2XI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C21 | C19 | sing | 1.53Å | 1.53Å | |
| C01 | C02 | sing | 1.53Å | 1.52Å | |
| C19 | C22 | sing | 1.53Å | 1.53Å | |
| C19 | C18 | sing | 1.51Å | 1.52Å | |
| C23 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C02 | C04 | sing | 1.53Å | 1.53Å | |
| C02 | C03 | sing | 1.53Å | 1.52Å | |
| C02 | N05 | sing | 1.46Å | 1.46Å | |
| C24 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| N05 | C06 | sing | 1.35Å | 1.34Å | |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | N14 | sing | 1.40Å | 1.42Å | |
| C06 | C07 | sing | 1.51Å | 1.52Å | |
| C06 | O30 | doub | 1.21Å | 1.24Å | |
| C27 | C26 | sing | 1.53Å | 1.52Å | |
| N14 | C07 | sing | 1.47Å | 1.49Å | |
| N14 | C25 | sing | 1.35Å | 1.36Å | |
| C07 | C08 | sing | 1.51Å | 1.48Å | |
| C25 | O29 | doub | 1.21Å | 1.22Å | |
| C25 | C26 | sing | 1.51Å | 1.53Å | |
| C26 | O28 | sing | 1.43Å | 1.44Å | |
| C08 | C09 | doub | 1.39Å | 1.40Å | Aromatic |
| C08 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C09 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C13 | N12 | doub | 1.32Å | 1.33Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| N12 | C11 | sing | 1.32Å | 1.34Å | Aromatic |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C13 | H2 | sing | 1.08Å | 1.08Å | |
| C17 | H3 | sing | 1.08Å | 1.08Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.08Å | 1.08Å | |
| C26 | H14 | sing | 1.09Å | 1.10Å | |
| C01 | H15 | sing | 1.09Å | 1.10Å | |
| C01 | H16 | sing | 1.09Å | 1.10Å | |
| C01 | H17 | sing | 1.09Å | 1.10Å | |
| C03 | H18 | sing | 1.09Å | 1.10Å | |
| C03 | H19 | sing | 1.09Å | 1.10Å | |
| C03 | H20 | sing | 1.09Å | 1.10Å | |
| C04 | H21 | sing | 1.09Å | 1.10Å | |
| C04 | H22 | sing | 1.09Å | 1.10Å | |
| C04 | H23 | sing | 1.09Å | 1.10Å | |
| C07 | H24 | sing | 1.09Å | 1.10Å | |
| C09 | H25 | sing | 1.08Å | 1.08Å | |
| C11 | H26 | sing | 1.08Å | 1.08Å | |
| C16 | H27 | sing | 1.08Å | 1.08Å | |
| C23 | H28 | sing | 1.08Å | 1.08Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| N05 | H32 | sing | 0.97Å | 1.00Å | |
| O28 | H33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C19 | C21 | 110.9° | 109.5° |
| C20 | C19 | C22 | 108.9° | 109.5° |
| C20 | C19 | C18 | 106.4° | 109.5° |
| C19 | C20 | H4 | 109.5° | 109.5° |
| C19 | C20 | H5 | 109.5° | 109.5° |
| C19 | C20 | H6 | 109.4° | 109.5° |
| C21 | C19 | C22 | 107.0° | 109.4° |
| C21 | C19 | C18 | 109.8° | 109.5° |
| C19 | C21 | H7 | 109.5° | 109.5° |
| C19 | C21 | H8 | 109.5° | 109.5° |
| C19 | C21 | H9 | 109.5° | 109.4° |
| C01 | C02 | C04 | 107.7° | 109.5° |
| C01 | C02 | C03 | 109.7° | 109.5° |
