EOY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C26 | sing | 1.53Å | 1.51Å | |
| C26 | C28 | sing | 1.53Å | 1.51Å | |
| C26 | C25 | sing | 1.53Å | 1.51Å | |
| O24 | C25 | sing | 1.43Å | 1.42Å | |
| O24 | C19 | sing | 1.36Å | 1.38Å | |
| C20 | C19 | doub | 1.39Å | 1.37Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.37Å | Aromatic |
| C36 | C35 | sing | 1.53Å | 1.51Å | |
| C36 | C38 | sing | 1.53Å | 1.51Å | |
| C36 | C37 | sing | 1.53Å | 1.51Å | |
| C35 | C34 | sing | 1.53Å | 1.51Å | |
| C19 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C38 | C32 | sing | 1.53Å | 1.51Å | |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C37 | C30 | sing | 1.53Å | 1.51Å | |
| C34 | C33 | sing | 1.53Å | 1.51Å | |
| C34 | C39 | sing | 1.53Å | 1.51Å | |
| C18 | C17 | doub | 1.39Å | 1.38Å | Aromatic |
| C32 | C33 | sing | 1.53Å | 1.51Å | |
| C32 | C31 | sing | 1.53Å | 1.51Å | |
| C22 | C17 | sing | 1.40Å | 1.39Å | Aromatic |
| C22 | CL3 | sing | 1.74Å | 1.73Å | |
| O13 | C11 | doub | 1.22Å | 1.22Å | |
| C30 | C39 | sing | 1.53Å | 1.51Å | |
| C30 | C31 | sing | 1.53Å | 1.51Å | |
| C30 | N29 | sing | 1.47Å | 1.44Å | |
| C17 | C16 | sing | 1.48Å | 1.46Å | |
| C11 | N29 | sing | 1.35Å | 1.37Å | |
| C11 | C5 | sing | 1.48Å | 1.46Å | |
| C16 | N15 | doub | 1.32Å | 1.32Å | Aromatic |
| C16 | N10 | sing | 1.36Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.39Å | 1.37Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.37Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.38Å | Aromatic |
| N15 | N14 | sing | 1.29Å | 1.37Å | Aromatic |
| N10 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| N10 | C9 | sing | 1.38Å | 1.37Å | Aromatic |
| C3 | C2 | doub | 1.41Å | 1.38Å | Aromatic |
| C6 | C1 | doub | 1.36Å | 1.37Å | Aromatic |
| N14 | C9 | doub | 1.32Å | 1.31Å | Aromatic |
| C9 | C8 | sing | 1.41Å | 1.43Å | Aromatic |
| C2 | C1 | sing | 1.40Å | 1.38Å | Aromatic |
| C2 | N7 | sing | 1.35Å | 1.40Å | Aromatic |
| C8 | N7 | doub | 1.31Å | 1.29Å | Aromatic |
| C8 | C12 | sing | 1.51Å | 1.50Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C20 | H3 | sing | 1.08Å | 1.08Å | |
| C21 | H4 | sing | 1.08Å | 1.08Å | |
| C26 | H5 | sing | 1.09Å | 1.10Å | |
| C28 | H6 | sing | 1.09Å | 1.10Å | |
| C28 | H7 | sing | 1.09Å | 1.10Å | |
| C28 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.08Å | 1.08Å | |
| C18 | H10 | sing | 1.08Å | 1.08Å | |
| C33 | H11 | sing | 1.09Å | 1.10Å | |
| C33 | H12 | sing | 1.09Å | 1.10Å | |
| C35 | H13 | sing | 1.09Å | 1.10Å | |
| C35 | H14 | sing | 1.09Å | 1.10Å | |
| C38 | H15 | sing | 1.09Å | 1.10Å | |
| C38 | H16 | sing | 1.09Å | 1.10Å | |
| C39 | H17 | sing | 1.09Å | 1.10Å | |
| C39 | H18 | sing | 1.09Å | 1.10Å | |
| C31 | H19 | sing | 1.09Å | 1.10Å | |
| C31 | H20 | sing | 1.09Å | 1.10Å | |
