L73
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C18 | sing | 1.53Å | 1.60Å | |
| C19 | C18 | sing | 1.53Å | 1.57Å | |
| C21 | C18 | sing | 1.53Å | 1.57Å | |
| C18 | C15 | sing | 1.51Å | 1.56Å | |
| C33 | O32 | sing | 1.43Å | 1.42Å | |
| O32 | C31 | sing | 1.36Å | 1.38Å | |
| C15 | C16 | doub | 1.38Å | 1.37Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C01 | C02 | sing | 1.53Å | 1.52Å | |
| C31 | C34 | doub | 1.39Å | 1.42Å | Aromatic |
| C31 | C30 | sing | 1.39Å | 1.39Å | Aromatic |
| C34 | C27 | sing | 1.38Å | 1.41Å | Aromatic |
| C17 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C02 | C03 | sing | 1.53Å | 1.54Å | |
| C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C38 | N37 | sing | 1.47Å | 1.46Å | |
| C30 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C26 | sing | 1.51Å | 1.53Å | |
| C27 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.51Å | 1.50Å | |
| C26 | C25 | sing | 1.53Å | 1.57Å | |
| C25 | N24 | sing | 1.47Å | 1.50Å | |
| C25 | C35 | sing | 1.51Å | 1.53Å | |
| C03 | C04 | sing | 1.53Å | 1.55Å | |
| C29 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| N37 | C35 | sing | 1.35Å | 1.39Å | |
| O23 | C22 | doub | 1.21Å | 1.23Å | |
| N24 | C22 | sing | 1.35Å | 1.40Å | |
| C35 | O36 | doub | 1.21Å | 1.24Å | |
| C11 | C10 | sing | 1.53Å | 1.56Å | |
| C22 | C10 | sing | 1.51Å | 1.55Å | |
| C04 | N05 | sing | 1.47Å | 1.48Å | |
| C10 | N09 | sing | 1.46Å | 1.46Å | |
| N09 | C07 | sing | 1.35Å | 1.40Å | |
| N05 | C06 | sing | 1.47Å | 1.48Å | |
| C07 | C06 | sing | 1.51Å | 1.53Å | |
| C07 | O08 | doub | 1.21Å | 1.23Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C01 | H4 | sing | 1.09Å | 1.10Å | |
| C01 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C02 | H7 | sing | 1.09Å | 1.10Å | |
| C02 | H8 | sing | 1.09Å | 1.10Å | |
| C03 | H9 | sing | 1.09Å | 1.10Å | |
| C03 | H10 | sing | 1.09Å | 1.10Å | |
| C04 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.09Å | 1.10Å | |
| C06 | H13 | sing | 1.09Å | 1.10Å | |
| C06 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.08Å | 1.08Å | |
| C14 | H16 | sing | 1.08Å | 1.08Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| C17 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.08Å | 1.08Å | |
| C29 | H32 | sing | 1.08Å | 1.08Å | |
| C30 | H33 | sing | 1.08Å | 1.08Å | |
| C33 | H34 | sing | 1.09Å | 1.10Å | |
| C33 | H35 | sing | 1.09Å | 1.10Å | |
| C33 | H36 | sing | 1.09Å | 1.10Å | |
| C34 | H37 | sing | 1.08Å | 1.08Å | |
| C38 | H38 | sing | 1.09Å | 1.10Å | |
| C38 | H39 | sing | 1.09Å | 1.10Å | |
