C04 | C05 | H5 | 29.1° | 17.9° |
| H3 | C04 | C05 | H6 | 148.6° | 139.5° |
| H4 | C04 | C05 | H5 | 91.5° | 103.3° |
| H4 | C04 | C05 | H6 | 28.0° | 18.4° |
| H7 | C09 | C10 | H8 | 0.2° | 0.1° |
| H8 | C10 | C11 | H9 | 0.1° | 0.0° |
| H9 | C11 | C12 | H10 | 0.1° | 0.1° |
| H10 | C12 | C13 | H11 | 0.1° | 0.1° |
| H15 | C17 | C18 | H16 | 0.2° | 0.0° |
| H16 | C18 | C19 | H17 | 0.0° | 0.1° |
| H17 | C19 | C20 | H18 | 0.0° | 0.1° |
| H18 | C20 | C21 | H19 | 0.1° | 0.1° |
| H21 | C23 | C24 | H23 | 70.4° | 180.0° |
| H21 | C23 | C24 | H14 | 171.8° | 60.0° |
| H22 | C23 | C24 | H23 | 46.7° | 60.0° |
| H22 | C23 | C24 | H14 | 71.1° | 180.0° |
| H23 | C24 | C25 | H24 | 172.1° | 179.9° |
| H23 | C24 | C25 | H20 | 53.9° | 60.0° |
| H24 | C25 | C26 | H25 | 120.9° | 180.0° |
| H24 | C25 | C26 | H26 | 2.6° | 60.0° |
| H24 | C25 | C24 | H14 | 70.1° | 60.0° |
| H25 | C26 | C27 | H27 | 145.2° | 180.0° |
| H25 | C26 | C27 | H28 | 27.0° | 60.0° |
| H25 | C26 | C25 | H20 | 121.0° | 60.0° |
| H26 | C26 | C27 | H27 | 96.5° | 60.0° |
| H26 | C26 | C27 | H28 | 145.3° | 180.0° |
| H26 | C26 | C25 | H20 | 120.7° | 180.0° |
| H27 | C27 | C28 | H29 | 59.1° | 180.0° |
| H27 | C27 | C28 | H30 | 60.9° | 60.1° |
| H27 | C27 | C28 | H31 | 179.1° | 59.9° |
| H28 | C27 | C28 | H29 | 59.1° | 60.1° |
| H28 | C27 | C28 | H30 | 179.1° | 180.0° |
| H28 | C27 | C28 | H31 | 60.9° | 60.0° |
| H29 | C28 | H30 | H31 | 120.0° | 120.0° |
| H14 | C24 | C25 | H20 | 171.7° | 180.0° |