| C37 | H21 | sing | 1.09Å | 1.10Å | |
| C37 | H22 | sing | 1.09Å | 1.10Å | |
| C34 | H23 | sing | 1.09Å | 1.10Å | |
| C32 | H24 | sing | 1.09Å | 1.10Å | |
| C36 | H25 | sing | 1.09Å | 1.10Å | |
| C12 | H26 | sing | 1.09Å | 1.10Å | |
| C12 | H27 | sing | 1.09Å | 1.10Å | |
| C12 | H28 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C25 | H32 | sing | 1.09Å | 1.10Å | |
| C25 | H33 | sing | 1.09Å | 1.10Å | |
| N29 | H34 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | C26 | C28 | 110.3° | 109.4° |
| C27 | C26 | C25 | 107.9° | 109.5° |
| C27 | C26 | H5 | 109.1° | 109.5° |
| C26 | C27 | H29 | 109.5° | 109.5° |
| C26 | C27 | H30 | 109.5° | 109.4° |
| C26 | C27 | H31 | 109.4° | 109.5° |
| C28 | C26 | C25 | 111.3° | 109.5° |
| C28 | C26 | H5 | 109.1° | 109.5° |
| C26 | C28 | H6 | 109.5° | 109.4° |
| C26 | C28 | H7 | 109.5° | 109.5° |
| C26 | C28 | H8 | 109.5° | 109.5° |
| C26 | C25 | O24 | 105.2° | 109.5° |
| C25 | C26 | H5 | 109.1° | 109.5° |
| C26 | C25 | H32 | 110.5° | 109.5° |
| C26 | C25 | H33 | 110.5° | 109.5° |
| C25 | O24 | C19 | 106.3° | 117.0° |
| O24 | C25 | H32 | 110.6° | 109.4° |
| O24 | C25 | H33 | 110.6° | 109.4° |
| O24 | C19 | C20 | 116.7° | 120.1° |
| O24 | C19 | C18 | 122.0° | 120.0° |
| C19 | C20 | C21 | 118.7° | 120.3° |
| C20 | C19 | C18 | 121.3° | 120.0° |
| C19 | C20 | H3 | 120.6° | 119.8° |
| C20 | C21 | C22 | 120.3° | 120.2° |
| C21 | C20 | H3 | 120.6° | 119.8° |
| C20 | C21 | H4 | 119.9° | 119.9° |
| C35 | C36 | C38 | 109.2° | 109.5° |
| C35 | C36 | C37 | 109.3° | 109.5° |
| C36 | C35 | C34 | 110.0° | 109.5° |
| C36 | C35 | H13 | 109.3° | 109.4° |
| C36 | C35 | H14 | 109.4° | 109.5° |
| C35 | C36 | H25 | 109.7° | 109.5° |
| C38 | C36 | C37 | 109.2° | 109.5° |
| C36 | C38 | C32 | 110.0° | 109.5° |
| C36 | C38 | H15 | 109.3° | 109.5° |
| C36 | C38 | H16 | 109.3° | 109.5° |
| C38 | C36 | H25 | 109.7° | 109.5° |
| C36 | C37 | C30 | 110.2° | 109.4° |
| C36 | C37 | H21 | 109.3° | 109.5° |
| C36 | C37 | H22 | 109.3° | 109.5° |
| C37 | C36 | H25 | 109.7° | 109.5° |
| C35 | C34 | C33 | 109.2° | 109.5° |
| C35 | C34 | C39 | 109.1° | 109.5° |
| C34 | C35 | H13 | 109.3° | 109.5° |
| C34 | C35 | H14 | 109.3° | 109.5° |
| C35 | C34 | H23 | 109.8° | 109.5° |
| C19 | C18 | C17 | 120.3° | 119.8° |
| C19 | C18 | H10 | 119.9° | 120.0° |
| C38 | C32 | C33 | 109.2° | 109.5° |
| C38 | C32 | C31 | 109.1° | 109.5° |
| C32 | C38 | H15 | 109.3° | 109.5° |
| C32 | C38 | H16 | 109.3° | 109.5° |
| C38 | C32 | H24 | 109.8° | 109.5° |
| C21 | C22 | C17 | 121.5° | 119.9° |
| C21 | C22 | CL3 | 115.8° | 120.0° |
| C22 | C21 | H4 | 119.9° | 119.9° |
| C37 | C30 | C39 | 109.0° | 109.5° |
| C37 | C30 | C31 | 109.1° | 109.5° |
| C37 | C30 | N29 | 110.6° | 109.4° |
| C30 | C37 | H21 | 109.3° | 109.5° |