| C38 | H40 | sing | 1.09Å | 1.10Å | |
| N05 | H41 | sing | 1.01Å | 1.00Å | |
| N09 | H43 | sing | 0.97Å | 1.00Å | |
| N24 | H44 | sing | 0.97Å | 1.00Å | |
| N37 | H45 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C18 | C19 | 92.7° | 109.5° |
| C20 | C18 | C21 | 92.4° | 109.4° |
| C20 | C18 | C15 | 145.2° | 109.5° |
| C18 | C20 | H22 | 109.5° | 109.5° |
| C18 | C20 | H23 | 109.5° | 109.5° |
| C18 | C20 | H24 | 109.5° | 109.4° |
| C19 | C18 | C21 | 164.5° | 109.5° |
| C19 | C18 | C15 | 93.2° | 109.5° |
| C18 | C19 | H19 | 109.5° | 109.5° |
| C18 | C19 | H20 | 109.5° | 109.5° |
| C18 | C19 | H21 | 109.4° | 109.5° |
| C21 | C18 | C15 | 90.9° | 109.5° |
| C18 | C21 | H25 | 109.5° | 109.4° |
| C18 | C21 | H26 | 109.5° | 109.5° |
| C18 | C21 | H27 | 109.4° | 109.5° |
| C18 | C15 | C16 | 117.9° | 119.9° |
| C18 | C15 | C14 | 122.4° | 120.0° |
| C33 | O32 | C31 | 118.4° | 117.0° |
| O32 | C33 | H34 | 109.5° | 109.5° |
| O32 | C33 | H35 | 109.5° | 109.5° |
| O32 | C33 | H36 | 109.5° | 109.5° |
| O32 | C31 | C34 | 116.2° | 120.0° |
| O32 | C31 | C30 | 122.6° | 120.0° |
| C16 | C15 | C14 | 119.7° | 120.0° |
| C15 | C16 | C17 | 121.2° | 120.0° |
| C15 | C16 | H17 | 119.4° | 120.0° |
| C15 | C14 | C13 | 119.1° | 120.0° |
| C15 | C14 | H16 | 120.4° | 120.0° |
| C16 | C17 | C12 | 119.9° | 120.0° |
| C17 | C16 | H17 | 119.4° | 120.0° |
| C16 | C17 | H18 | 120.0° | 120.0° |
| C14 | C13 | C12 | 121.1° | 120.1° |
| C14 | C13 | H15 | 119.4° | 119.9° |
| C13 | C14 | H16 | 120.5° | 120.1° |
| C01 | C02 | C03 | 114.7° | 109.5° |
| C02 | C01 | H4 | 109.5° | 109.5° |
| C02 | C01 | H5 | 109.5° | 109.5° |
| C02 | C01 | H6 | 109.5° | 109.5° |
| C01 | C02 | H7 | 108.2° | 109.5° |
| C01 | C02 | H8 | 108.2° | 109.5° |
| C34 | C31 | C30 | 121.3° | 119.9° |
| C31 | C34 | C27 | 120.2° | 119.9° |
| C31 | C34 | H37 | 119.9° | 120.0° |
| C31 | C30 | C29 | 118.2° | 119.9° |
| C31 | C30 | H33 | 120.9° | 120.1° |
| C34 | C27 | C26 | 122.0° | 120.0° |
| C34 | C27 | C28 | 117.5° | 120.1° |
| C27 | C34 | H37 | 119.9° | 120.0° |
| C17 | C12 | C13 | 119.0° | 120.0° |
| C17 | C12 | C11 | 116.3° | 120.0° |
| C12 | C17 | H18 | 120.1° | 120.0° |
| C02 | C03 | C04 | 112.8° | 109.5° |
| C03 | C02 | H7 | 108.2° | 109.5° |
| C03 | C02 | H8 | 108.2° | 109.4° |
| C02 | C03 | H9 | 108.6° | 109.5° |
| C02 | C03 | H10 | 108.6° | 109.4° |
| C13 | C12 | C11 | 124.7° | 120.1° |
| C12 | C13 | H15 | 119.4° | 120.0° |
| C38 | N37 | C35 | 122.0° | 120.0° |
| N37 | C38 | H38 | 109.5° | 109.5° |
| N37 | C38 | H39 | 109.5° | 109.4° |
| N37 | C38 | H40 | 109.5° | 109.5° |