| C01 | C02 | N05 | 106.0° | 109.4° |
| C02 | C01 | H15 | 109.5° | 109.5° |
| C02 | C01 | H16 | 109.4° | 109.5° |
| C02 | C01 | H17 | 109.5° | 109.5° |
| C22 | C19 | C18 | 114.0° | 109.5° |
| C19 | C22 | H10 | 109.5° | 109.4° |
| C19 | C22 | H11 | 109.4° | 109.5° |
| C19 | C22 | H12 | 109.5° | 109.4° |
| C19 | C18 | C23 | 119.0° | 119.9° |
| C19 | C18 | C17 | 122.5° | 119.9° |
| C18 | C23 | C24 | 121.1° | 120.1° |
| C23 | C18 | C17 | 118.4° | 120.1° |
| C18 | C23 | H28 | 119.5° | 120.0° |
| C23 | C24 | C15 | 120.3° | 120.0° |
| C23 | C24 | H13 | 119.9° | 120.1° |
| C24 | C23 | H28 | 119.4° | 120.0° |
| C18 | C17 | C16 | 120.5° | 120.1° |
| C18 | C17 | H3 | 119.8° | 119.9° |
| C04 | C02 | C03 | 111.0° | 109.5° |
| C04 | C02 | N05 | 113.2° | 109.5° |
| C02 | C04 | H21 | 109.5° | 109.5° |
| C02 | C04 | H22 | 109.5° | 109.4° |
| C02 | C04 | H23 | 109.5° | 109.5° |
| C03 | C02 | N05 | 109.0° | 109.5° |
| C02 | C03 | H18 | 109.5° | 109.5° |
| C02 | C03 | H19 | 109.4° | 109.5° |
| C02 | C03 | H20 | 109.4° | 109.5° |
| C02 | N05 | C06 | 128.2° | 120.0° |
| C02 | N05 | H32 | 115.9° | 120.0° |
| C24 | C15 | C16 | 118.7° | 119.8° |
| C24 | C15 | N14 | 119.0° | 120.1° |
| C15 | C24 | H13 | 119.9° | 120.0° |
| N05 | C06 | C07 | 113.7° | 120.0° |
| N05 | C06 | O30 | 124.7° | 120.0° |
| C06 | N05 | H32 | 115.9° | 120.0° |
| C17 | C16 | C15 | 120.9° | 119.9° |
| C16 | C17 | H3 | 119.7° | 120.0° |
| C17 | C16 | H27 | 119.6° | 120.0° |
| C16 | C15 | N14 | 122.2° | 120.1° |
| C15 | C16 | H27 | 119.5° | 120.1° |
| C15 | N14 | C07 | 116.1° | 120.0° |
| C15 | N14 | C25 | 122.8° | 120.0° |
| C07 | C06 | O30 | 121.6° | 120.0° |
| C06 | C07 | N14 | 113.1° | 109.5° |
| C06 | C07 | C08 | 104.2° | 109.5° |
| C06 | C07 | H24 | 107.4° | 109.5° |
| C27 | C26 | C25 | 113.0° | 109.5° |
| C27 | C26 | O28 | 104.1° | 109.5° |
| C27 | C26 | H14 | 109.8° | 109.5° |
| C26 | C27 | H29 | 109.5° | 109.5° |
| C26 | C27 | H30 | 109.4° | 109.5° |
| C26 | C27 | H31 | 109.4° | 109.5° |
| C07 | N14 | C25 | 120.4° | 120.0° |
| N14 | C07 | C08 | 115.9° | 109.5° |
| N14 | C07 | H24 | 107.8° | 109.4° |
| N14 | C25 | O29 | 118.8° | 120.0° |
| N14 | C25 | C26 | 124.7° | 120.0° |
| C07 | C08 | C09 | 116.2° | 120.4° |
| C07 | C08 | C13 | 123.5° | 120.4° |
| C08 | C07 | H24 | 108.0° | 109.4° |
| O29 | C25 | C26 | 116.5° | 120.0° |
| C25 | C26 | O28 | 108.9° | 109.5° |
| C25 | C26 | H14 | 109.8° | 109.4° |
| O28 | C26 | H14 | 111.1° | 109.5° |
| C26 | O28 | H33 | 109.5° | 114.0° |
| C09 | C08 | C13 | 119.7° | 119.2° |
| C08 | C09 | C10 | 119.5° | 118.4° |
| C08 | C09 | H25 | 120.3° | 120.8° |
| C08 | C13 | N12 | 119.4° | 120.8° |