| C30 | C37 | H22 | 109.3° | 109.4° |
| C33 | C34 | C39 | 109.2° | 109.5° |
| C34 | C33 | C32 | 109.9° | 109.5° |
| C34 | C33 | H11 | 109.3° | 109.5° |
| C34 | C33 | H12 | 109.4° | 109.5° |
| C33 | C34 | H23 | 109.8° | 109.5° |
| C34 | C39 | C30 | 110.5° | 109.5° |
| C34 | C39 | H17 | 109.2° | 109.5° |
| C34 | C39 | H18 | 109.2° | 109.4° |
| C39 | C34 | H23 | 109.8° | 109.5° |
| C18 | C17 | C22 | 117.9° | 119.8° |
| C18 | C17 | C16 | 120.9° | 120.1° |
| C17 | C18 | H10 | 119.8° | 120.1° |
| C33 | C32 | C31 | 109.2° | 109.5° |
| C32 | C33 | H11 | 109.3° | 109.5° |
| C32 | C33 | H12 | 109.4° | 109.5° |
| C33 | C32 | H24 | 109.8° | 109.5° |
| C32 | C31 | C30 | 110.4° | 109.5° |
| C32 | C31 | H19 | 109.2° | 109.5° |
| C32 | C31 | H20 | 109.2° | 109.5° |
| C31 | C32 | H24 | 109.8° | 109.5° |
| C17 | C22 | CL3 | 122.7° | 120.0° |
| C22 | C17 | C16 | 121.2° | 120.1° |
| O13 | C11 | N29 | 127.8° | 120.0° |
| O13 | C11 | C5 | 122.2° | 120.0° |
| C39 | C30 | C31 | 108.6° | 109.5° |
| C39 | C30 | N29 | 109.6° | 109.5° |
| C30 | C39 | H17 | 109.2° | 109.5° |
| C30 | C39 | H18 | 109.2° | 109.4° |
| C31 | C30 | N29 | 109.9° | 109.5° |
| C30 | C31 | H19 | 109.2° | 109.5° |
| C30 | C31 | H20 | 109.2° | 109.5° |
| C30 | N29 | C11 | 121.5° | 120.0° |
| C30 | N29 | H34 | 119.3° | 120.0° |
| C17 | C16 | N15 | 120.8° | 126.4° |
| C17 | C16 | N10 | 131.4° | 126.4° |
| N29 | C11 | C5 | 109.8° | 120.0° |
| C11 | N29 | H34 | 119.3° | 120.0° |
| C11 | C5 | C4 | 116.9° | 119.9° |
| C11 | C5 | C6 | 120.1° | 119.9° |
| N15 | C16 | N10 | 107.6° | 107.2° |
| C16 | N15 | N14 | 109.1° | 110.0° |
| C16 | N10 | C3 | 135.6° | 134.8° |
| C16 | N10 | C9 | 106.4° | 106.2° |
| C5 | C4 | C3 | 117.8° | 119.7° |
| C4 | C5 | C6 | 123.0° | 120.1° |
| C5 | C4 | H1 | 121.1° | 120.2° |
| C4 | C3 | N10 | 120.8° | 121.0° |
| C4 | C3 | C2 | 121.3° | 119.9° |
| C3 | C4 | H1 | 121.1° | 120.2° |
| C5 | C6 | C1 | 117.5° | 120.5° |
| C5 | C6 | H2 | 121.3° | 119.8° |
| N15 | N14 | C9 | 107.4° | 109.8° |
| C3 | N10 | C9 | 117.9° | 119.1° |
| N10 | C3 | C2 | 118.0° | 119.1° |
| N10 | C9 | N14 | 109.5° | 106.8° |
| N10 | C9 | C8 | 121.4° | 119.4° |
| C3 | C2 | C1 | 119.0° | 119.6° |
| C3 | C2 | N7 | 123.5° | 120.1° |
| C6 | C1 | C2 | 121.4° | 120.2° |
| C1 | C6 | H2 | 121.2° | 119.8° |
| C6 | C1 | H9 | 119.3° | 119.9° |
| N14 | C9 | C8 | 129.1° | 133.8° |
| C9 | C8 | N7 | 121.0° | 120.8° |
| C9 | C8 | C12 | 119.0° | 119.6° |
| C1 | C2 | N7 | 117.4° | 120.3° |
| C2 | C1 | H9 | 119.3° | 119.9° |
| C2 | N7 | C8 | 118.2° | 121.5° |
| N7 | C8 | C12 | 120.0° | 119.6° |
| C8 | C12 | H26 | 109.5° | 109.5° |
| C8 | C12 | H27 | 109.5° | 109.5° |
| C8 | C12 | H28 | 109.5° | 109.4° |
| H6 | C28 | H7 | 109.5° | 109.5° |
| H6 | C28 | H8 | 109.5° | 109.4° |
| H7 | C28 | H8 | 109.5° | 109.5° |