| C38 | N37 | H45 | 119.0° | 119.9° |
| C30 | C29 | C28 | 121.0° | 120.1° |
| C30 | C29 | H32 | 119.5° | 119.9° |
| C29 | C30 | H33 | 120.9° | 120.0° |
| C26 | C27 | C28 | 120.5° | 119.9° |
| C27 | C26 | C25 | 116.8° | 109.5° |
| C27 | C26 | H29 | 107.6° | 109.5° |
| C27 | C26 | H30 | 107.6° | 109.4° |
| C27 | C28 | C29 | 121.8° | 120.1° |
| C27 | C28 | H31 | 119.1° | 119.9° |
| C12 | C11 | C10 | 116.2° | 109.5° |
| C12 | C11 | H2 | 107.8° | 109.4° |
| C12 | C11 | H3 | 107.7° | 109.5° |
| C26 | C25 | N24 | 112.1° | 109.5° |
| C26 | C25 | C35 | 107.9° | 109.5° |
| C26 | C25 | H28 | 108.3° | 109.5° |
| C25 | C26 | H29 | 107.6° | 109.5° |
| C25 | C26 | H30 | 107.6° | 109.4° |
| N24 | C25 | C35 | 110.4° | 109.5° |
| C25 | N24 | C22 | 122.1° | 120.0° |
| N24 | C25 | H28 | 109.2° | 109.5° |
| C25 | N24 | H44 | 118.9° | 120.0° |
| C25 | C35 | N37 | 120.3° | 120.0° |
| C25 | C35 | O36 | 119.4° | 120.0° |
| C35 | C25 | H28 | 108.8° | 109.4° |
| C03 | C04 | N05 | 114.3° | 109.5° |
| C04 | C03 | H9 | 108.7° | 109.5° |
| C04 | C03 | H10 | 108.6° | 109.5° |
| C03 | C04 | H11 | 108.2° | 109.5° |
| C03 | C04 | H12 | 108.3° | 109.5° |
| C29 | C28 | H31 | 119.1° | 120.0° |
| C28 | C29 | H32 | 119.5° | 120.0° |
| N37 | C35 | O36 | 120.3° | 119.9° |
| C35 | N37 | H45 | 119.0° | 120.0° |
| O23 | C22 | N24 | 119.2° | 120.0° |
| O23 | C22 | C10 | 119.2° | 120.0° |
| N24 | C22 | C10 | 121.6° | 120.0° |
| C22 | N24 | H44 | 119.0° | 120.0° |
| C11 | C10 | C22 | 108.4° | 109.5° |
| C11 | C10 | N09 | 111.5° | 109.5° |
| C11 | C10 | H1 | 106.8° | 109.5° |
| C10 | C11 | H2 | 107.7° | 109.5° |
| C10 | C11 | H3 | 107.8° | 109.5° |
| C22 | C10 | N09 | 115.0° | 109.4° |
| C22 | C10 | H1 | 106.9° | 109.4° |
| C04 | N05 | C06 | 115.5° | 111.0° |
| N05 | C04 | H11 | 108.2° | 109.5° |
| N05 | C04 | H12 | 108.2° | 109.5° |
| C04 | N05 | H41 | 108.0° | 111.0° |
| C10 | N09 | C07 | 123.5° | 120.0° |
| N09 | C10 | H1 | 107.8° | 109.4° |
| C10 | N09 | H43 | 118.2° | 120.0° |
| N09 | C07 | C06 | 120.4° | 120.0° |
| N09 | C07 | O08 | 118.0° | 120.0° |
| C07 | N09 | H43 | 118.3° | 120.0° |
| N05 | C06 | C07 | 110.3° | 109.5° |
| N05 | C06 | H13 | 109.3° | 109.5° |
| N05 | C06 | H14 | 109.3° | 109.5° |
| C06 | N05 | H41 | 107.9° | 111.0° |
| C06 | C07 | O08 | 121.6° | 119.9° |
| C07 | C06 | H13 | 109.3° | 109.5° |
| C07 | C06 | H14 | 109.3° | 109.5° |
| H2 | C11 | H3 | 109.5° | 109.5° |
| H4 | C01 | H5 | 109.4° | 109.5° |
| H4 | C01 | H6 | 109.5° | 109.4° |
| H5 | C01 | H6 | 109.4° | 109.5° |
| H7 | C02 | H8 | 109.4° | 109.6° |
| H9 | C03 | H10 | 109.5° | 109.5° |
