9CI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | C02 | sing | 1.53Å | 1.56Å | |
| C12 | N13 | sing | 1.47Å | 1.48Å | |
| C02 | C03 | sing | 1.53Å | 1.56Å | |
| C02 | O01 | sing | 1.43Å | 1.39Å | |
| N13 | C14 | sing | 1.35Å | 1.42Å | |
| C03 | N04 | sing | 1.47Å | 1.47Å | |
| C14 | O15 | doub | 1.21Å | 1.21Å | |
| C14 | C16 | sing | 1.51Å | 1.54Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| N04 | C05 | sing | 1.47Å | 1.49Å | |
| C17 | C24 | sing | 1.51Å | 1.53Å | |
| C17 | C18 | sing | 1.51Å | 1.52Å | |
| C05 | C06 | sing | 1.53Å | 1.55Å | |
| C11 | C06 | sing | 1.53Å | 1.56Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C24 | C29 | doub | 1.38Å | 1.41Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C06 | C07 | sing | 1.53Å | 1.56Å | |
| C23 | C18 | doub | 1.38Å | 1.41Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C25 | C26 | doub | 1.38Å | 1.40Å | Aromatic |
| C28 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C09 | sing | 1.53Å | 1.53Å | |
| C22 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C07 | C08 | sing | 1.53Å | 1.54Å | |
| C09 | C08 | sing | 1.53Å | 1.53Å | |
| C21 | C20 | sing | 1.38Å | 1.40Å | Aromatic |
| C02 | H1 | sing | 1.09Å | 1.10Å | |
| C03 | H2 | sing | 1.09Å | 1.10Å | |
| C03 | H3 | sing | 1.09Å | 1.10Å | |
| C05 | H4 | sing | 1.09Å | 1.10Å | |
| C05 | H5 | sing | 1.09Å | 1.10Å | |
| C06 | H6 | sing | 1.09Å | 1.10Å | |
| C07 | H7 | sing | 1.09Å | 1.10Å | |
| C07 | H8 | sing | 1.09Å | 1.10Å | |
| C08 | H9 | sing | 1.09Å | 1.10Å | |
| C08 | H10 | sing | 1.09Å | 1.10Å | |
| C09 | H11 | sing | 1.09Å | 1.10Å | |
| C09 | H12 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.08Å | 1.08Å | |
| C20 | H23 | sing | 1.08Å | 1.08Å | |
| C21 | H24 | sing | 1.08Å | 1.08Å | |
| C22 | H25 | sing | 1.08Å | 1.08Å | |
| C23 | H26 | sing | 1.08Å | 1.08Å | |
| C25 | H27 | sing | 1.08Å | 1.08Å | |
| C26 | H28 | sing | 1.08Å | 1.08Å | |
| C27 | H29 | sing | 1.08Å | 1.08Å | |
| C28 | H30 | sing | 1.08Å | 1.08Å | |
| C29 | H31 | sing | 1.08Å | 1.08Å | |
| N04 | H32 | sing | 1.01Å | 1.00Å | |
| N13 | H34 | sing | 0.97Å | 1.00Å | |
| O01 | H35 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C12 | N13 | 115.9° | 109.5° |
| C12 | C02 | C03 | 109.6° | 109.5° |
| C12 | C02 | O01 | 109.7° | 109.5° |
| C12 | C02 | H1 | 109.2° | 109.5° |
| C02 | C12 | H17 | 107.9° | 109.4° |
| C02 | C12 | H18 | 107.8° | 109.4° |
| C12 | N13 | C14 | 130.2° | 120.0° |