| C08 | C13 | H2 | 120.3° | 119.7° |
| C09 | C10 | C11 | 118.0° | 119.1° |
| C09 | C10 | H1 | 121.0° | 120.4° |
| C10 | C09 | H25 | 120.2° | 120.8° |
| C13 | N12 | C11 | 121.8° | 121.7° |
| N12 | C13 | H2 | 120.3° | 119.6° |
| C10 | C11 | N12 | 121.4° | 120.8° |
| C11 | C10 | H1 | 121.0° | 120.5° |
| C10 | C11 | H26 | 119.3° | 119.6° |
| N12 | C11 | H26 | 119.3° | 119.6° |
| H4 | C20 | H5 | 109.4° | 109.5° |
| H4 | C20 | H6 | 109.5° | 109.5° |
| H5 | C20 | H6 | 109.5° | 109.5° |
| H7 | C21 | H8 | 109.4° | 109.5° |
| H7 | C21 | H9 | 109.5° | 109.5° |
| H8 | C21 | H9 | 109.5° | 109.4° |
| H10 | C22 | H11 | 109.5° | 109.5° |
| H10 | C22 | H12 | 109.5° | 109.5° |
| H11 | C22 | H12 | 109.5° | 109.5° |
| H15 | C01 | H16 | 109.5° | 109.5° |
| H15 | C01 | H17 | 109.5° | 109.4° |
| H16 | C01 | H17 | 109.5° | 109.5° |
| H18 | C03 | H19 | 109.4° | 109.4° |
| H18 | C03 | H20 | 109.5° | 109.5° |
| H19 | C03 | H20 | 109.5° | 109.5° |
| H21 | C04 | H22 | 109.5° | 109.5° |
| H21 | C04 | H23 | 109.4° | 109.5° |
| H22 | C04 | H23 | 109.4° | 109.5° |
| H29 | C27 | H30 | 109.5° | 109.5° |
| H29 | C27 | H31 | 109.5° | 109.5° |
| H30 | C27 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C19 | C21 | C22 | 118.6° | 120.0° |
| C20 | C19 | C21 | C18 | 117.2° | 120.0° |
| C20 | C19 | C22 | C18 | 118.6° | 120.0° |
| C20 | C19 | C18 | C23 | 66.3° | 119.4° |
| C20 | C19 | C18 | C17 | 109.2° | 60.0° |
| C19 | C20 | H4 | H5 | 120.0° | 120.0° |
| C19 | C20 | H4 | H6 | 120.0° | 120.0° |
| C19 | C20 | H5 | H6 | 120.0° | 120.0° |
| C20 | C19 | C21 | H7 | 180.0° | 60.0° |
| C20 | C19 | C21 | H8 | 60.0° | 180.0° |
| C20 | C19 | C21 | H9 | 60.0° | 60.0° |
| C20 | C19 | C22 | H10 | 180.0° | 60.0° |
| C20 | C19 | C22 | H11 | 60.0° | 180.0° |
| C20 | C19 | C22 | H12 | 60.0° | 60.0° |
| C21 | C19 | C22 | C18 | 121.6° | 120.0° |
| C21 | C19 | C18 | C23 | 53.8° | 120.5° |
| C21 | C19 | C18 | C17 | 130.8° | 60.1° |
| C21 | C19 | C20 | H4 | 180.0° | 60.0° |
| C21 | C19 | C20 | H5 | 60.0° | 180.0° |
| C21 | C19 | C20 | H6 | 60.0° | 60.0° |
| C19 | C21 | H7 | H8 | 120.0° | 120.0° |
| C19 | C21 | H7 | H9 | 120.0° | 120.0° |
| C19 | C21 | H8 | H9 | 120.0° | 119.9° |
| C21 | C19 | C22 | H10 | 60.1° | 180.0° |
| C21 | C19 | C22 | H11 | 179.9° | 60.0° |
| C21 | C19 | C22 | H12 | 59.9° | 60.0° |
| C01 | C02 | C04 | C03 | 120.1° | 120.0° |
| C01 | C02 | C04 | N05 | 116.9° | 119.9° |
| C01 | C02 | C03 | N05 | 115.7° | 120.0° |
| C01 | C02 | N05 | C06 | 164.9° | 60.1° |
| C02 | C01 | H15 | H16 | 120.0° | 120.0° |
| C02 | C01 | H15 | H17 | 120.0° | 120.0° |
| C02 | C01 | H16 | H17 | 120.0° | 120.0° |
