TEY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| C3 | C2 | sing | 1.54Å | 1.55Å | |
| C4 | C1 | sing | 1.52Å | 1.52Å | |
| C2 | C5 | sing | 1.51Å | 1.53Å | |
| C18 | C17 | sing | 1.53Å | 1.51Å | |
| C24 | C25 | sing | 1.53Å | 1.54Å | |
| C24 | C23 | sing | 1.52Å | 1.52Å | |
| N35 | C36 | doub | 1.31Å | 1.35Å | Aromatic |
| N35 | N34 | sing | 1.29Å | 1.40Å | Aromatic |
| C22 | C23 | doub | 1.35Å | 1.36Å | |
| C22 | C21 | sing | 1.46Å | 1.46Å | |
| C31 | C33 | sing | 1.53Å | 1.54Å | |
| C31 | C26 | sing | 1.53Å | 1.54Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C25 | O32 | sing | 1.43Å | 1.44Å | |
| C10 | C5 | sing | 1.53Å | 1.53Å | |
| C23 | C28 | sing | 1.48Å | 1.48Å | |
| C33 | N34 | sing | 1.47Å | 1.48Å | |
| C1 | C21 | doub | 1.33Å | 1.34Å | |
| C1 | C6 | sing | 1.50Å | 1.52Å | |
| C5 | C6 | sing | 1.55Å | 1.52Å | |
| C5 | C9 | sing | 1.52Å | 1.54Å | |
| C36 | N37 | sing | 1.33Å | 1.36Å | Aromatic |
| N34 | N38 | sing | 1.29Å | 1.38Å | Aromatic |
| C17 | C19 | sing | 1.53Å | 1.52Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| C17 | O20 | sing | 1.43Å | 1.44Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C15 | C14 | sing | 1.53Å | 1.52Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C6 | C7 | sing | 1.53Å | 1.54Å | |
| C12 | C9 | sing | 1.53Å | 1.55Å | |
| C12 | C14 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C28 | C29 | doub | 1.33Å | 1.35Å | |
| C28 | C27 | sing | 1.52Å | 1.51Å | |
| C9 | C8 | sing | 1.55Å | 1.53Å | |
| N37 | N38 | doub | 1.29Å | 1.41Å | Aromatic |
| C27 | O30 | sing | 1.43Å | 1.43Å | |
| C7 | C8 | sing | 1.56Å | 1.56Å | |
| O20 | H1 | sing | 0.97Å | 0.95Å | |
| C19 | H2 | sing | 1.09Å | 1.10Å | |
| C19 | H3 | sing | 1.09Å | 1.10Å | |
| C19 | H4 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C9 | H18 | sing | 1.09Å | 1.10Å | |
| C8 | H19 | sing | 1.09Å | 1.10Å | |
| C8 | H20 | sing | 1.09Å | 1.10Å | |
| C7 | H21 | sing | 1.09Å | 1.10Å | |
| C7 | H22 | sing | 1.09Å | 1.10Å | |
| C10 | H23 | sing | 1.09Å | 1.10Å | |
| C10 | H24 | sing | 1.09Å | 1.10Å | |
| C10 | H25 | sing | 1.09Å | 1.10Å | |
| C2 | H26 | sing | 1.09Å | 1.10Å | |
| C2 | H27 | sing | 1.09Å | 1.10Å | |
| C3 | H28 | sing | 1.09Å | 1.10Å | |
| C3 | H29 | sing | 1.09Å | 1.10Å | |
| C4 | H30 | sing | 1.09Å | 1.10Å | |
| C4 | H31 | sing | 1.09Å | 1.10Å | |
| C6 | H32 | sing | 1.09Å | 1.10Å | |
| C21 | H33 | sing | 1.08Å | 1.08Å | |
| C22 | H34 | sing | 1.08Å | 1.08Å | |
| C24 | H35 | sing | 1.09Å | 1.10Å | |
| C24 | H36 | sing | 1.09Å | 1.10Å | |
| C29 | H37 | sing | 1.08Å | 1.08Å | |
| C29 | H38 | sing | 1.08Å | 1.08Å | |
| C27 | H39 | sing | 1.09Å | 1.10Å | |
| O30 | H40 | sing | 0.97Å | 0.95Å | |
| C26 | H41 | sing | 1.09Å | 1.10Å | |
| C25 | H42 | sing | 1.09Å | 1.10Å | |
| O32 | H43 | sing | 0.97Å | 0.95Å | |
| C31 | H44 | sing | 1.09Å | 1.10Å | |
| C31 | H45 | sing | 1.09Å | 1.10Å | |
| C33 | H46 | sing | 1.09Å | 1.10Å | |
| C33 | H47 | sing | 1.09Å | 1.10Å | |
| C36 | H48 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | C3 | C2 | 116.4° | 111.8° |
| C3 | C4 | C1 | 109.3° | 110.7° |