| N13 | C12 | H17 | 107.8° | 109.5° |
| N13 | C12 | H18 | 107.8° | 109.5° |
| C12 | N13 | H34 | 114.9° | 120.0° |
| C03 | C02 | O01 | 107.5° | 109.5° |
| C02 | C03 | N04 | 116.0° | 109.5° |
| C03 | C02 | H1 | 109.2° | 109.5° |
| C02 | C03 | H2 | 107.8° | 109.5° |
| C02 | C03 | H3 | 107.8° | 109.4° |
| O01 | C02 | H1 | 111.7° | 109.5° |
| C02 | O01 | H35 | 109.5° | 114.0° |
| N13 | C14 | O15 | 119.2° | 120.0° |
| N13 | C14 | C16 | 123.5° | 120.0° |
| C14 | N13 | H34 | 114.9° | 120.1° |
| C03 | N04 | C05 | 114.5° | 111.0° |
| N04 | C03 | H2 | 107.8° | 109.5° |
| N04 | C03 | H3 | 107.8° | 109.5° |
| C03 | N04 | H32 | 108.2° | 111.0° |
| O15 | C14 | C16 | 117.3° | 120.0° |
| C14 | C16 | C17 | 119.0° | 109.5° |
| C14 | C16 | H19 | 107.1° | 109.5° |
| C14 | C16 | H20 | 107.1° | 109.5° |
| C16 | C17 | C24 | 113.0° | 109.5° |
| C16 | C17 | C18 | 111.9° | 109.5° |
| C17 | C16 | H19 | 107.0° | 109.5° |
| C17 | C16 | H20 | 107.0° | 109.5° |
| C16 | C17 | H21 | 105.6° | 109.5° |
| N04 | C05 | C06 | 115.3° | 109.5° |
| N04 | C05 | H4 | 108.0° | 109.5° |
| N04 | C05 | H5 | 108.0° | 109.5° |
| C05 | N04 | H32 | 108.2° | 111.1° |
| C24 | C17 | C18 | 113.9° | 109.5° |
| C17 | C24 | C29 | 123.3° | 120.0° |
| C17 | C24 | C25 | 121.5° | 120.0° |
| C24 | C17 | H21 | 105.7° | 109.4° |
| C17 | C18 | C23 | 122.0° | 120.1° |
| C17 | C18 | C19 | 123.6° | 120.0° |
| C18 | C17 | H21 | 105.9° | 109.5° |
| C05 | C06 | C11 | 110.4° | 109.5° |
| C05 | C06 | C07 | 112.7° | 109.5° |
| C06 | C05 | H4 | 108.0° | 109.5° |
| C06 | C05 | H5 | 108.0° | 109.4° |
| C05 | C06 | H6 | 107.0° | 109.5° |
| C06 | C11 | C10 | 113.8° | 109.5° |
| C11 | C06 | C07 | 112.7° | 109.5° |
| C11 | C06 | H6 | 106.8° | 109.5° |
| C06 | C11 | H15 | 108.4° | 109.5° |
| C06 | C11 | H16 | 108.4° | 109.5° |
| C11 | C10 | C09 | 112.1° | 109.5° |
| C11 | C10 | H13 | 108.8° | 109.4° |
| C11 | C10 | H14 | 108.8° | 109.5° |
| C10 | C11 | H15 | 108.4° | 109.4° |
| C10 | C11 | H16 | 108.4° | 109.5° |
| C29 | C24 | C25 | 115.2° | 120.0° |
| C24 | C29 | C28 | 122.3° | 120.0° |
| C24 | C29 | H31 | 118.9° | 120.0° |
| C24 | C25 | C26 | 123.3° | 120.0° |
| C24 | C25 | H27 | 118.3° | 120.0° |
| C29 | C28 | C27 | 120.6° | 120.0° |
| C29 | C28 | H30 | 119.7° | 120.0° |
| C28 | C29 | H31 | 118.8° | 120.0° |
| C06 | C07 | C08 | 116.4° | 109.5° |
| C07 | C06 | H6 | 106.8° | 109.4° |
| C06 | C07 | H7 | 107.7° | 109.4° |
| C06 | C07 | H8 | 107.7° | 109.4° |
| C18 | C23 | C22 | 124.0° | 120.1° |