| H11 | C33 | H12 | 109.5° | 109.4° |
| H13 | C35 | H14 | 109.5° | 109.5° |
| H15 | C38 | H16 | 109.5° | 109.4° |
| H17 | C39 | H18 | 109.4° | 109.5° |
| H19 | C31 | H20 | 109.5° | 109.4° |
| H21 | C37 | H22 | 109.5° | 109.5° |
| H26 | C12 | H27 | 109.5° | 109.5° |
| H26 | C12 | H28 | 109.5° | 109.5° |
| H27 | C12 | H28 | 109.4° | 109.5° |
| H29 | C27 | H30 | 109.5° | 109.5° |
| H29 | C27 | H31 | 109.5° | 109.5° |
| H30 | C27 | H31 | 109.5° | 109.4° |
| H32 | C25 | H33 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | C26 | C28 | C25 | 119.7° | 120.0° |
| C27 | C26 | C28 | H5 | 119.8° | 120.0° |
| C27 | C26 | C25 | H5 | 118.4° | 120.0° |
| C27 | C26 | C25 | O24 | 50.6° | 65.0° |
| C27 | C26 | C28 | H6 | 180.0° | 60.0° |
| C27 | C26 | C28 | H7 | 60.0° | 60.0° |
| C27 | C26 | C28 | H8 | 60.0° | 180.0° |
| C26 | C27 | H29 | H30 | 120.0° | 120.0° |
| C26 | C27 | H29 | H31 | 120.0° | 120.1° |
| C26 | C27 | H30 | H31 | 120.0° | 120.0° |
| C27 | C26 | C25 | H32 | 169.9° | 55.0° |
| C27 | C26 | C25 | H33 | 68.7° | 175.0° |
| C28 | C26 | C25 | H5 | 120.4° | 120.0° |
| C28 | C26 | C25 | O24 | 171.8° | 175.0° |
| C26 | C28 | H6 | H7 | 120.0° | 120.0° |
| C26 | C28 | H6 | H8 | 120.0° | 120.0° |
| C26 | C28 | H7 | H8 | 120.0° | 120.0° |
| C28 | C26 | C27 | H29 | 180.0° | 60.0° |
| C28 | C26 | C27 | H30 | 60.0° | 180.0° |
| C28 | C26 | C27 | H31 | 60.0° | 60.0° |
| C28 | C26 | C25 | H32 | 68.9° | 65.0° |
| C28 | C26 | C25 | H33 | 52.4° | 55.0° |
| C26 | C25 | O24 | H32 | 119.3° | 120.0° |
| C26 | C25 | O24 | H33 | 119.3° | 120.0° |
| C26 | C25 | O24 | C19 | 173.6° | 180.0° |
| C25 | C26 | C28 | H6 | 60.3° | 60.0° |
| C25 | C26 | C28 | H7 | 179.7° | 180.0° |
| C25 | C26 | C28 | H8 | 59.7° | 60.0° |
| C25 | C26 | C27 | H29 | 58.2° | 59.9° |
| C25 | C26 | C27 | H30 | 61.8° | 60.0° |
| C25 | C26 | C27 | H31 | 178.2° | 180.0° |
| C26 | C25 | H32 | H33 | 122.0° | 120.0° |
| C25 | O24 | C19 | C20 | 137.0° | 0.0° |
| C25 | O24 | C19 | C18 | 44.3° | 179.7° |
| O24 | C25 | C26 | H5 | 67.8° | 55.0° |
| O24 | C25 | H32 | H33 | 122.0° | 120.0° |
| O24 | C19 | C20 | C18 | 178.7° | 179.7° |
| O24 | C19 | C20 | C21 | 179.5° | 180.0° |
| O24 | C19 | C18 | C17 | 179.5° | 179.7° |
| O24 | C19 | C20 | H3 | 0.5° | 0.3° |
| O24 | C19 | C18 | H10 | 0.5° | 0.3° |
| C19 | O24 | C25 | H32 | 67.1° | 60.0° |
| C19 | O24 | C25 | H33 | 54.3° | 60.0° |
| C19 | C20 | C21 | H3 | 180.0° | 179.7° |
| C19 | C20 | C21 | C22 | 0.7° | 0.3° |
| C20 | C19 | C18 | C17 | 0.9° | 0.0° |
| C19 | C20 | C21 | H4 | 179.3° | 179.9° |
| C20 | C19 | C18 | H10 | 179.1° | 180.0° |
| C21 | C20 | C19 | C18 | 0.8° | 0.3° |
| C20 | C21 | C22 | H4 | 180.0° | 179.8° |
| C20 | C21 | C22 | C17 | 0.7° | 0.0° |
| C20 | C21 | C22 | CL3 | 179.9° | 180.0° |