| C4 | C3 | H28 | 107.7° | 109.0° |
| C4 | C3 | H29 | 107.7° | 109.0° |
| C3 | C4 | H30 | 109.5° | 109.2° |
| C3 | C4 | H31 | 109.5° | 109.2° |
| C3 | C2 | C5 | 114.0° | 107.6° |
| C3 | C2 | H26 | 108.3° | 109.9° |
| C3 | C2 | H27 | 108.3° | 109.9° |
| C2 | C3 | H28 | 107.7° | 109.0° |
| C2 | C3 | H29 | 107.7° | 109.0° |
| C4 | C1 | C21 | 122.5° | 122.4° |
| C4 | C1 | C6 | 114.6° | 115.2° |
| C1 | C4 | H30 | 109.5° | 109.2° |
| C1 | C4 | H31 | 109.5° | 109.2° |
| C2 | C5 | C10 | 110.6° | 108.8° |
| C2 | C5 | C6 | 107.2° | 107.6° |
| C2 | C5 | C9 | 115.3° | 118.4° |
| C5 | C2 | H26 | 108.3° | 109.8° |
| C5 | C2 | H27 | 108.3° | 109.8° |
| C18 | C17 | C19 | 106.0° | 109.4° |
| C18 | C17 | C16 | 113.7° | 109.5° |
| C18 | C17 | O20 | 109.3° | 109.4° |
| C17 | C18 | H5 | 109.5° | 109.5° |
| C17 | C18 | H6 | 109.5° | 109.5° |
| C17 | C18 | H7 | 109.5° | 109.5° |
| C25 | C24 | C23 | 109.6° | 108.4° |
| C24 | C25 | C26 | 112.6° | 109.8° |
| C24 | C25 | O32 | 110.8° | 109.4° |
| C25 | C24 | H35 | 109.4° | 109.7° |
| C25 | C24 | H36 | 109.4° | 109.7° |
| C24 | C25 | H42 | 107.7° | 109.4° |
| C24 | C23 | C22 | 117.4° | 121.6° |
| C24 | C23 | C28 | 117.3° | 116.8° |
| C23 | C24 | H35 | 109.4° | 109.7° |
| C23 | C24 | H36 | 109.4° | 109.7° |
| C36 | N35 | N34 | 104.7° | 107.9° |
| N35 | C36 | N37 | 109.5° | 106.9° |
| N35 | C36 | H48 | 125.3° | 126.5° |
| N35 | N34 | C33 | 124.1° | 125.5° |
| N35 | N34 | N38 | 113.3° | 109.1° |
| C23 | C22 | C21 | 124.0° | 120.0° |
| C22 | C23 | C28 | 125.3° | 121.6° |
| C23 | C22 | H34 | 118.0° | 120.0° |
| C22 | C21 | C1 | 122.4° | 120.0° |
| C22 | C21 | H33 | 118.8° | 120.0° |
| C21 | C22 | H34 | 118.0° | 120.0° |
| C33 | C31 | C26 | 120.5° | 109.5° |
| C31 | C33 | N34 | 113.0° | 109.4° |
| C33 | C31 | H44 | 106.6° | 109.5° |
| C33 | C31 | H45 | 106.6° | 109.5° |
| C31 | C33 | H46 | 108.6° | 109.5° |
| C31 | C33 | H47 | 108.6° | 109.5° |
| C31 | C26 | C25 | 110.1° | 109.5° |
| C31 | C26 | C27 | 113.0° | 109.4° |
| C31 | C26 | H41 | 108.3° | 109.4° |
| C26 | C31 | H44 | 106.7° | 109.5° |
| C26 | C31 | H45 | 106.7° | 109.5° |
| C26 | C25 | O32 | 108.7° | 109.5° |
| C25 | C26 | C27 | 108.1° | 110.0° |
| C25 | C26 | H41 | 108.5° | 109.2° |
| C26 | C25 | H42 | 107.9° | 109.4° |
| O32 | C25 | H42 | 109.0° | 109.4° |
| C25 | O32 | H43 | 109.5° | 114.0° |
| C10 | C5 | C6 | 110.0° | 109.2° |
| C10 | C5 | C9 | 114.3° | 109.3° |
| C5 | C10 | H23 | 109.5° | 109.5° |
| C5 | C10 | H24 | 109.5° | 109.5° |
| C5 | C10 | H25 | 109.5° | 109.5° |
| C23 | C28 | C29 | 122.8° | 121.6° |
| C23 | C28 | C27 | 116.2° | 116.8° |
| C33 | N34 | N38 | 122.6° | 125.4° |
| N34 | C33 | H46 | 108.6° | 109.5° |
| N34 | C33 | H47 | 108.6° | 109.5° |
| C21 | C1 | C6 | 122.8° | 122.3° |
| C1 | C21 | H33 | 118.8° | 120.0° |
| C1 | C6 | C5 | 108.0° | 105.5° |
| C1 | C6 | C7 | 121.8° | 116.7° |
| C1 | C6 | H32 | 107.1° | 111.1° |
| C6 | C5 | C9 | 98.4° | 103.2° |
| C5 | C6 | C7 | 105.4° | 101.3° |
| C5 | C6 | H32 | 107.0° | 110.9° |
| C5 | C9 | C12 | 120.2° | 110.3° |
| C5 | C9 | C8 | 105.1° | 105.0° |
| C5 | C9 | H18 | 104.2° | 110.4° |