| H11 | C04 | H12 | 109.5° | 109.4° |
| H13 | C06 | H14 | 109.5° | 109.5° |
| H19 | C19 | H20 | 109.4° | 109.5° |
| H19 | C19 | H21 | 109.5° | 109.5° |
| H20 | C19 | H21 | 109.5° | 109.4° |
| H22 | C20 | H23 | 109.5° | 109.5° |
| H22 | C20 | H24 | 109.5° | 109.4° |
| H23 | C20 | H24 | 109.5° | 109.5° |
| H25 | C21 | H26 | 109.5° | 109.5° |
| H25 | C21 | H27 | 109.5° | 109.4° |
| H26 | C21 | H27 | 109.5° | 109.5° |
| H29 | C26 | H30 | 109.5° | 109.4° |
| H34 | C33 | H35 | 109.4° | 109.4° |
| H34 | C33 | H36 | 109.5° | 109.5° |
| H35 | C33 | H36 | 109.5° | 109.4° |
| H38 | C38 | H39 | 109.5° | 109.5° |
| H38 | C38 | H40 | 109.4° | 109.5° |
| H39 | C38 | H40 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C18 | C19 | C21 | 109.1° | 119.9° |
| C20 | C18 | C19 | C15 | 145.7° | 120.0° |
| C20 | C18 | C21 | C15 | 145.4° | 120.0° |
| C20 | C18 | C15 | C16 | 7.2° | 180.0° |
| C20 | C18 | C15 | C14 | 172.9° | 0.3° |
| C20 | C18 | C19 | H19 | 180.0° | 60.0° |
| C20 | C18 | C19 | H20 | 60.0° | 60.0° |
| C20 | C18 | C19 | H21 | 60.0° | 180.0° |
| C18 | C20 | H22 | H23 | 120.0° | 120.0° |
| C18 | C20 | H22 | H24 | 120.0° | 119.9° |
| C18 | C20 | H23 | H24 | 120.0° | 120.0° |
| C20 | C18 | C21 | H25 | 180.0° | 180.0° |
| C20 | C18 | C21 | H26 | 60.0° | 60.0° |
| C20 | C18 | C21 | H27 | 60.0° | 60.1° |
| C19 | C18 | C21 | C15 | 105.5° | 120.1° |
| C19 | C18 | C15 | C16 | 92.2° | 60.0° |
| C19 | C18 | C15 | C14 | 87.7° | 119.7° |
| C18 | C19 | H19 | H20 | 120.0° | 120.0° |
| C18 | C19 | H19 | H21 | 120.0° | 120.0° |
| C18 | C19 | H20 | H21 | 120.0° | 120.0° |
| C19 | C18 | C20 | H22 | 180.0° | 180.0° |
| C19 | C18 | C20 | H23 | 60.0° | 60.0° |
| C19 | C18 | C20 | H24 | 60.0° | 60.0° |
| C19 | C18 | C21 | H25 | 70.9° | 60.1° |
| C19 | C18 | C21 | H26 | 169.1° | 60.0° |
| C19 | C18 | C21 | H27 | 49.1° | 180.0° |
| C21 | C18 | C15 | C16 | 102.8° | 60.0° |
| C21 | C18 | C15 | C14 | 77.3° | 120.2° |
| C21 | C18 | C19 | H19 | 70.9° | 179.9° |
| C21 | C18 | C19 | H20 | 49.1° | 59.9° |
| C21 | C18 | C19 | H21 | 169.1° | 60.0° |
| C21 | C18 | C20 | H22 | 14.7° | 60.1° |
| C21 | C18 | C20 | H23 | 134.7° | 60.0° |
| C21 | C18 | C20 | H24 | 105.3° | 180.0° |
| C18 | C21 | H25 | H26 | 120.0° | 120.0° |
| C18 | C21 | H25 | H27 | 120.0° | 119.9° |
| C18 | C21 | H26 | H27 | 120.0° | 120.1° |
| C18 | C15 | C16 | C14 | 179.9° | 179.8° |
| C18 | C15 | C16 | C17 | 180.0° | 180.0° |
| C18 | C15 | C14 | C13 | 180.0° | 179.7° |
| C18 | C15 | C14 | H16 | 0.0° | 0.2° |
| C18 | C15 | C16 | H17 | 0.1° | 0.2° |