| C35 | C36 | C38 | C37 | 119.4° | 120.0° |
| C35 | C36 | C38 | H25 | 120.3° | 120.0° |
| C35 | C36 | C37 | H25 | 120.3° | 120.0° |
| C36 | C35 | C34 | H13 | 120.1° | 120.0° |
| C36 | C35 | C34 | H14 | 120.1° | 120.0° |
| C35 | C36 | C38 | C32 | 59.6° | 60.0° |
| C35 | C36 | C37 | C30 | 59.7° | 60.0° |
| C36 | C35 | C34 | C33 | 59.8° | 60.0° |
| C36 | C35 | C34 | C39 | 59.5° | 60.0° |
| C36 | C35 | H13 | H14 | 119.8° | 120.0° |
| C35 | C36 | C38 | H15 | 179.7° | 60.0° |
| C35 | C36 | C38 | H16 | 60.4° | 180.0° |
| C35 | C36 | C37 | H21 | 60.4° | 60.0° |
| C35 | C36 | C37 | H22 | 179.8° | 180.0° |
| C36 | C35 | C34 | H23 | 179.8° | 180.0° |
| C38 | C36 | C37 | H25 | 120.3° | 120.0° |
| C38 | C36 | C35 | C34 | 59.7° | 60.0° |
| C36 | C38 | C32 | H15 | 120.1° | 120.0° |
| C36 | C38 | C32 | H16 | 120.1° | 120.0° |
| C38 | C36 | C37 | C30 | 59.6° | 60.0° |
| C36 | C38 | C32 | C33 | 59.7° | 60.0° |
| C36 | C38 | C32 | C31 | 59.6° | 60.0° |
| C38 | C36 | C35 | H13 | 60.4° | 180.0° |
| C38 | C36 | C35 | H14 | 179.7° | 60.0° |
| C36 | C38 | H15 | H16 | 119.8° | 120.0° |
| C38 | C36 | C37 | H21 | 179.7° | 180.0° |
| C38 | C36 | C37 | H22 | 60.4° | 60.0° |
| C36 | C38 | C32 | H24 | 179.9° | 180.0° |
| C37 | C36 | C35 | C34 | 59.7° | 60.0° |
| C37 | C36 | C38 | C32 | 59.8° | 60.0° |
| C36 | C37 | C30 | H21 | 120.1° | 120.0° |
| C36 | C37 | C30 | H22 | 120.1° | 119.9° |
| C36 | C37 | C30 | C39 | 59.3° | 60.0° |
| C36 | C37 | C30 | C31 | 59.2° | 60.0° |
| C36 | C37 | C30 | N29 | 179.8° | 180.0° |
| C37 | C36 | C35 | H13 | 179.8° | 60.0° |
| C37 | C36 | C35 | H14 | 60.4° | 180.0° |
| C37 | C36 | C38 | H15 | 60.3° | 180.0° |
| C37 | C36 | C38 | H16 | 179.8° | 60.0° |
| C36 | C37 | H21 | H22 | 119.7° | 120.0° |
| C35 | C34 | C33 | C39 | 119.2° | 120.0° |
| C35 | C34 | C33 | H23 | 120.4° | 120.0° |
| C35 | C34 | C39 | H23 | 120.3° | 120.0° |
| C35 | C34 | C33 | C32 | 59.7° | 60.0° |
| C35 | C34 | C39 | C30 | 59.5° | 60.0° |
| C35 | C34 | C33 | H11 | 60.3° | 60.0° |
| C35 | C34 | C33 | H12 | 179.8° | 180.0° |
| C34 | C35 | H13 | H14 | 119.7° | 120.0° |
| C35 | C34 | C39 | H17 | 179.7° | 180.0° |
| C35 | C34 | C39 | H18 | 60.7° | 60.0° |
| C34 | C35 | C36 | H25 | 179.9° | 180.0° |
| C19 | C18 | C17 | H10 | 180.0° | 179.9° |
| C19 | C18 | C17 | C22 | 0.9° | 0.2° |
| C19 | C18 | C17 | C16 | 178.3° | 180.0° |
| C18 | C19 | C20 | H3 | 179.2° | 180.0° |
| C38 | C32 | C33 | C34 | 59.7° | 60.0° |
| C38 | C32 | C33 | C31 | 119.2° | 120.0° |
| C38 | C32 | C33 | H24 | 120.4° | 120.0° |
| C38 | C32 | C31 | H24 | 120.3° | 120.0° |
| C38 | C32 | C31 | C30 | 59.5° | 60.0° |
| C38 | C32 | C33 | H11 | 60.3° | 60.0° |
| C38 | C32 | C33 | H12 | 179.8° | 180.0° |
| C32 | C38 | H15 | H16 | 119.7° | 120.0° |
| C38 | C32 | C31 | H19 | 60.7° | 60.1° |