| C36 | N37 | N38 | 111.4° | 107.4° |
| N37 | C36 | H48 | 125.2° | 126.6° |
| N34 | N38 | N37 | 101.2° | 108.7° |
| C19 | C17 | C16 | 107.6° | 109.5° |
| C19 | C17 | O20 | 111.6° | 109.5° |
| C17 | C19 | H2 | 109.5° | 109.5° |
| C17 | C19 | H3 | 109.5° | 109.5° |
| C17 | C19 | H4 | 109.4° | 109.5° |
| C16 | C17 | O20 | 108.7° | 109.5° |
| C17 | C16 | C15 | 115.3° | 109.5° |
| C17 | C16 | H8 | 108.0° | 109.5° |
| C17 | C16 | H9 | 108.0° | 109.4° |
| C17 | O20 | H1 | 109.5° | 114.0° |
| C16 | C15 | C14 | 108.5° | 109.5° |
| C15 | C16 | H8 | 108.0° | 109.5° |
| C15 | C16 | H9 | 108.0° | 109.4° |
| C16 | C15 | H10 | 109.7° | 109.5° |
| C16 | C15 | H11 | 109.7° | 109.5° |
| C15 | C14 | C12 | 110.3° | 109.5° |
| C14 | C15 | H10 | 109.7° | 109.4° |
| C14 | C15 | H11 | 109.7° | 109.5° |
| C15 | C14 | H12 | 109.3° | 109.4° |
| C15 | C14 | H13 | 109.3° | 109.5° |
| C26 | C27 | C28 | 109.4° | 108.4° |
| C26 | C27 | O30 | 108.1° | 109.7° |
| C26 | C27 | H39 | 108.4° | 109.8° |
| C27 | C26 | H41 | 108.6° | 109.4° |
| C6 | C7 | C8 | 104.5° | 102.8° |
| C6 | C7 | H21 | 110.7° | 110.8° |
| C6 | C7 | H22 | 110.7° | 110.9° |
| C7 | C6 | H32 | 106.8° | 110.7° |
| C9 | C12 | C14 | 114.0° | 109.5° |
| C9 | C12 | C13 | 110.6° | 109.4° |
| C12 | C9 | C8 | 117.1° | 110.3° |
| C9 | C12 | H14 | 106.0° | 109.5° |
| C12 | C9 | H18 | 104.1° | 110.3° |
| C14 | C12 | C13 | 113.3° | 109.5° |
| C12 | C14 | H12 | 109.3° | 109.4° |
| C12 | C14 | H13 | 109.3° | 109.5° |
| C14 | C12 | H14 | 106.1° | 109.5° |
| C13 | C12 | H14 | 106.0° | 109.5° |
| C12 | C13 | H15 | 109.5° | 109.5° |
| C12 | C13 | H16 | 109.5° | 109.5° |
| C12 | C13 | H17 | 109.5° | 109.5° |
| C29 | C28 | C27 | 120.9° | 121.6° |
| C28 | C29 | H37 | 120.0° | 120.0° |
| C28 | C29 | H38 | 120.0° | 120.0° |
| C28 | C27 | O30 | 112.8° | 109.7° |
| C28 | C27 | H39 | 108.5° | 109.7° |
| C9 | C8 | C7 | 104.1° | 106.3° |
| C8 | C9 | H18 | 104.2° | 110.4° |
| C9 | C8 | H19 | 110.8° | 110.1° |
| C9 | C8 | H20 | 110.8° | 110.1° |
| O30 | C27 | H39 | 109.6° | 109.7° |
| C27 | O30 | H40 | 109.5° | 114.0° |
| C7 | C8 | H19 | 110.8° | 110.1° |
| C7 | C8 | H20 | 110.8° | 110.1° |
| C8 | C7 | H21 | 110.7° | 110.8° |
| C8 | C7 | H22 | 110.7° | 110.7° |
| H2 | C19 | H3 | 109.4° | 109.4° |
| H2 | C19 | H4 | 109.5° | 109.5° |
| H3 | C19 | H4 | 109.5° | 109.5° |
| H5 | C18 | H6 | 109.4° | 109.5° |
| H5 | C18 | H7 | 109.5° | 109.5° |
| H6 | C18 | H7 | 109.5° | 109.4° |
| H8 | C16 | H9 | 109.4° | 109.5° |
| H10 | C15 | H11 | 109.5° | 109.5° |
| H12 | C14 | H13 | 109.5° | 109.5° |
| H15 | C13 | H16 | 109.4° | 109.5° |
| H15 | C13 | H17 | 109.4° | 109.4° |
| H16 | C13 | H17 | 109.5° | 109.5° |
| H19 | C8 | H20 | 109.5° | 110.0° |
| H21 | C7 | H22 | 109.5° | 110.7° |
| H23 | C10 | H24 | 109.5° | 109.5° |
| H23 | C10 | H25 | 109.5° | 109.4° |
| H24 | C10 | H25 | 109.5° | 109.4° |
| H26 | C2 | H27 | 109.5° | 109.8° |
| H28 | C3 | H29 | 109.5° | 108.9° |
| H30 | C4 | H31 | 109.4° | 109.2° |
| H35 | C24 | H36 | 109.5° | 109.7° |
| H37 | C29 | H38 | 120.0° | 120.0° |
| H44 | C31 | H45 | 109.5° | 109.5° |