| C15 | C18 | C19 | H19 | 34.3° | 60.0° |
| C15 | C18 | C19 | H20 | 154.3° | 180.0° |
| C15 | C18 | C19 | H21 | 85.7° | 60.0° |
| C15 | C18 | C20 | H22 | 80.4° | 60.0° |
| C15 | C18 | C20 | H23 | 39.6° | 180.0° |
| C15 | C18 | C20 | H24 | 159.6° | 60.0° |
| C15 | C18 | C21 | H25 | 34.6° | 60.0° |
| C15 | C18 | C21 | H26 | 85.4° | 180.0° |
| C15 | C18 | C21 | H27 | 154.6° | 59.9° |
| C33 | O32 | C31 | C34 | 16.4° | 180.0° |
| C33 | O32 | C31 | C30 | 163.8° | 0.5° |
| O32 | C33 | H34 | H35 | 120.0° | 120.1° |
| O32 | C33 | H34 | H36 | 120.0° | 120.1° |
| O32 | C33 | H35 | H36 | 120.0° | 120.0° |
| O32 | C31 | C34 | C30 | 179.8° | 179.5° |
| O32 | C31 | C34 | C27 | 179.8° | 180.0° |
| O32 | C31 | C30 | C29 | 179.9° | 179.7° |
| O32 | C31 | C30 | H33 | 0.1° | 0.3° |
| C31 | O32 | C33 | H34 | 180.0° | 60.0° |
| C31 | O32 | C33 | H35 | 60.0° | 60.0° |
| C31 | O32 | C33 | H36 | 60.0° | 179.9° |
| O32 | C31 | C34 | H37 | 0.2° | 0.4° |
| C15 | C16 | C17 | H17 | 180.0° | 179.8° |
| C16 | C15 | C14 | C13 | 0.0° | 0.1° |
| C15 | C16 | C17 | C12 | 0.1° | 0.6° |
| C16 | C15 | C14 | H16 | 179.9° | 180.0° |
| C15 | C16 | C17 | H18 | 179.9° | 180.0° |
| C14 | C15 | C16 | C17 | 0.0° | 0.2° |
| C15 | C14 | C13 | H16 | 180.0° | 179.9° |
| C15 | C14 | C13 | C12 | 0.1° | 0.1° |
| C15 | C14 | C13 | H15 | 179.9° | 179.9° |
| C14 | C15 | C16 | H17 | 180.0° | 180.0° |
| C16 | C17 | C12 | H18 | 180.0° | 179.4° |
| C16 | C17 | C12 | C13 | 0.2° | 0.5° |
| C16 | C17 | C12 | C11 | 179.8° | 179.7° |
| C14 | C13 | C12 | C17 | 0.2° | 0.2° |
| C14 | C13 | C12 | H15 | 180.0° | 180.0° |
| C14 | C13 | C12 | C11 | 179.8° | 180.0° |
| C01 | C02 | C03 | H7 | 120.8° | 120.0° |
| C01 | C02 | C03 | H8 | 120.8° | 120.0° |
| C01 | C02 | C03 | C04 | 165.6° | 180.0° |
| C02 | C01 | H4 | H5 | 120.0° | 120.0° |
| C02 | C01 | H4 | H6 | 120.0° | 120.0° |
| C02 | C01 | H5 | H6 | 120.0° | 120.0° |
| C01 | C02 | H7 | H8 | 117.6° | 120.0° |
| C01 | C02 | C03 | H9 | 73.9° | 60.0° |
| C01 | C02 | C03 | H10 | 45.2° | 60.0° |
| C31 | C34 | C27 | H37 | 180.0° | 179.6° |
| C34 | C31 | C30 | C29 | 0.1° | 0.2° |
| C31 | C34 | C27 | C26 | 179.8° | 179.7° |
| C31 | C34 | C27 | C28 | 0.1° | 0.5° |
| C34 | C31 | C30 | H33 | 179.9° | 179.8° |
| C30 | C31 | C34 | C27 | 0.0° | 0.5° |
| C31 | C30 | C29 | H33 | 180.0° | 179.9° |
| C31 | C30 | C29 | C28 | 0.1° | 0.0° |
| C31 | C30 | C29 | H32 | 179.9° | 179.9° |
| C30 | C31 | C34 | H37 | 180.0° | 179.9° |
| C34 | C27 | C26 | C28 | 179.7° | 179.8° |
| C34 | C27 | C26 | C25 | 97.4° | 90.2° |
| C34 | C27 | C28 | C29 | 0.1° | 0.2° |