| C38 | C32 | C31 | H20 | 179.6° | 180.0° |
| C32 | C38 | C36 | H25 | 179.9° | 180.0° |
| C21 | C22 | C17 | C18 | 0.8° | 0.2° |
| C21 | C22 | C17 | CL3 | 179.3° | 180.0° |
| C21 | C22 | C17 | C16 | 178.2° | 180.0° |
| C22 | C21 | C20 | H3 | 179.3° | 180.0° |
| C37 | C30 | C39 | C34 | 59.3° | 60.0° |
| C37 | C30 | C31 | C32 | 59.3° | 60.0° |
| C37 | C30 | C39 | C31 | 118.8° | 120.0° |
| C37 | C30 | C39 | N29 | 121.1° | 120.0° |
| C37 | C30 | C31 | N29 | 121.4° | 119.9° |
| C37 | C30 | N29 | C11 | 28.4° | 180.0° |
| C37 | C30 | C39 | H17 | 179.5° | 180.0° |
| C37 | C30 | C39 | H18 | 60.8° | 59.9° |
| C37 | C30 | C31 | H19 | 60.9° | 60.0° |
| C37 | C30 | C31 | H20 | 179.4° | 180.0° |
| C30 | C37 | H21 | H22 | 119.7° | 120.0° |
| C30 | C37 | C36 | H25 | 180.0° | 180.0° |
| C37 | C30 | N29 | H34 | 151.6° | 0.0° |
| C33 | C34 | C39 | H23 | 120.4° | 120.0° |
| C34 | C33 | C32 | H11 | 120.0° | 120.0° |
| C34 | C33 | C32 | H12 | 120.1° | 120.0° |
| C34 | C33 | C32 | C31 | 59.5° | 60.0° |
| C33 | C34 | C39 | C30 | 59.8° | 60.0° |
| C34 | C33 | H11 | H12 | 119.8° | 120.0° |
| C33 | C34 | C35 | H13 | 60.3° | 180.0° |
| C33 | C34 | C35 | H14 | 179.9° | 60.0° |
| C33 | C34 | C39 | H17 | 60.4° | 60.0° |
| C33 | C34 | C39 | H18 | 180.0° | 180.0° |
| C34 | C33 | C32 | H24 | 179.9° | 180.0° |
| C39 | C34 | C33 | C32 | 59.4° | 60.0° |
| C34 | C39 | C30 | H17 | 120.1° | 120.0° |
| C34 | C39 | C30 | H18 | 120.2° | 119.9° |
| C34 | C39 | C30 | C31 | 59.5° | 60.0° |
| C34 | C39 | C30 | N29 | 179.5° | 180.0° |
| C39 | C34 | C33 | H11 | 179.5° | 180.0° |
| C39 | C34 | C33 | H12 | 60.6° | 60.0° |
| C39 | C34 | C35 | H13 | 179.6° | 60.0° |
| C39 | C34 | C35 | H14 | 60.6° | 180.0° |
| C34 | C39 | H17 | H18 | 119.5° | 120.0° |
| C18 | C17 | C22 | C16 | 177.4° | 179.8° |
| C18 | C17 | C22 | CL3 | 179.9° | 179.8° |
| C18 | C17 | C16 | N15 | 66.5° | 89.8° |
| C18 | C17 | C16 | N10 | 119.9° | 90.2° |
| C33 | C32 | C31 | H24 | 120.4° | 120.0° |
| C33 | C32 | C31 | C30 | 59.8° | 60.0° |
| C32 | C33 | H11 | H12 | 119.8° | 120.0° |
| C33 | C32 | C38 | H15 | 179.8° | 60.0° |
| C33 | C32 | C38 | H16 | 60.4° | 180.0° |
| C33 | C32 | C31 | H19 | 180.0° | 180.0° |
| C33 | C32 | C31 | H20 | 60.3° | 60.0° |
| C32 | C33 | C34 | H23 | 179.9° | 180.0° |
| C32 | C31 | C30 | C39 | 59.4° | 60.0° |
| C32 | C31 | C30 | H19 | 120.2° | 120.0° |
| C32 | C31 | C30 | H20 | 120.1° | 120.0° |
| C32 | C31 | C30 | N29 | 179.3° | 180.0° |
| C31 | C32 | C33 | H11 | 179.5° | 180.0° |
| C31 | C32 | C33 | H12 | 60.6° | 60.0° |
| C31 | C32 | C38 | H15 | 60.5° | 180.0° |
| C31 | C32 | C38 | H16 | 179.7° | 60.0° |
| C32 | C31 | H19 | H20 | 119.6° | 120.0° |
| C22 | C17 | C16 | N15 | 110.8° | 89.9° |
| C22 | C17 | C16 | N10 | 62.8° | 90.0° |
| C17 | C22 | C21 | H4 | 179.3° | 179.8° |