| H46 | C33 | H47 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | C3 | C2 | H28 | 121.0° | 120.6° |
| C4 | C3 | C2 | H29 | 121.0° | 120.6° |
| C3 | C4 | C1 | H30 | 120.0° | 120.3° |
| C3 | C4 | C1 | H31 | 120.0° | 120.3° |
| C4 | C3 | C2 | C5 | 43.5° | 59.0° |
| C3 | C4 | C1 | C21 | 127.5° | 129.8° |
| C3 | C4 | C1 | C6 | 50.1° | 50.2° |
| C4 | C3 | C2 | H26 | 77.2° | 178.6° |
| C4 | C3 | C2 | H27 | 164.2° | 60.5° |
| C4 | C3 | H28 | H29 | 116.8° | 118.8° |
| C3 | C4 | H30 | H31 | 120.1° | 119.4° |
| C2 | C3 | C4 | C1 | 38.4° | 48.6° |
| C3 | C2 | C5 | H26 | 120.7° | 119.6° |
| C3 | C2 | C5 | H27 | 120.7° | 119.6° |
| C3 | C2 | C5 | C10 | 65.1° | 50.2° |
| C3 | C2 | C5 | C6 | 54.8° | 68.0° |
| C3 | C2 | C5 | C9 | 163.3° | 175.6° |
| C3 | C2 | H26 | H27 | 117.9° | 121.0° |
| C2 | C3 | H28 | H29 | 116.8° | 118.8° |
| C2 | C3 | C4 | H30 | 158.4° | 168.9° |
| C2 | C3 | C4 | H31 | 81.5° | 71.7° |
| C4 | C1 | C21 | C22 | 2.2° | 0.0° |
| C4 | C1 | C21 | C6 | 177.3° | 180.0° |
| C4 | C1 | C6 | C5 | 65.4° | 58.1° |
| C4 | C1 | C6 | C7 | 172.6° | 169.6° |
| C1 | C4 | C3 | H28 | 159.4° | 72.1° |
| C1 | C4 | C3 | H29 | 82.6° | 169.2° |
| C1 | C4 | H30 | H31 | 120.0° | 119.4° |
| C4 | C1 | C6 | H32 | 49.6° | 62.1° |
| C4 | C1 | C21 | H33 | 177.7° | 180.0° |
| C2 | C5 | C10 | C6 | 118.2° | 117.2° |
| C2 | C5 | C10 | C9 | 132.2° | 130.6° |
| C2 | C5 | C6 | C1 | 64.1° | 66.5° |
| C2 | C5 | C6 | C9 | 119.9° | 125.9° |
| C2 | C5 | C6 | C7 | 164.2° | 171.5° |
| C2 | C5 | C9 | C12 | 66.2° | 92.2° |
| C2 | C5 | C9 | C8 | 159.1° | 148.9° |
| C2 | C5 | C9 | H18 | 49.8° | 29.9° |
| C2 | C5 | C10 | H23 | 180.0° | 176.0° |
| C2 | C5 | C10 | H24 | 60.0° | 55.9° |
| C2 | C5 | C10 | H25 | 60.0° | 64.1° |
| C5 | C2 | H26 | H27 | 117.9° | 120.8° |
| C5 | C2 | C3 | H28 | 164.5° | 61.6° |
| C5 | C2 | C3 | H29 | 77.5° | 179.6° |
| C2 | C5 | C6 | H32 | 50.8° | 53.9° |
| C18 | C17 | C19 | C16 | 122.0° | 120.0° |
| C18 | C17 | C19 | O20 | 118.9° | 119.9° |
| C18 | C17 | C16 | O20 | 122.0° | 120.0° |
| C18 | C17 | C16 | C15 | 58.7° | 60.0° |
| C18 | C17 | O20 | H1 | 180.0° | 180.0° |
| C18 | C17 | C19 | H2 | 180.0° | 179.9° |
| C18 | C17 | C19 | H3 | 60.0° | 60.0° |
| C18 | C17 | C19 | H4 | 60.0° | 60.0° |
| C17 | C18 | H5 | H6 | 120.0° | 120.0° |
| C17 | C18 | H5 | H7 | 120.0° | 120.0° |
| C17 | C18 | H6 | H7 | 120.0° | 120.0° |
| C18 | C17 | C16 | H8 | 179.6° | 180.0° |
| C18 | C17 | C16 | H9 | 62.1° | 60.0° |
| C25 | C24 | C23 | H35 | 120.0° | 119.7° |
| C25 | C24 | C23 | H36 | 120.0° | 119.7° |
| C25 | C24 | C23 | C22 | 139.1° | 133.4° |
| C24 | C25 | C26 | C31 | 60.3° | 173.8° |
| C24 | C25 | C26 | O32 | 123.2° | 120.1° |
| C24 | C25 | C26 | H42 | 118.7° | 120.1° |
| C24 | C25 | O32 | H42 | 118.4° | 119.9° |
| C25 | C24 | C23 | C28 | 40.2° | 46.9° |
| C24 | C25 | C26 | C27 | 63.6° | 66.0° |
| C25 | C24 | H35 | H36 | 119.9° | 120.5° |
| C24 | C25 | C26 | H41 | 178.7° | 54.1° |
| C24 | C25 | O32 | H43 | 180.0° | 60.0° |
| C24 | C23 | C22 | C28 | 179.2° | 179.7° |
| C24 | C23 | C22 | C21 | 178.8° | 179.7° |
| C23 | C24 | C25 | C26 | 51.9° | 57.6° |