| C01 | C02 | C03 | H18 | 180.0° | 60.0° |
| C01 | C02 | C03 | H19 | 60.0° | 180.0° |
| C01 | C02 | C03 | H20 | 60.0° | 60.0° |
| C01 | C02 | C04 | H21 | 180.0° | 60.0° |
| C01 | C02 | C04 | H22 | 60.0° | 180.0° |
| C01 | C02 | C04 | H23 | 60.0° | 60.0° |
| C01 | C02 | N05 | H32 | 15.1° | 120.1° |
| C22 | C19 | C18 | C23 | 173.7° | 0.6° |
| C22 | C19 | C18 | C17 | 10.8° | 180.0° |
| C22 | C19 | C20 | H4 | 62.6° | 180.0° |
| C22 | C19 | C20 | H5 | 177.4° | 60.0° |
| C22 | C19 | C20 | H6 | 57.4° | 60.0° |
| C22 | C19 | C21 | H7 | 61.4° | 60.0° |
| C22 | C19 | C21 | H8 | 58.6° | 60.0° |
| C22 | C19 | C21 | H9 | 178.6° | 180.0° |
| C19 | C22 | H10 | H11 | 120.0° | 120.0° |
| C19 | C22 | H10 | H12 | 120.0° | 119.9° |
| C19 | C22 | H11 | H12 | 120.0° | 120.0° |
| C19 | C18 | C23 | C17 | 175.7° | 179.4° |
| C19 | C18 | C23 | C24 | 179.2° | 179.7° |
| C19 | C18 | C17 | C16 | 179.1° | 179.9° |
| C19 | C18 | C17 | H3 | 0.9° | 0.5° |
| C18 | C19 | C20 | H4 | 60.7° | 60.0° |
| C18 | C19 | C20 | H5 | 59.3° | 60.0° |
| C18 | C19 | C20 | H6 | 179.3° | 180.0° |
| C18 | C19 | C21 | H7 | 62.8° | 180.0° |
| C18 | C19 | C21 | H8 | 177.2° | 60.0° |
| C18 | C19 | C21 | H9 | 57.2° | 60.0° |
| C18 | C19 | C22 | H10 | 61.4° | 60.0° |
| C18 | C19 | C22 | H11 | 58.6° | 60.0° |
| C18 | C19 | C22 | H12 | 178.6° | 180.0° |
| C19 | C18 | C23 | H28 | 0.8° | 0.6° |
| C18 | C23 | C24 | H28 | 180.0° | 179.7° |
| C18 | C23 | C24 | C15 | 0.8° | 0.1° |
| C23 | C18 | C17 | C16 | 5.4° | 0.5° |
| C23 | C18 | C17 | H3 | 174.6° | 179.9° |
| C18 | C23 | C24 | H13 | 179.2° | 180.0° |
| C24 | C23 | C18 | C17 | 3.5° | 0.3° |
| C23 | C24 | C15 | H13 | 180.0° | 179.9° |
| C23 | C24 | C15 | C16 | 0.2° | 0.1° |
| C23 | C24 | C15 | N14 | 177.2° | 179.7° |
| C18 | C17 | C16 | H3 | 180.0° | 179.5° |
| C18 | C17 | C16 | C15 | 4.6° | 0.5° |
| C18 | C17 | C16 | H27 | 175.4° | 179.5° |
| C17 | C18 | C23 | H28 | 176.4° | 180.0° |
| C04 | C02 | C03 | N05 | 125.4° | 120.0° |
| C04 | C02 | N05 | C06 | 47.0° | 180.0° |
| C04 | C02 | C01 | H15 | 180.0° | 60.0° |
| C04 | C02 | C01 | H16 | 60.0° | 180.0° |
| C04 | C02 | C01 | H17 | 60.0° | 59.9° |
| C04 | C02 | C03 | H18 | 61.1° | 60.0° |
| C04 | C02 | C03 | H19 | 178.9° | 60.0° |
| C04 | C02 | C03 | H20 | 58.9° | 180.0° |
| C02 | C04 | H21 | H22 | 120.0° | 119.9° |
| C02 | C04 | H21 | H23 | 120.0° | 120.0° |
| C02 | C04 | H22 | H23 | 120.0° | 120.0° |
| C04 | C02 | N05 | H32 | 133.0° | 0.1° |
| C03 | C02 | N05 | C06 | 77.1° | 59.9° |
| C03 | C02 | C01 | H15 | 59.1° | 60.0° |
| C03 | C02 | C01 | H16 | 179.1° | 60.0° |
| C03 | C02 | C01 | H17 | 60.9° | 180.0° |
| C02 | C03 | H18 | H19 | 120.0° | 120.0° |