| C22 | C17 | C18 | H10 | 179.1° | 179.7° |
| CL3 | C22 | C17 | C16 | 2.4° | 0.0° |
| CL3 | C22 | C21 | H4 | 0.1° | 0.2° |
| O13 | C11 | N29 | C30 | 4.4° | 0.0° |
| O13 | C11 | N29 | C5 | 174.7° | 180.0° |
| O13 | C11 | C5 | C4 | 33.6° | 0.1° |
| O13 | C11 | C5 | C6 | 147.6° | 180.0° |
| O13 | C11 | N29 | H34 | 175.6° | 180.0° |
| C39 | C30 | C31 | N29 | 119.9° | 120.1° |
| C39 | C30 | N29 | C11 | 148.5° | 60.0° |
| C30 | C39 | H17 | H18 | 119.5° | 120.0° |
| C39 | C30 | C31 | H19 | 179.6° | 180.0° |
| C39 | C30 | C31 | H20 | 60.7° | 60.0° |
| C39 | C30 | C37 | H21 | 60.8° | 60.0° |
| C39 | C30 | C37 | H22 | 179.4° | 180.0° |
| C30 | C39 | C34 | H23 | 179.8° | 180.0° |
| C39 | C30 | N29 | H34 | 31.5° | 120.0° |
| C31 | C30 | N29 | C11 | 92.2° | 60.1° |
| C31 | C30 | C39 | H17 | 60.7° | 60.0° |
| C31 | C30 | C39 | H18 | 179.6° | 180.0° |
| C30 | C31 | H19 | H20 | 119.5° | 120.0° |
| C31 | C30 | C37 | H21 | 179.3° | 180.0° |
| C31 | C30 | C37 | H22 | 60.9° | 59.9° |
| C30 | C31 | C32 | H24 | 179.8° | 180.0° |
| C31 | C30 | N29 | H34 | 87.9° | 120.0° |
| C30 | N29 | C11 | H34 | 180.0° | 179.9° |
| C30 | N29 | C11 | C5 | 179.1° | 180.0° |
| N29 | C30 | C39 | H17 | 59.4° | 60.0° |
| N29 | C30 | C39 | H18 | 60.3° | 60.0° |
| N29 | C30 | C31 | H19 | 60.5° | 59.9° |
| N29 | C30 | C31 | H20 | 59.2° | 60.0° |
| N29 | C30 | C37 | H21 | 59.7° | 60.0° |
| N29 | C30 | C37 | H22 | 60.1° | 60.0° |
| C17 | C16 | N15 | N10 | 175.0° | 180.0° |
| C17 | C16 | N15 | N14 | 174.6° | 180.0° |
| C17 | C16 | N10 | C3 | 7.0° | 0.0° |
| C17 | C16 | N10 | C9 | 172.9° | 180.0° |
| C16 | C17 | C18 | H10 | 1.7° | 0.1° |
| N29 | C11 | C5 | C4 | 141.4° | 180.0° |
| N29 | C11 | C5 | C6 | 37.3° | 0.0° |
| C11 | C5 | C4 | C6 | 178.7° | 180.0° |
| C11 | C5 | C4 | C3 | 179.4° | 180.0° |
| C11 | C5 | C6 | C1 | 179.0° | 180.0° |
| C11 | C5 | C4 | H1 | 0.6° | 0.2° |
| C11 | C5 | C6 | H2 | 1.0° | 0.0° |
| C5 | C11 | N29 | H34 | 0.9° | 0.0° |
| N15 | C16 | N10 | C3 | 178.7° | 180.0° |
| N15 | C16 | N10 | C9 | 1.3° | 0.0° |
| C16 | N15 | N14 | C9 | 0.8° | 0.1° |
| C16 | N10 | C3 | C4 | 1.6° | 0.0° |
| N10 | C16 | N15 | N14 | 0.3° | 0.0° |
| C16 | N10 | C3 | C9 | 180.0° | 180.0° |
| C16 | N10 | C3 | C2 | 179.0° | 180.0° |
| C16 | N10 | C9 | N14 | 1.8° | 0.1° |
| C16 | N10 | C9 | C8 | 178.8° | 179.9° |
| C5 | C4 | C3 | H1 | 180.0° | 179.7° |
| C5 | C4 | C3 | N10 | 179.7° | 180.0° |
| C5 | C4 | C3 | C2 | 0.9° | 0.0° |
| C4 | C5 | C6 | C1 | 0.3° | 0.0° |
| C4 | C5 | C6 | H2 | 179.7° | 180.0° |
| C3 | C4 | C5 | C6 | 0.7° | 0.0° |
| C4 | C3 | N10 | C2 | 179.4° | 180.0° |
| C4 | C3 | N10 | C9 | 178.4° | 180.0° |
| C4 | C3 | C2 | C1 | 0.7° | 0.0° |
| C4 | C3 | C2 | N7 | 179.5° | 180.0° |
| C5 | C6 | C1 | H2 | 180.0° | 180.0° |
| C5 | C6 | C1 | C2 | 0.1° | 0.0° |