| C23 | C24 | C25 | O32 | 70.1° | 177.8° |
| C24 | C23 | C28 | C29 | 135.9° | 136.7° |
| C24 | C23 | C28 | C27 | 41.3° | 43.3° |
| C24 | C23 | C22 | H34 | 1.2° | 0.3° |
| C23 | C24 | H35 | H36 | 119.9° | 120.6° |
| C23 | C24 | C25 | H42 | 170.7° | 62.4° |
| C36 | N35 | N34 | C33 | 179.4° | 180.0° |
| N35 | C36 | N37 | H48 | 180.0° | 180.0° |
| C36 | N35 | N34 | N38 | 1.1° | 0.2° |
| N35 | C36 | N37 | N38 | 0.3° | 0.2° |
| N35 | N34 | C33 | C31 | 54.5° | 89.7° |
| N35 | N34 | C33 | N38 | 178.2° | 179.7° |
| N34 | N35 | C36 | N37 | 0.5° | 0.0° |
| N35 | N34 | N38 | N37 | 1.2° | 0.4° |
| N35 | N34 | C33 | H46 | 175.0° | 150.3° |
| N35 | N34 | C33 | H47 | 66.0° | 30.2° |
| N34 | N35 | C36 | H48 | 179.5° | 180.0° |
| C23 | C22 | C21 | H34 | 180.0° | 180.0° |
| C23 | C22 | C21 | C1 | 157.8° | 180.0° |
| C22 | C23 | C28 | C29 | 44.9° | 43.0° |
| C22 | C23 | C28 | C27 | 138.0° | 136.9° |
| C23 | C22 | C21 | H33 | 22.2° | 0.0° |
| C22 | C23 | C24 | H35 | 19.1° | 13.7° |
| C22 | C23 | C24 | H36 | 100.9° | 106.9° |
| C21 | C22 | C23 | C28 | 0.4° | 0.0° |
| C22 | C21 | C1 | H33 | 180.0° | 180.0° |
| C22 | C21 | C1 | C6 | 179.6° | 180.0° |
| C33 | C31 | C26 | H44 | 121.5° | 120.0° |
| C33 | C31 | C26 | H45 | 121.5° | 120.0° |
| C33 | C31 | C26 | C25 | 138.8° | 174.4° |
| C31 | C33 | N34 | H46 | 120.5° | 120.0° |
| C31 | C33 | N34 | H47 | 120.5° | 120.0° |
| C31 | C33 | N34 | N38 | 127.3° | 90.0° |
| C33 | C31 | C26 | C27 | 100.1° | 65.0° |
| C33 | C31 | C26 | H41 | 20.3° | 54.9° |
| C33 | C31 | H44 | H45 | 115.0° | 120.0° |
| C31 | C33 | H46 | H47 | 118.4° | 120.0° |
| C31 | C26 | C25 | C27 | 123.9° | 120.3° |
| C31 | C26 | C25 | H41 | 118.4° | 119.7° |
| C31 | C26 | C25 | O32 | 176.4° | 53.7° |
| C26 | C31 | C33 | N34 | 45.4° | 180.0° |
| C31 | C26 | C27 | H41 | 120.2° | 119.8° |
| C31 | C26 | C27 | C28 | 62.3° | 177.7° |
| C31 | C26 | C27 | O30 | 60.8° | 58.0° |
| C31 | C26 | C27 | H39 | 179.5° | 62.5° |
| C31 | C26 | C25 | H42 | 58.4° | 66.2° |
| C26 | C31 | H44 | H45 | 115.0° | 120.0° |
| C26 | C31 | C33 | H46 | 75.2° | 60.0° |
| C26 | C31 | C33 | H47 | 165.9° | 60.0° |
| C26 | C25 | O32 | H42 | 117.3° | 119.8° |
| C25 | C26 | C27 | H41 | 117.6° | 119.9° |
| C25 | C26 | C27 | C28 | 59.8° | 57.4° |
| C25 | C26 | C27 | O30 | 177.0° | 62.3° |
| C26 | C25 | C24 | H35 | 172.0° | 177.3° |
| C26 | C25 | C24 | H36 | 68.1° | 62.1° |
| C25 | C26 | C27 | H39 | 58.3° | 177.2° |
| C26 | C25 | O32 | H43 | 55.7° | 179.7° |
| C25 | C26 | C31 | H44 | 17.3° | 65.6° |
| C25 | C26 | C31 | H45 | 99.7° | 54.5° |
| O32 | C25 | C26 | C27 | 59.6° | 174.0° |
| O32 | C25 | C24 | H35 | 49.9° | 62.5° |
| O32 | C25 | C24 | H36 | 169.9° | 58.0° |
| O32 | C25 | C26 | H41 | 58.0° | 66.0° |
| C10 | C5 | C6 | C1 | 56.2° | 51.5° |
| C10 | C5 | C6 | C9 | 119.8° | 116.2° |
| C10 | C5 | C6 | C7 | 75.5° | 70.6° |
| C10 | C5 | C9 | C12 | 63.6° | 33.0° |
| C10 | C5 | C9 | C8 | 71.0° | 85.9° |
| C10 | C5 | C9 | H18 | 179.7° | 155.1° |
| C5 | C10 | H23 | H24 | 120.0° | 120.1° |
| C5 | C10 | H23 | H25 | 120.0° | 120.0° |
| C5 | C10 | H24 | H25 | 120.0° | 120.0° |