| C23 | C18 | C19 | 114.3° | 119.9° |
| C18 | C23 | H26 | 118.0° | 119.9° |
| C23 | C22 | C21 | 119.6° | 120.0° |
| C23 | C22 | H25 | 120.2° | 120.1° |
| C22 | C23 | H26 | 118.0° | 120.0° |
| C18 | C19 | C20 | 122.4° | 120.1° |
| C18 | C19 | H22 | 118.8° | 120.0° |
| C25 | C26 | C27 | 120.1° | 119.9° |
| C26 | C25 | H27 | 118.3° | 119.9° |
| C25 | C26 | H28 | 120.0° | 120.0° |
| C28 | C27 | C26 | 118.5° | 120.0° |
| C28 | C27 | H29 | 120.7° | 120.0° |
| C27 | C28 | H30 | 119.7° | 120.0° |
| C27 | C26 | H28 | 119.9° | 120.0° |
| C26 | C27 | H29 | 120.8° | 119.9° |
| C10 | C09 | C08 | 113.7° | 109.5° |
| C10 | C09 | H11 | 108.4° | 109.5° |
| C10 | C09 | H12 | 108.4° | 109.5° |
| C09 | C10 | H13 | 108.8° | 109.5° |
| C09 | C10 | H14 | 108.8° | 109.5° |
| C22 | C21 | C20 | 118.3° | 120.0° |
| C22 | C21 | H24 | 120.8° | 120.0° |
| C21 | C22 | H25 | 120.2° | 119.9° |
| C19 | C20 | C21 | 121.4° | 120.0° |
| C20 | C19 | H22 | 118.8° | 120.0° |
| C19 | C20 | H23 | 119.3° | 120.1° |
| C07 | C08 | C09 | 113.7° | 109.5° |
| C08 | C07 | H7 | 107.7° | 109.5° |
| C08 | C07 | H8 | 107.7° | 109.5° |
| C07 | C08 | H9 | 108.4° | 109.5° |
| C07 | C08 | H10 | 108.4° | 109.4° |
| C09 | C08 | H9 | 108.4° | 109.5° |
| C09 | C08 | H10 | 108.4° | 109.5° |
| C08 | C09 | H11 | 108.4° | 109.4° |
| C08 | C09 | H12 | 108.4° | 109.5° |
| C21 | C20 | H23 | 119.3° | 120.0° |
| C20 | C21 | H24 | 120.9° | 120.0° |
| H2 | C03 | H3 | 109.5° | 109.5° |
| H4 | C05 | H5 | 109.5° | 109.5° |
| H7 | C07 | H8 | 109.5° | 109.5° |
| H9 | C08 | H10 | 109.5° | 109.4° |
| H11 | C09 | H12 | 109.5° | 109.4° |
| H13 | C10 | H14 | 109.5° | 109.5° |
| H15 | C11 | H16 | 109.5° | 109.5° |
| H17 | C12 | H18 | 109.5° | 109.4° |
| H19 | C16 | H20 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C12 | N13 | H17 | 120.9° | 120.0° |
| C02 | C12 | N13 | H18 | 120.9° | 120.0° |
| C12 | C02 | C03 | O01 | 119.1° | 120.0° |
| C12 | C02 | C03 | H1 | 119.5° | 120.0° |
| C12 | C02 | O01 | H1 | 121.2° | 120.0° |
| C02 | C12 | N13 | C14 | 72.8° | 180.0° |
| C12 | C02 | C03 | N04 | 87.2° | 180.0° |
| C12 | C02 | C03 | H2 | 33.8° | 60.0° |
| C12 | C02 | C03 | H3 | 151.9° | 60.0° |
| C02 | C12 | H17 | H18 | 117.1° | 119.9° |
| C02 | C12 | N13 | H34 | 107.2° | 0.0° |
| C12 | C02 | O01 | H35 | 180.0° | 60.0° |
| N13 | C12 | C02 | C03 | 82.2° | 175.0° |
| N13 | C12 | C02 | O01 | 35.6° | 65.0° |
| C12 | N13 | C14 | H34 | 180.0° | 180.0° |