| C34 | C27 | C26 | H29 | 23.7° | 149.7° |
| C34 | C27 | C26 | H30 | 141.5° | 29.7° |
| C34 | C27 | C28 | H31 | 179.9° | 179.8° |
| C17 | C12 | C13 | C11 | 179.6° | 179.8° |
| C17 | C12 | C11 | C10 | 113.3° | 90.3° |
| C17 | C12 | C11 | H2 | 7.7° | 149.7° |
| C17 | C12 | C11 | H3 | 125.8° | 29.8° |
| C17 | C12 | C13 | H15 | 179.8° | 179.8° |
| C12 | C17 | C16 | H17 | 179.9° | 179.7° |
| C02 | C03 | C04 | H9 | 120.5° | 120.0° |
| C02 | C03 | C04 | H10 | 120.5° | 119.9° |
| C02 | C03 | C04 | N05 | 160.1° | 180.0° |
| C03 | C02 | C01 | H4 | 180.0° | 60.0° |
| C03 | C02 | C01 | H5 | 60.0° | 180.0° |
| C03 | C02 | C01 | H6 | 60.0° | 60.0° |
| C03 | C02 | H7 | H8 | 117.7° | 120.0° |
| C02 | C03 | H9 | H10 | 118.5° | 120.0° |
| C02 | C03 | C04 | H11 | 79.2° | 60.0° |
| C02 | C03 | C04 | H12 | 39.4° | 60.0° |
| C13 | C12 | C11 | C10 | 66.3° | 89.9° |
| C13 | C12 | C11 | H2 | 172.7° | 30.1° |
| C13 | C12 | C11 | H3 | 54.7° | 150.0° |
| C12 | C13 | C14 | H16 | 179.9° | 180.0° |
| C13 | C12 | C17 | H18 | 179.8° | 180.0° |
| C38 | N37 | C35 | C25 | 0.1° | 180.0° |
| C38 | N37 | C35 | H45 | 180.0° | 180.0° |
| C38 | N37 | C35 | O36 | 180.0° | 0.0° |
| N37 | C38 | H38 | H39 | 120.0° | 120.0° |
| N37 | C38 | H38 | H40 | 120.0° | 120.0° |
| N37 | C38 | H39 | H40 | 120.0° | 120.0° |
| C30 | C29 | C28 | C27 | 0.0° | 0.0° |
| C30 | C29 | C28 | H32 | 180.0° | 179.9° |
| C30 | C29 | C28 | H31 | 180.0° | 180.0° |
| C27 | C26 | C25 | H29 | 121.1° | 120.1° |
| C27 | C26 | C25 | H30 | 121.1° | 120.0° |
| C27 | C26 | C25 | N24 | 28.3° | 65.1° |
| C27 | C26 | C25 | C35 | 150.0° | 174.9° |
| C26 | C27 | C28 | C29 | 179.8° | 180.0° |
| C27 | C26 | C25 | H28 | 92.3° | 54.9° |
| C27 | C26 | H29 | H30 | 116.6° | 120.0° |
| C26 | C27 | C28 | H31 | 0.2° | 0.0° |
| C26 | C27 | C34 | H37 | 0.3° | 0.2° |
| C28 | C27 | C26 | C25 | 82.3° | 90.0° |
| C27 | C28 | C29 | H31 | 180.0° | 180.0° |
| C28 | C27 | C26 | H29 | 156.7° | 30.0° |
| C28 | C27 | C26 | H30 | 38.8° | 150.0° |
| C27 | C28 | C29 | H32 | 180.0° | 179.9° |
| C28 | C27 | C34 | H37 | 179.9° | 179.9° |
| C12 | C11 | C10 | H2 | 121.0° | 119.9° |
| C12 | C11 | C10 | H3 | 121.0° | 120.0° |
| C12 | C11 | C10 | C22 | 51.1° | 175.0° |
| C12 | C11 | C10 | N09 | 76.5° | 65.0° |
| C12 | C11 | C10 | H1 | 165.9° | 55.0° |
| C12 | C11 | H2 | H3 | 116.9° | 120.0° |
| C11 | C12 | C13 | H15 | 0.2° | 0.0° |
| C11 | C12 | C17 | H18 | 0.2° | 0.2° |
| C26 | C25 | N24 | C35 | 120.3° | 120.0° |
| C26 | C25 | N24 | H28 | 120.0° | 120.0° |
| C26 | C25 | C35 | H28 | 117.3° | 120.0° |
| C26 | C25 | C35 | N37 | 96.3° | 60.0° |