| C02 | C03 | H18 | H20 | 120.0° | 120.1° |
| C02 | C03 | H19 | H20 | 120.0° | 120.0° |
| C03 | C02 | C04 | H21 | 59.9° | 180.0° |
| C03 | C02 | C04 | H22 | 60.1° | 60.0° |
| C03 | C02 | C04 | H23 | 179.9° | 60.0° |
| C03 | C02 | N05 | H32 | 102.9° | 119.9° |
| C02 | N05 | C06 | H32 | 180.0° | 179.8° |
| C02 | N05 | C06 | C07 | 172.6° | 180.0° |
| C02 | N05 | C06 | O30 | 8.6° | 0.1° |
| N05 | C02 | C01 | H15 | 58.5° | 179.9° |
| N05 | C02 | C01 | H16 | 61.5° | 60.0° |
| N05 | C02 | C01 | H17 | 178.5° | 60.0° |
| N05 | C02 | C03 | H18 | 64.3° | 180.0° |
| N05 | C02 | C03 | H19 | 55.7° | 60.0° |
| N05 | C02 | C03 | H20 | 175.7° | 60.0° |
| N05 | C02 | C04 | H21 | 63.1° | 59.9° |
| N05 | C02 | C04 | H22 | 176.9° | 60.0° |
| N05 | C02 | C04 | H23 | 56.9° | 180.0° |
| C24 | C15 | C16 | C17 | 1.7° | 0.3° |
| C24 | C15 | C16 | N14 | 176.9° | 179.7° |
| C24 | C15 | N14 | C07 | 87.0° | 110.7° |
| C24 | C15 | N14 | C25 | 83.3° | 69.2° |
| C24 | C15 | C16 | H27 | 178.3° | 179.7° |
| C15 | C24 | C23 | H28 | 179.2° | 179.8° |
| N05 | C06 | C07 | O30 | 178.8° | 179.9° |
| N05 | C06 | C07 | N14 | 103.2° | 180.0° |
| N05 | C06 | C07 | C08 | 130.1° | 60.0° |
| N05 | C06 | C07 | H24 | 15.8° | 60.1° |
| C17 | C16 | C15 | H27 | 180.0° | 180.0° |
| C17 | C16 | C15 | N14 | 175.2° | 180.0° |
| C16 | C15 | N14 | C07 | 89.9° | 69.6° |
| C16 | C15 | N14 | C25 | 99.8° | 110.4° |
| C15 | C16 | C17 | H3 | 175.4° | 180.0° |
| C16 | C15 | C24 | H13 | 179.8° | 180.0° |
| C15 | N14 | C07 | C06 | 18.8° | 112.7° |
| C15 | N14 | C07 | C25 | 170.6° | 179.9° |
| C15 | N14 | C07 | C08 | 139.0° | 7.3° |
| C15 | N14 | C25 | O29 | 145.3° | 5.3° |
| C15 | N14 | C25 | C26 | 34.4° | 174.7° |
| N14 | C15 | C24 | H13 | 2.8° | 0.3° |
| C15 | N14 | C07 | H24 | 99.9° | 127.3° |
| N14 | C15 | C16 | H27 | 4.8° | 0.0° |
| C06 | C07 | N14 | C08 | 120.2° | 120.1° |
| C06 | C07 | N14 | H24 | 118.7° | 120.0° |
| C06 | C07 | N14 | C25 | 170.7° | 67.2° |
| C06 | C07 | C08 | H24 | 114.0° | 120.1° |
| C06 | C07 | C08 | C09 | 85.8° | 115.5° |
| C06 | C07 | C08 | C13 | 85.0° | 64.0° |
| C07 | C06 | N05 | H32 | 7.4° | 0.1° |
| O30 | C06 | C07 | N14 | 78.0° | 0.0° |
| O30 | C06 | C07 | C08 | 48.7° | 120.0° |
| O30 | C06 | C07 | H24 | 163.1° | 120.0° |
| O30 | C06 | N05 | H32 | 171.4° | 179.9° |
| C27 | C26 | C25 | N14 | 70.4° | 73.7° |
| C27 | C26 | C25 | O29 | 109.3° | 106.2° |
| C27 | C26 | C25 | O28 | 115.1° | 120.0° |
| C27 | C26 | C25 | H14 | 123.0° | 120.0° |
| C27 | C26 | O28 | H14 | 118.2° | 120.0° |
| C26 | C27 | H29 | H30 | 120.0° | 120.0° |
| C26 | C27 | H29 | H31 | 120.0° | 120.0° |