| C12 | N13 | C14 | O15 | 1.8° | 0.0° |
| C12 | N13 | C14 | C16 | 179.1° | 180.0° |
| N13 | C12 | C02 | H1 | 158.3° | 55.0° |
| N13 | C12 | H17 | H18 | 117.0° | 120.1° |
| C03 | C02 | O01 | H1 | 119.7° | 120.0° |
| C02 | C03 | N04 | H2 | 120.9° | 120.0° |
| C02 | C03 | N04 | H3 | 120.9° | 119.9° |
| C02 | C03 | N04 | C05 | 105.9° | 180.0° |
| C02 | C03 | H2 | H3 | 117.0° | 120.0° |
| C03 | C02 | C12 | H17 | 156.9° | 55.0° |
| C03 | C02 | C12 | H18 | 38.7° | 65.0° |
| C02 | C03 | N04 | H32 | 14.9° | 56.0° |
| C03 | C02 | O01 | H35 | 60.9° | 59.9° |
| O01 | C02 | C03 | N04 | 32.0° | 60.0° |
| O01 | C02 | C03 | H2 | 152.9° | 60.0° |
| O01 | C02 | C03 | H3 | 89.0° | 180.0° |
| O01 | C02 | C12 | H17 | 85.3° | 175.0° |
| O01 | C02 | C12 | H18 | 156.5° | 55.0° |
| N13 | C14 | O15 | C16 | 179.1° | 180.0° |
| N13 | C14 | C16 | C17 | 148.1° | 180.0° |
| C14 | N13 | C12 | H17 | 166.3° | 60.0° |
| C14 | N13 | C12 | H18 | 48.1° | 60.0° |
| N13 | C14 | C16 | H19 | 26.8° | 60.0° |
| N13 | C14 | C16 | H20 | 90.6° | 60.0° |
| C03 | N04 | C05 | H32 | 120.8° | 124.0° |
| C03 | N04 | C05 | C06 | 104.9° | 180.0° |
| N04 | C03 | C02 | H1 | 153.3° | 60.0° |
| N04 | C03 | H2 | H3 | 117.0° | 120.0° |
| C03 | N04 | C05 | H4 | 16.0° | 60.0° |
| C03 | N04 | C05 | H5 | 134.3° | 60.0° |
| O15 | C14 | C16 | C17 | 31.0° | 0.0° |
| O15 | C14 | C16 | H19 | 152.3° | 120.0° |
| O15 | C14 | C16 | H20 | 90.3° | 120.0° |
| O15 | C14 | N13 | H34 | 178.2° | 180.0° |
| C14 | C16 | C17 | H19 | 121.4° | 120.0° |
| C14 | C16 | C17 | H20 | 121.3° | 120.0° |
| C14 | C16 | C17 | C24 | 173.3° | 175.0° |
| C14 | C16 | C17 | C18 | 56.5° | 65.0° |
| C14 | C16 | H19 | H20 | 115.7° | 120.0° |
| C14 | C16 | C17 | H21 | 58.2° | 55.0° |
| C16 | C14 | N13 | H34 | 0.9° | 0.0° |
| C16 | C17 | C24 | C18 | 129.1° | 120.1° |
| C16 | C17 | C24 | H21 | 115.0° | 120.0° |
| C16 | C17 | C18 | H21 | 114.5° | 120.0° |
| C16 | C17 | C24 | C29 | 52.7° | 127.8° |
| C16 | C17 | C24 | C25 | 127.2° | 52.0° |
| C16 | C17 | C18 | C23 | 39.3° | 128.3° |
| C16 | C17 | C18 | C19 | 138.8° | 52.0° |
| C17 | C16 | H19 | H20 | 115.7° | 120.0° |
| N04 | C05 | C06 | H4 | 120.9° | 120.0° |
| N04 | C05 | C06 | H5 | 120.9° | 120.0° |
| N04 | C05 | C06 | C11 | 26.0° | 65.0° |
| N04 | C05 | C06 | C07 | 153.0° | 175.0° |
| C05 | N04 | C03 | H2 | 133.2° | 60.0° |
| C05 | N04 | C03 | H3 | 15.1° | 60.1° |
| N04 | C05 | H4 | H5 | 117.4° | 120.0° |
| N04 | C05 | C06 | H6 | 89.9° | 55.0° |