| C6 | C5 | C4 | H1 | 179.2° | 179.7° |
| C5 | C6 | C1 | H9 | 179.9° | 180.0° |
| N15 | N14 | C9 | N10 | 1.6° | 0.1° |
| N15 | N14 | C9 | C8 | 179.1° | 179.9° |
| C3 | N10 | C9 | N14 | 178.2° | 179.9° |
| C3 | N10 | C9 | C8 | 1.2° | 0.1° |
| N10 | C3 | C2 | C1 | 179.9° | 180.0° |
| N10 | C3 | C2 | N7 | 0.1° | 0.0° |
| N10 | C3 | C4 | H1 | 0.3° | 0.3° |
| C9 | N10 | C3 | C2 | 1.0° | 0.0° |
| N10 | C9 | N14 | C8 | 179.3° | 179.9° |
| N10 | C9 | C8 | N7 | 0.2° | 0.1° |
| N10 | C9 | C8 | C12 | 178.8° | 180.0° |
| C3 | C2 | C1 | C6 | 0.3° | 0.0° |
| C3 | C2 | C1 | N7 | 179.8° | 179.9° |
| C3 | C2 | N7 | C8 | 1.0° | 0.1° |
| C2 | C3 | C4 | H1 | 179.1° | 179.7° |
| C3 | C2 | C1 | H9 | 179.7° | 180.0° |
| C6 | C1 | C2 | H9 | 180.0° | 180.0° |
| C6 | C1 | C2 | N7 | 179.9° | 180.0° |
| N14 | C9 | C8 | N7 | 179.0° | 179.9° |
| N14 | C9 | C8 | C12 | 2.0° | 0.2° |
| C9 | C8 | N7 | C2 | 0.9° | 0.1° |
| C9 | C8 | N7 | C12 | 179.0° | 179.9° |
| C9 | C8 | C12 | H26 | 179.0° | 179.9° |
| C9 | C8 | C12 | H27 | 60.9° | 60.1° |
| C9 | C8 | C12 | H28 | 59.0° | 59.9° |
| C1 | C2 | N7 | C8 | 179.2° | 180.0° |
| C2 | C1 | C6 | H2 | 179.9° | 180.0° |
| C2 | N7 | C8 | C12 | 179.9° | 180.0° |
| N7 | C2 | C1 | H9 | 0.1° | 0.0° |
| N7 | C8 | C12 | H26 | 0.0° | 0.0° |
| N7 | C8 | C12 | H27 | 120.0° | 120.0° |
| N7 | C8 | C12 | H28 | 120.0° | 120.0° |
| C8 | C12 | H26 | H27 | 120.0° | 120.0° |
| C8 | C12 | H26 | H28 | 120.0° | 120.0° |
| C8 | C12 | H27 | H28 | 120.0° | 119.9° |
| H2 | C6 | C1 | H9 | 0.1° | 0.0° |
| H3 | C20 | C21 | H4 | 0.7° | 0.2° |
| H5 | C26 | C28 | H6 | 60.2° | 180.0° |
| H5 | C26 | C28 | H7 | 59.8° | 60.0° |
| H5 | C26 | C28 | H8 | 179.8° | 60.0° |
| H5 | C26 | C27 | H29 | 60.2° | 180.0° |
| H5 | C26 | C27 | H30 | 179.8° | 60.0° |
| H5 | C26 | C27 | H31 | 59.8° | 60.0° |
| H5 | C26 | C25 | H32 | 51.5° | 175.0° |
| H5 | C26 | C25 | H33 | 172.9° | 65.0° |
| H6 | C28 | H7 | H8 | 120.0° | 120.0° |
| H11 | C33 | C34 | H23 | 60.1° | 60.0° |
| H11 | C33 | C32 | H24 | 60.1° | 60.0° |
| H12 | C33 | C34 | H23 | 59.8° | 60.0° |
| H12 | C33 | C32 | H24 | 59.8° | 60.0° |
| H13 | C35 | C34 | H23 | 60.1° | 60.0° |
| H13 | C35 | C36 | H25 | 59.9° | 60.0° |
| H14 | C35 | C34 | H23 | 59.7° | 60.0° |
| H14 | C35 | C36 | H25 | 60.0° | 60.0° |
| H15 | C38 | C32 | H24 | 59.8° | 60.0° |
| H15 | C38 | C36 | H25 | 60.0° | 60.0° |
| H16 | C38 | C32 | H24 | 60.1° | 60.0° |
| H16 | C38 | C36 | H25 | 59.9° | 60.0° |
| H17 | C39 | C34 | H23 | 60.0° | 60.0° |
| H18 | C39 | C34 | H23 | 59.6° | 60.1° |
| H19 | C31 | C32 | H24 | 59.6° | 60.0° |
| H20 | C31 | C32 | H24 | 60.1° | 60.0° |
| H21 | C37 | C36 | H25 | 60.0° | 60.0° |
| H22 | C37 | C36 | H25 | 59.9° | 60.0° |
| H26 | C12 | H27 | H28 | 120.0° | 120.1° |
| H29 | C27 | H30 | H31 | 120.0° | 120.0° |