| C10 | C5 | C2 | H26 | 174.2° | 69.4° |
| C10 | C5 | C2 | H27 | 55.6° | 169.7° |
| C10 | C5 | C6 | H32 | 171.1° | 171.9° |
| C23 | C28 | C27 | C26 | 50.1° | 46.6° |
| C23 | C28 | C29 | C27 | 177.0° | 180.0° |
| C23 | C28 | C27 | O30 | 170.4° | 73.1° |
| C28 | C23 | C22 | H34 | 179.6° | 180.0° |
| C28 | C23 | C24 | H35 | 160.2° | 166.6° |
| C28 | C23 | C24 | H36 | 79.8° | 72.8° |
| C23 | C28 | C29 | H37 | 177.0° | 0.0° |
| C23 | C28 | C29 | H38 | 3.0° | 180.0° |
| C23 | C28 | C27 | H39 | 68.0° | 166.4° |
| C33 | N34 | N38 | N37 | 179.6° | 179.8° |
| N34 | C33 | C31 | H44 | 76.2° | 60.0° |
| N34 | C33 | C31 | H45 | 166.9° | 60.1° |
| N34 | C33 | H46 | H47 | 118.4° | 120.0° |
| C21 | C1 | C6 | C5 | 112.2° | 121.9° |
| C21 | C1 | C6 | C7 | 9.8° | 10.4° |
| C21 | C1 | C4 | H30 | 7.5° | 9.5° |
| C21 | C1 | C4 | H31 | 112.5° | 109.9° |
| C21 | C1 | C6 | H32 | 132.9° | 117.8° |
| C1 | C21 | C22 | H34 | 22.2° | 0.0° |
| C1 | C6 | C5 | C7 | 131.6° | 122.1° |
| C1 | C6 | C5 | H32 | 115.0° | 120.4° |
| C1 | C6 | C5 | C9 | 176.0° | 167.6° |
| C1 | C6 | C7 | H32 | 123.2° | 128.4° |
| C1 | C6 | C7 | C8 | 150.4° | 156.2° |
| C1 | C6 | C7 | H21 | 31.2° | 85.4° |
| C1 | C6 | C7 | H22 | 90.4° | 37.9° |
| C6 | C1 | C4 | H30 | 170.1° | 170.6° |
| C6 | C1 | C4 | H31 | 69.9° | 70.1° |
| C6 | C1 | C21 | H33 | 0.4° | 0.1° |
| C5 | C6 | C7 | H32 | 113.6° | 117.6° |
| C6 | C5 | C9 | C12 | 179.9° | 149.1° |
| C6 | C5 | C9 | C8 | 45.5° | 30.2° |
| C5 | C6 | C7 | C8 | 27.2° | 42.3° |
| C6 | C5 | C9 | H18 | 63.8° | 88.8° |
| C5 | C6 | C7 | H21 | 92.0° | 160.6° |
| C5 | C6 | C7 | H22 | 146.4° | 76.1° |
| C6 | C5 | C10 | H23 | 61.8° | 66.8° |
| C6 | C5 | C10 | H24 | 178.2° | 173.1° |
| C6 | C5 | C10 | H25 | 58.2° | 53.1° |
| C6 | C5 | C2 | H26 | 65.8° | 172.4° |
| C6 | C5 | C2 | H27 | 175.5° | 51.6° |
| C9 | C5 | C6 | C7 | 44.3° | 45.6° |
| C5 | C9 | C12 | C8 | 129.5° | 115.6° |
| C5 | C9 | C12 | H18 | 116.1° | 122.3° |
| C5 | C9 | C12 | C14 | 81.3° | 177.1° |
| C5 | C9 | C12 | C13 | 149.6° | 62.9° |
| C5 | C9 | C8 | H18 | 109.3° | 119.0° |
| C5 | C9 | C8 | C7 | 29.6° | 4.0° |
| C5 | C9 | C12 | H14 | 35.0° | 57.0° |
| C5 | C9 | C8 | H19 | 148.8° | 123.2° |
| C5 | C9 | C8 | H20 | 89.5° | 115.2° |
| C9 | C5 | C10 | H23 | 47.8° | 45.4° |
| C9 | C5 | C10 | H24 | 72.2° | 74.7° |
| C9 | C5 | C10 | H25 | 167.8° | 165.3° |
| C9 | C5 | C2 | H26 | 42.6° | 56.0° |
| C9 | C5 | C2 | H27 | 76.1° | 64.8° |
| C9 | C5 | C6 | H32 | 69.1° | 72.0° |
| C36 | N37 | N38 | N34 | 0.9° | 0.4° |
| N38 | N34 | C33 | H46 | 6.8° | 30.0° |
| N38 | N34 | C33 | H47 | 112.2° | 150.0° |
| C19 | C17 | C16 | O20 | 120.9° | 120.0° |
| C19 | C17 | C16 | C15 | 175.8° | 180.0° |
| C19 | C17 | O20 | H1 | 63.1° | 60.0° |
| C17 | C19 | H2 | H3 | 120.0° | 120.0° |
| C17 | C19 | H2 | H4 | 120.0° | 120.0° |
| C17 | C19 | H3 | H4 | 120.0° | 120.0° |
| C19 | C17 | C18 | H5 | 180.0° | 60.0° |
| C19 | C17 | C18 | H6 | 60.0° | 180.0° |
| C19 | C17 | C18 | H7 | 60.0° | 60.0° |
| C19 | C17 | C16 | H8 | 63.3° | 60.0° |
| C19 | C17 | C16 | H9 | 54.9° | 60.0° |
| C17 | C16 | C15 | H8 | 120.9° | 120.1° |