| C24 | C17 | C18 | H21 | 115.8° | 120.0° |
| C17 | C24 | C29 | C25 | 179.9° | 179.8° |
| C17 | C24 | C29 | C28 | 179.8° | 179.7° |
| C24 | C17 | C18 | C23 | 90.4° | 111.7° |
| C24 | C17 | C18 | C19 | 91.5° | 68.0° |
| C17 | C24 | C25 | C26 | 179.8° | 180.0° |
| C24 | C17 | C16 | H19 | 65.3° | 65.0° |
| C24 | C17 | C16 | H20 | 52.0° | 55.0° |
| C17 | C24 | C25 | H27 | 0.1° | 0.0° |
| C17 | C24 | C29 | H31 | 0.2° | 0.0° |
| C18 | C17 | C24 | C29 | 76.5° | 112.2° |
| C18 | C17 | C24 | C25 | 103.7° | 68.1° |
| C17 | C18 | C23 | C19 | 178.3° | 179.7° |
| C17 | C18 | C23 | C22 | 179.2° | 179.7° |
| C17 | C18 | C19 | C20 | 179.9° | 180.0° |
| C18 | C17 | C16 | H19 | 64.9° | 55.0° |
| C18 | C17 | C16 | H20 | 177.8° | 175.0° |
| C17 | C18 | C19 | H22 | 0.0° | 0.0° |
| C17 | C18 | C23 | H26 | 0.8° | 0.0° |
| C05 | C06 | C11 | C07 | 127.0° | 120.0° |
| C05 | C06 | C11 | H6 | 116.0° | 120.1° |
| C05 | C06 | C11 | C10 | 126.4° | 180.0° |
| C05 | C06 | C07 | H6 | 117.2° | 120.0° |
| C05 | C06 | C07 | C08 | 169.3° | 180.0° |
| C06 | C05 | H4 | H5 | 117.3° | 120.0° |
| C05 | C06 | C07 | H7 | 69.7° | 60.0° |
| C05 | C06 | C07 | H8 | 48.3° | 60.0° |
| C05 | C06 | C11 | H15 | 5.8° | 60.0° |
| C05 | C06 | C11 | H16 | 113.0° | 60.0° |
| C06 | C05 | N04 | H32 | 134.3° | 56.0° |
| C06 | C11 | C10 | H15 | 120.6° | 120.0° |
| C06 | C11 | C10 | H16 | 120.6° | 120.0° |
| C11 | C06 | C07 | H6 | 117.0° | 120.0° |
| C06 | C11 | C10 | C09 | 49.8° | 60.0° |
| C11 | C06 | C07 | C08 | 43.6° | 60.0° |
| C11 | C06 | C05 | H4 | 146.9° | 55.0° |
| C11 | C06 | C05 | H5 | 94.9° | 175.0° |
| C11 | C06 | C07 | H7 | 164.6° | 180.0° |
| C11 | C06 | C07 | H8 | 77.4° | 60.0° |
| C06 | C11 | C10 | H13 | 70.6° | 60.0° |
| C06 | C11 | C10 | H14 | 170.2° | 180.0° |
| C06 | C11 | H15 | H16 | 118.0° | 120.0° |
| C10 | C11 | C06 | C07 | 0.5° | 60.0° |
| C11 | C10 | C09 | H13 | 120.4° | 120.0° |
| C11 | C10 | C09 | H14 | 120.4° | 120.0° |
| C11 | C10 | C09 | C08 | 57.4° | 60.0° |
| C10 | C11 | C06 | H6 | 117.6° | 60.0° |
| C11 | C10 | C09 | H11 | 178.0° | 180.0° |
| C11 | C10 | C09 | H12 | 63.2° | 60.0° |
| C11 | C10 | H13 | H14 | 118.8° | 120.0° |
| C10 | C11 | H15 | H16 | 118.0° | 120.0° |
| C24 | C29 | C28 | H31 | 180.0° | 179.7° |
| C29 | C24 | C25 | C26 | 0.0° | 0.2° |
| C24 | C29 | C28 | C27 | 0.6° | 0.5° |
| C29 | C24 | C17 | H21 | 167.7° | 7.8° |
| C29 | C24 | C25 | H27 | 180.0° | 179.8° |
| C24 | C29 | C28 | H30 | 179.4° | 179.7° |