| C26 | C27 | H30 | H31 | 120.0° | 120.0° |
| C27 | C26 | O28 | H33 | 118.0° | 60.0° |
| N14 | C07 | C08 | H24 | 121.0° | 119.9° |
| C07 | N14 | C25 | O29 | 24.6° | 174.7° |
| C07 | N14 | C25 | C26 | 155.6° | 5.4° |
| N14 | C07 | C08 | C09 | 149.3° | 124.5° |
| N14 | C07 | C08 | C13 | 39.9° | 56.0° |
| C25 | N14 | C07 | C08 | 50.4° | 172.7° |
| N14 | C25 | O29 | C26 | 179.7° | 179.9° |
| N14 | C25 | C26 | O28 | 174.5° | 166.2° |
| N14 | C25 | C26 | H14 | 52.6° | 46.2° |
| C25 | N14 | C07 | H24 | 70.6° | 52.8° |
| C07 | C08 | C09 | C13 | 171.2° | 179.5° |
| C07 | C08 | C09 | C10 | 174.6° | 180.0° |
| C07 | C08 | C13 | N12 | 173.7° | 179.8° |
| C07 | C08 | C13 | H2 | 6.3° | 0.2° |
| C07 | C08 | C09 | H25 | 5.4° | 0.1° |
| O29 | C25 | C26 | O28 | 5.8° | 13.8° |
| O29 | C25 | C26 | H14 | 127.7° | 133.8° |
| C25 | C26 | O28 | H14 | 121.1° | 120.0° |
| C25 | C26 | C27 | H29 | 180.0° | 174.0° |
| C25 | C26 | C27 | H30 | 60.0° | 54.1° |
| C25 | C26 | C27 | H31 | 60.0° | 65.9° |
| C25 | C26 | O28 | H33 | 2.7° | 180.0° |
| O28 | C26 | C27 | H29 | 62.0° | 65.9° |
| O28 | C26 | C27 | H30 | 178.0° | 174.1° |
| O28 | C26 | C27 | H31 | 58.0° | 54.1° |
| C08 | C09 | C10 | H25 | 180.0° | 179.9° |
| C09 | C08 | C13 | N12 | 3.2° | 0.7° |
| C08 | C09 | C10 | C11 | 1.6° | 0.1° |
| C08 | C09 | C10 | H1 | 178.4° | 179.7° |
| C09 | C08 | C13 | H2 | 176.8° | 179.8° |
| C09 | C08 | C07 | H24 | 28.2° | 4.6° |
| C13 | C08 | C09 | C10 | 3.4° | 0.5° |
| C08 | C13 | N12 | H2 | 180.0° | 179.5° |
| C08 | C13 | N12 | C11 | 1.1° | 0.5° |
| C13 | C08 | C07 | H24 | 160.9° | 175.9° |
| C13 | C08 | C09 | H25 | 176.6° | 179.6° |
| C09 | C10 | C11 | H1 | 180.0° | 179.8° |
| C09 | C10 | C11 | N12 | 0.6° | 0.2° |
| C09 | C10 | C11 | H26 | 179.4° | 179.7° |
| C13 | N12 | C11 | C10 | 0.8° | 0.0° |
| C13 | N12 | C11 | H26 | 179.1° | 179.9° |
| C10 | C11 | N12 | H26 | 180.0° | 179.9° |
| C11 | C10 | C09 | H25 | 178.5° | 180.0° |
| N12 | C11 | C10 | H1 | 179.4° | 179.9° |
| C11 | N12 | C13 | H2 | 178.9° | 180.0° |
| H1 | C10 | C09 | H25 | 1.6° | 0.2° |
| H1 | C10 | C11 | H26 | 0.6° | 0.0° |
| H3 | C17 | C16 | H27 | 4.6° | 0.1° |
| H4 | C20 | H5 | H6 | 120.0° | 120.0° |
| H7 | C21 | H8 | H9 | 120.0° | 120.0° |
| H10 | C22 | H11 | H12 | 120.0° | 120.1° |
| H13 | C24 | C23 | H28 | 0.8° | 0.3° |
| H14 | C26 | C27 | H29 | 57.0° | 54.1° |
| H14 | C26 | C27 | H30 | 63.0° | 65.9° |
| H14 | C26 | C27 | H31 | 177.0° | 174.1° |
| H14 | C26 | O28 | H33 | 123.8° | 60.1° |
| H15 | C01 | H16 | H17 | 120.0° | 119.9° |
| H18 | C03 | H19 | H20 | 120.0° | 120.0° |
| H21 | C04 | H22 | H23 | 119.9° | 120.0° |
| H29 | C27 | H30 | H31 | 120.0° | 120.0° |