| C17 | C16 | C15 | H9 | 120.9° | 120.0° |
| C17 | C16 | C15 | C14 | 171.9° | 180.0° |
| C16 | C17 | O20 | H1 | 55.4° | 60.0° |
| C16 | C17 | C19 | H2 | 58.0° | 60.0° |
| C16 | C17 | C19 | H3 | 178.0° | 179.9° |
| C16 | C17 | C19 | H4 | 62.0° | 60.0° |
| C16 | C17 | C18 | H5 | 62.0° | 180.0° |
| C16 | C17 | C18 | H6 | 58.0° | 60.0° |
| C16 | C17 | C18 | H7 | 178.0° | 60.0° |
| C17 | C16 | H8 | H9 | 117.4° | 120.0° |
| C17 | C16 | C15 | H10 | 68.3° | 60.0° |
| C17 | C16 | C15 | H11 | 52.0° | 60.1° |
| O20 | C17 | C16 | C15 | 63.3° | 60.0° |
| O20 | C17 | C19 | H2 | 61.1° | 60.0° |
| O20 | C17 | C19 | H3 | 58.9° | 59.9° |
| O20 | C17 | C19 | H4 | 178.9° | 180.0° |
| O20 | C17 | C18 | H5 | 59.6° | 60.0° |
| O20 | C17 | C18 | H6 | 179.6° | 60.1° |
| O20 | C17 | C18 | H7 | 60.4° | 180.0° |
| O20 | C17 | C16 | H8 | 57.6° | 60.0° |
| O20 | C17 | C16 | H9 | 175.9° | 180.0° |
| C16 | C15 | C14 | H10 | 119.8° | 120.0° |
| C16 | C15 | C14 | H11 | 119.9° | 120.0° |
| C16 | C15 | C14 | C12 | 177.1° | 180.0° |
| C15 | C16 | H8 | H9 | 117.3° | 120.0° |
| C16 | C15 | H10 | H11 | 120.5° | 120.0° |
| C16 | C15 | C14 | H12 | 62.8° | 60.0° |
| C16 | C15 | C14 | H13 | 57.0° | 60.0° |
| C15 | C14 | C12 | C9 | 161.0° | 175.0° |
| C15 | C14 | C12 | H12 | 120.1° | 120.0° |
| C15 | C14 | C12 | H13 | 120.1° | 120.1° |
| C15 | C14 | C12 | C13 | 71.3° | 65.0° |
| C14 | C15 | C16 | H8 | 51.0° | 60.0° |
| C14 | C15 | C16 | H9 | 67.3° | 60.0° |
| C14 | C15 | H10 | H11 | 120.4° | 120.0° |
| C15 | C14 | H12 | H13 | 119.7° | 120.1° |
| C15 | C14 | C12 | H14 | 44.7° | 55.0° |
| C26 | C27 | C28 | C29 | 127.0° | 133.5° |
| C26 | C27 | C28 | O30 | 120.3° | 119.7° |
| C26 | C27 | C28 | H39 | 118.1° | 119.8° |
| C26 | C27 | O30 | H39 | 118.0° | 120.6° |
| C26 | C27 | O30 | H40 | 180.0° | 178.9° |
| C27 | C26 | C25 | H42 | 177.7° | 54.1° |
| C27 | C26 | C31 | H44 | 138.3° | 55.0° |
| C27 | C26 | C31 | H45 | 21.4° | 175.1° |
| C6 | C7 | C8 | C9 | 1.6° | 24.1° |
| C6 | C7 | C8 | H21 | 119.2° | 118.3° |
| C6 | C7 | C8 | H22 | 119.2° | 118.5° |
| C6 | C7 | C8 | H19 | 120.8° | 95.1° |
| C6 | C7 | C8 | H20 | 117.5° | 143.4° |
| C6 | C7 | H21 | H22 | 122.3° | 123.4° |
| C9 | C12 | C14 | C13 | 127.7° | 120.0° |
| C9 | C12 | C14 | H14 | 116.3° | 120.0° |
| C9 | C12 | C13 | H14 | 114.5° | 120.0° |
| C12 | C9 | C8 | H18 | 114.4° | 122.1° |
| C12 | C9 | C8 | C7 | 166.0° | 122.9° |
| C9 | C12 | C14 | H12 | 78.9° | 65.0° |
| C9 | C12 | C14 | H13 | 40.9° | 55.0° |
| C9 | C12 | C13 | H15 | 180.0° | 180.0° |
| C9 | C12 | C13 | H16 | 60.0° | 60.0° |
| C9 | C12 | C13 | H17 | 60.0° | 60.0° |
| C12 | C9 | C8 | H19 | 74.9° | 117.9° |
| C12 | C9 | C8 | H20 | 46.8° | 3.6° |
| C14 | C12 | C13 | H14 | 116.0° | 120.0° |
| C14 | C12 | C9 | C8 | 48.2° | 61.4° |
| C12 | C14 | C15 | H10 | 57.3° | 60.0° |
| C12 | C14 | C15 | H11 | 63.0° | 60.0° |
| C12 | C14 | H12 | H13 | 119.6° | 120.0° |
| C14 | C12 | C13 | H15 | 50.6° | 60.0° |
| C14 | C12 | C13 | H16 | 69.4° | 60.0° |
| C14 | C12 | C13 | H17 | 170.5° | 180.0° |
| C14 | C12 | C9 | H18 | 162.6° | 60.7° |
| C13 | C12 | C9 | C8 | 80.9° | 178.5° |