| C25 | C24 | C29 | C28 | 0.3° | 0.5° |
| C24 | C25 | C26 | H27 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.1° | 0.0° |
| C25 | C24 | C17 | H21 | 12.2° | 171.9° |
| C24 | C25 | C26 | H28 | 179.9° | 180.0° |
| C25 | C24 | C29 | H31 | 179.7° | 179.8° |
| C29 | C28 | C27 | H30 | 180.0° | 179.8° |
| C29 | C28 | C27 | C26 | 0.5° | 0.2° |
| C29 | C28 | C27 | H29 | 179.5° | 179.7° |
| C06 | C07 | C08 | H7 | 121.0° | 120.0° |
| C06 | C07 | C08 | H8 | 121.0° | 120.0° |
| C06 | C07 | C08 | C09 | 37.0° | 60.0° |
| C07 | C06 | C05 | H4 | 86.1° | 65.0° |
| C07 | C06 | C05 | H5 | 32.1° | 55.0° |
| C06 | C07 | H7 | H8 | 116.8° | 119.9° |
| C06 | C07 | C08 | H9 | 83.6° | 60.0° |
| C06 | C07 | C08 | H10 | 157.7° | 180.0° |
| C07 | C06 | C11 | H15 | 121.2° | 60.0° |
| C07 | C06 | C11 | H16 | 120.1° | 180.0° |
| C18 | C23 | C22 | H26 | 180.0° | 179.7° |
| C18 | C23 | C22 | C21 | 0.3° | 0.6° |
| C23 | C18 | C19 | C20 | 1.7° | 0.3° |
| C23 | C18 | C17 | H21 | 153.9° | 8.3° |
| C23 | C18 | C19 | H22 | 178.3° | 179.7° |
| C18 | C23 | C22 | H25 | 179.7° | 179.7° |
| C22 | C23 | C18 | C19 | 0.9° | 0.6° |
| C23 | C22 | C21 | H25 | 180.0° | 179.7° |
| C23 | C22 | C21 | C20 | 0.8° | 0.3° |
| C23 | C22 | C21 | H24 | 179.2° | 179.7° |
| C18 | C19 | C20 | H22 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 1.3° | 0.0° |
| C19 | C18 | C17 | H21 | 24.3° | 172.0° |
| C18 | C19 | C20 | H23 | 178.7° | 180.0° |
| C19 | C18 | C23 | H26 | 179.0° | 179.7° |
| C25 | C26 | C27 | C28 | 0.2° | 0.0° |
| C25 | C26 | C27 | H28 | 180.0° | 179.9° |
| C25 | C26 | C27 | H29 | 179.9° | 180.0° |
| C28 | C27 | C26 | H29 | 180.0° | 180.0° |
| C28 | C27 | C26 | H28 | 179.8° | 180.0° |
| C27 | C28 | C29 | H31 | 179.4° | 179.8° |
| C27 | C26 | C25 | H27 | 179.9° | 180.0° |
| C26 | C27 | C28 | H30 | 179.5° | 180.0° |
| C10 | C09 | C08 | C07 | 13.1° | 60.0° |
| C10 | C09 | C08 | H11 | 120.6° | 120.0° |
| C10 | C09 | C08 | H12 | 120.6° | 120.0° |
| C10 | C09 | C08 | H9 | 133.7° | 60.0° |
| C10 | C09 | C08 | H10 | 107.5° | 180.0° |
| C10 | C09 | H11 | H12 | 118.1° | 120.0° |
| C09 | C10 | H13 | H14 | 118.8° | 120.0° |
| C09 | C10 | C11 | H15 | 170.4° | 60.0° |
| C09 | C10 | C11 | H16 | 70.8° | 180.0° |
| C22 | C21 | C20 | C19 | 0.0° | 0.0° |
| C22 | C21 | C20 | H24 | 180.0° | 180.0° |
| C22 | C21 | C20 | H23 | 180.0° | 180.0° |
| C21 | C22 | C23 | H26 | 179.7° | 179.7° |
| C19 | C20 | C21 | H23 | 180.0° | 180.0° |
| C19 | C20 | C21 | H24 | 180.0° | 180.0° |