| C26 | C25 | N24 | C22 | 170.6° | 155.0° |
| C26 | C25 | C35 | O36 | 83.9° | 120.0° |
| C25 | C26 | H29 | H30 | 116.7° | 120.0° |
| C26 | C25 | N24 | H44 | 9.4° | 25.0° |
| N24 | C25 | C35 | H28 | 119.8° | 119.9° |
| N24 | C25 | C35 | N37 | 140.9° | 180.0° |
| C25 | N24 | C22 | O23 | 0.2° | 0.0° |
| C25 | N24 | C22 | H44 | 180.0° | 179.9° |
| N24 | C25 | C35 | O36 | 39.0° | 0.0° |
| C25 | N24 | C22 | C10 | 179.6° | 180.0° |
| N24 | C25 | C26 | H29 | 149.3° | 55.0° |
| N24 | C25 | C26 | H30 | 92.8° | 175.0° |
| C25 | C35 | N37 | O36 | 179.8° | 180.0° |
| C35 | C25 | N24 | C22 | 69.1° | 85.0° |
| C35 | C25 | C26 | H29 | 88.9° | 65.0° |
| C35 | C25 | C26 | H30 | 29.0° | 55.0° |
| C35 | C25 | N24 | H44 | 110.9° | 95.1° |
| C25 | C35 | N37 | H45 | 179.9° | 0.0° |
| C03 | C04 | N05 | H11 | 120.7° | 120.0° |
| C03 | C04 | N05 | H12 | 120.7° | 120.0° |
| C03 | C04 | N05 | C06 | 156.5° | 180.0° |
| C04 | C03 | C02 | H7 | 44.9° | 60.0° |
| C04 | C03 | C02 | H8 | 73.6° | 60.0° |
| C04 | C03 | H9 | H10 | 118.5° | 120.0° |
| C03 | C04 | H11 | H12 | 117.8° | 120.0° |
| C03 | C04 | N05 | H41 | 35.6° | 56.0° |
| C28 | C29 | C30 | H33 | 179.9° | 179.9° |
| N37 | C35 | C25 | H28 | 21.0° | 60.1° |
| C35 | N37 | C38 | H38 | 180.0° | 60.0° |
| C35 | N37 | C38 | H39 | 60.0° | 60.0° |
| C35 | N37 | C38 | H40 | 60.0° | 180.0° |
| O23 | C22 | N24 | C10 | 179.4° | 180.0° |
| O23 | C22 | C10 | C11 | 126.7° | 120.0° |
| O23 | C22 | C10 | N09 | 1.0° | 0.0° |
| O23 | C22 | C10 | H1 | 118.6° | 120.0° |
| O23 | C22 | N24 | H44 | 179.8° | 180.0° |
| N24 | C22 | C10 | C11 | 52.7° | 60.0° |
| N24 | C22 | C10 | N09 | 178.3° | 180.0° |
| N24 | C22 | C10 | H1 | 62.0° | 60.0° |
| C22 | N24 | C25 | H28 | 50.6° | 34.9° |
| O36 | C35 | C25 | H28 | 158.8° | 120.0° |
| O36 | C35 | N37 | H45 | 0.0° | 180.0° |
| C11 | C10 | C22 | N09 | 125.6° | 120.0° |
| C11 | C10 | C22 | H1 | 114.8° | 120.0° |
| C11 | C10 | N09 | H1 | 116.9° | 120.0° |
| C11 | C10 | N09 | C07 | 94.8° | 85.0° |
| C10 | C11 | H2 | H3 | 117.0° | 120.0° |
| C11 | C10 | N09 | H43 | 85.1° | 95.0° |
| C22 | C10 | N09 | H1 | 119.1° | 119.9° |
| C22 | C10 | N09 | C07 | 141.2° | 155.0° |
| C22 | C10 | C11 | H2 | 69.9° | 55.0° |
| C22 | C10 | C11 | H3 | 172.1° | 65.0° |
| C22 | C10 | N09 | H43 | 38.9° | 25.0° |
| C10 | C22 | N24 | H44 | 0.4° | 0.0° |
| C04 | N05 | C06 | H41 | 120.9° | 124.0° |
| C04 | N05 | C06 | C07 | 108.2° | 180.0° |
| N05 | C04 | C03 | H9 | 39.6° | 60.0° |
| N05 | C04 | C03 | H10 | 79.4° | 60.1° |
| N05 | C04 | H11 | H12 | 117.8° | 120.0° |
| C04 | N05 | C06 | H13 | 131.7° | 60.0° |