| C13 | C12 | C14 | H12 | 48.9° | 55.0° |
| C13 | C12 | C14 | H13 | 168.6° | 175.0° |
| C12 | C13 | H15 | H16 | 120.0° | 120.0° |
| C12 | C13 | H15 | H17 | 120.0° | 120.0° |
| C12 | C13 | H16 | H17 | 120.0° | 120.0° |
| C13 | C12 | C9 | H18 | 33.5° | 59.3° |
| C29 | C28 | C27 | O30 | 6.8° | 106.8° |
| C28 | C29 | H37 | H38 | 180.0° | 180.0° |
| C29 | C28 | C27 | H39 | 114.8° | 13.7° |
| C28 | C27 | O30 | H39 | 121.0° | 120.5° |
| C27 | C28 | C29 | H37 | 0.0° | 180.0° |
| C27 | C28 | C29 | H38 | 180.0° | 0.0° |
| C28 | C27 | O30 | H40 | 59.0° | 60.0° |
| C28 | C27 | C26 | H41 | 177.4° | 62.4° |
| C9 | C8 | C7 | H19 | 119.1° | 119.3° |
| C9 | C8 | C7 | H20 | 119.2° | 119.3° |
| C8 | C9 | C12 | H14 | 164.6° | 58.6° |
| C9 | C8 | H19 | H20 | 122.5° | 121.6° |
| C9 | C8 | C7 | H21 | 120.8° | 142.5° |
| C9 | C8 | C7 | H22 | 117.6° | 94.3° |
| N38 | N37 | C36 | H48 | 179.7° | 179.8° |
| O30 | C27 | C26 | H41 | 59.4° | 177.8° |
| C7 | C8 | C9 | H18 | 79.7° | 115.1° |
| C7 | C8 | H19 | H20 | 122.5° | 121.5° |
| C8 | C7 | H21 | H22 | 122.3° | 123.2° |
| C8 | C7 | C6 | H32 | 86.4° | 75.4° |
| H2 | C19 | H3 | H4 | 120.0° | 120.0° |
| H5 | C18 | H6 | H7 | 120.0° | 119.9° |
| H8 | C16 | C15 | H10 | 170.8° | 179.9° |
| H8 | C16 | C15 | H11 | 68.9° | 60.0° |
| H9 | C16 | C15 | H10 | 52.6° | 59.9° |
| H9 | C16 | C15 | H11 | 172.9° | 180.0° |
| H10 | C15 | C14 | H12 | 177.4° | 180.0° |
| H10 | C15 | C14 | H13 | 62.8° | 60.0° |
| H11 | C15 | C14 | H12 | 57.1° | 59.9° |
| H11 | C15 | C14 | H13 | 176.9° | 180.0° |
| H12 | C14 | C12 | H14 | 164.8° | 175.0° |
| H13 | C14 | C12 | H14 | 75.4° | 65.1° |
| H14 | C12 | C13 | H15 | 65.5° | 60.0° |
| H14 | C12 | C13 | H16 | 174.5° | 180.0° |
| H14 | C12 | C13 | H17 | 54.5° | 60.0° |
| H14 | C12 | C9 | H18 | 81.1° | 179.3° |
| H15 | C13 | H16 | H17 | 120.0° | 120.0° |
| H18 | C9 | C8 | H19 | 39.5° | 4.2° |
| H18 | C9 | C8 | H20 | 161.2° | 125.7° |
| H19 | C8 | C7 | H21 | 120.0° | 23.2° |
| H19 | C8 | C7 | H22 | 1.5° | 146.4° |
| H20 | C8 | C7 | H21 | 1.7° | 98.3° |
| H20 | C8 | C7 | H22 | 123.2° | 24.9° |
| H21 | C7 | C6 | H32 | 154.4° | 43.0° |
| H22 | C7 | C6 | H32 | 32.8° | 166.3° |
| H23 | C10 | H24 | H25 | 120.0° | 119.9° |
| H26 | C2 | C3 | H28 | 43.8° | 58.0° |
| H26 | C2 | C3 | H29 | 161.8° | 60.8° |
| H27 | C2 | C3 | H28 | 74.8° | 178.9° |
| H27 | C2 | C3 | H29 | 43.2° | 60.1° |
| H28 | C3 | C4 | H30 | 80.6° | 48.3° |
| H28 | C3 | C4 | H31 | 39.5° | 167.6° |
| H29 | C3 | C4 | H30 | 37.4° | 70.5° |
| H29 | C3 | C4 | H31 | 157.4° | 48.9° |
| H33 | C21 | C22 | H34 | 157.8° | 180.0° |
| H35 | C24 | C25 | H42 | 69.2° | 57.3° |
| H36 | C24 | C25 | H42 | 50.7° | 177.9° |
| H39 | C27 | O30 | H40 | 62.0° | 60.5° |
| H39 | C27 | C26 | H41 | 59.3° | 57.3° |
| H41 | C26 | C25 | H42 | 60.0° | 174.1° |
| H41 | C26 | C31 | H44 | 101.3° | 174.8° |
| H41 | C26 | C31 | H45 | 141.8° | 65.1° |
| H42 | C25 | O32 | H43 | 61.6° | 59.8° |
| H44 | C31 | C33 | H46 | 163.3° | 180.0° |
| H44 | C31 | C33 | H47 | 44.3° | 60.0° |
| H45 | C31 | C33 | H46 | 46.4° | 59.9° |
| H45 | C31 | C33 | H47 | 72.6° | 180.0° |