| C07 | C08 | C09 | H9 | 120.6° | 120.1° |
| C07 | C08 | C09 | H10 | 120.6° | 120.0° |
| C08 | C07 | C06 | H6 | 73.4° | 60.0° |
| C08 | C07 | H7 | H8 | 116.9° | 120.1° |
| C07 | C08 | H9 | H10 | 118.1° | 120.0° |
| C07 | C08 | C09 | H11 | 133.7° | 180.0° |
| C07 | C08 | C09 | H12 | 107.5° | 60.0° |
| C09 | C08 | C07 | H7 | 158.0° | 180.0° |
| C09 | C08 | C07 | H8 | 84.0° | 59.9° |
| C09 | C08 | H9 | H10 | 118.1° | 120.0° |
| C08 | C09 | H11 | H12 | 118.1° | 120.0° |
| C08 | C09 | C10 | H13 | 63.0° | 60.0° |
| C08 | C09 | C10 | H14 | 177.8° | 180.0° |
| C21 | C20 | C19 | H22 | 178.7° | 180.0° |
| C20 | C21 | C22 | H25 | 179.2° | 180.0° |
| H1 | C02 | C03 | H2 | 85.8° | 180.0° |
| H1 | C02 | C03 | H3 | 32.3° | 59.9° |
| H1 | C02 | C12 | H17 | 37.3° | 65.0° |
| H1 | C02 | C12 | H18 | 80.8° | 175.1° |
| H1 | C02 | O01 | H35 | 58.8° | 180.0° |
| H2 | C03 | N04 | H32 | 106.1° | 176.0° |
| H3 | C03 | N04 | H32 | 135.8° | 64.0° |
| H4 | C05 | C06 | H6 | 31.0° | 175.0° |
| H4 | C05 | N04 | H32 | 104.8° | 64.0° |
| H5 | C05 | C06 | H6 | 149.3° | 65.0° |
| H5 | C05 | N04 | H32 | 13.5° | 176.0° |
| H6 | C06 | C07 | H7 | 47.6° | 60.0° |
| H6 | C06 | C07 | H8 | 165.6° | 180.0° |
| H6 | C06 | C11 | H15 | 121.8° | 179.9° |
| H6 | C06 | C11 | H16 | 3.0° | 60.0° |
| H7 | C07 | C08 | H9 | 37.4° | 59.9° |
| H7 | C07 | C08 | H10 | 81.3° | 60.0° |
| H8 | C07 | C08 | H9 | 155.4° | 180.0° |
| H8 | C07 | C08 | H10 | 36.7° | 60.0° |
| H9 | C08 | C09 | H11 | 105.7° | 60.0° |
| H9 | C08 | C09 | H12 | 13.1° | 179.9° |
| H10 | C08 | C09 | H11 | 13.1° | 60.0° |
| H10 | C08 | C09 | H12 | 131.9° | 60.0° |
| H11 | C09 | C10 | H13 | 57.7° | 60.0° |
| H11 | C09 | C10 | H14 | 61.6° | 60.0° |
| H12 | C09 | C10 | H13 | 176.4° | 180.0° |
| H12 | C09 | C10 | H14 | 57.2° | 60.0° |
| H13 | C10 | C11 | H15 | 50.1° | 180.0° |
| H13 | C10 | C11 | H16 | 168.8° | 60.0° |
| H14 | C10 | C11 | H15 | 69.2° | 60.0° |
| H14 | C10 | C11 | H16 | 49.6° | 60.0° |
| H17 | C12 | N13 | H34 | 13.7° | 119.9° |
| H18 | C12 | N13 | H34 | 131.9° | 120.0° |
| H19 | C16 | C17 | H21 | 179.6° | 175.0° |
| H20 | C16 | C17 | H21 | 63.1° | 65.0° |
| H22 | C19 | C20 | H23 | 1.3° | 0.0° |
| H23 | C20 | C21 | H24 | 0.0° | 0.0° |
| H24 | C21 | C22 | H25 | 0.8° | 0.0° |
| H25 | C22 | C23 | H26 | 0.3° | 0.0° |
| H27 | C25 | C26 | H28 | 0.1° | 0.0° |
| H28 | C26 | C27 | H29 | 0.1° | 0.1° |
| H29 | C27 | C28 | H30 | 0.5° | 0.0° |
| H30 | C28 | C29 | H31 | 0.6° | 0.0° |