| C04 | N05 | C06 | H14 | 11.9° | 60.0° |
| C10 | N09 | C07 | H43 | 180.0° | 179.9° |
| C10 | N09 | C07 | C06 | 179.6° | 180.0° |
| C10 | N09 | C07 | O08 | 0.4° | 0.1° |
| N09 | C10 | C11 | H2 | 162.5° | 175.0° |
| N09 | C10 | C11 | H3 | 44.4° | 55.0° |
| N09 | C07 | C06 | N05 | 80.8° | 180.0° |
| N09 | C07 | C06 | O08 | 180.0° | 180.0° |
| C07 | N09 | C10 | H1 | 22.1° | 35.1° |
| N09 | C07 | C06 | H13 | 159.1° | 60.0° |
| N09 | C07 | C06 | H14 | 39.3° | 60.0° |
| N05 | C06 | C07 | H13 | 120.1° | 120.0° |
| N05 | C06 | C07 | H14 | 120.1° | 120.0° |
| N05 | C06 | C07 | O08 | 99.2° | 0.0° |
| C06 | N05 | C04 | H11 | 82.8° | 60.0° |
| C06 | N05 | C04 | H12 | 35.8° | 60.0° |
| N05 | C06 | H13 | H14 | 119.6° | 120.0° |
| C07 | C06 | H13 | H14 | 119.7° | 120.0° |
| C07 | C06 | N05 | H41 | 12.7° | 56.0° |
| C06 | C07 | N09 | H43 | 0.4° | 0.0° |
| O08 | C07 | C06 | H13 | 20.9° | 120.0° |
| O08 | C07 | C06 | H14 | 140.7° | 120.0° |
| O08 | C07 | N09 | H43 | 179.7° | 180.0° |
| H1 | C10 | C11 | H2 | 44.9° | 65.0° |
| H1 | C10 | C11 | H3 | 73.1° | 175.0° |
| H1 | C10 | N09 | H43 | 157.9° | 145.0° |
| H4 | C01 | H5 | H6 | 120.0° | 120.0° |
| H4 | C01 | C02 | H7 | 59.2° | 179.9° |
| H4 | C01 | C02 | H8 | 59.2° | 59.9° |
| H5 | C01 | C02 | H7 | 60.8° | 60.0° |
| H5 | C01 | C02 | H8 | 179.2° | 60.1° |
| H6 | C01 | C02 | H7 | 179.2° | 60.0° |
| H6 | C01 | C02 | H8 | 60.8° | 179.9° |
| H7 | C02 | C03 | H9 | 165.4° | 180.0° |
| H7 | C02 | C03 | H10 | 75.6° | 59.9° |
| H8 | C02 | C03 | H9 | 46.9° | 60.0° |
| H8 | C02 | C03 | H10 | 166.0° | 180.0° |
| H9 | C03 | C04 | H11 | 160.3° | 180.0° |
| H9 | C03 | C04 | H12 | 81.0° | 60.0° |
| H10 | C03 | C04 | H11 | 41.3° | 59.9° |
| H10 | C03 | C04 | H12 | 159.9° | 179.9° |
| H11 | C04 | N05 | H41 | 156.3° | 176.0° |
| H12 | C04 | N05 | H41 | 85.1° | 64.0° |
| H13 | C06 | N05 | H41 | 107.4° | 64.0° |
| H14 | C06 | N05 | H41 | 132.8° | 176.0° |
| H15 | C13 | C14 | H16 | 0.1° | 0.0° |
| H17 | C16 | C17 | H18 | 0.1° | 0.3° |
| H19 | C19 | H20 | H21 | 120.0° | 120.0° |
| H22 | C20 | H23 | H24 | 120.0° | 120.0° |
| H25 | C21 | H26 | H27 | 120.0° | 119.9° |
| H28 | C25 | C26 | H29 | 28.8° | 175.0° |
| H28 | C25 | C26 | H30 | 146.6° | 65.0° |
| H28 | C25 | N24 | H44 | 129.4° | 145.0° |
| H31 | C28 | C29 | H32 | 0.0° | 0.1° |
| H32 | C29 | C30 | H33 | 0.1° | 0.0° |
| H34 | C33 | H35 | H36 | 120.0° | 119.9° |
| H38 | C38 | H39 | H40 | 120.0° | 120.0° |
| H38 | C38 | N37 | H45 | 0.0° | 120.0° |
| H39 | C38 | N37 | H45 | 120.0° | 120.0° |
| H40 | C38 | N37 | H45 | 120.0° | 0.0° |
