M6E
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | N5 | sing | 1.46Å | 1.44Å | |
| O5 | C23 | doub | 1.22Å | 1.25Å | |
| N5 | C23 | sing | 1.35Å | 1.34Å | |
| C23 | N4 | sing | 1.35Å | 1.36Å | |
| N3 | C22 | doub | 1.30Å | 1.28Å | |
| N4 | C22 | sing | 1.38Å | 1.34Å | |
| C22 | N2 | sing | 1.37Å | 1.32Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| N2 | C21 | sing | 1.47Å | 1.46Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C15 | N1 | sing | 1.46Å | 1.45Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| N1 | C14 | sing | 1.35Å | 1.33Å | |
| C14 | O4 | doub | 1.21Å | 1.22Å | |
| C14 | O3 | sing | 1.35Å | 1.47Å | |
| C27 | C26 | trip | 1.17Å | 1.28Å | |
| C26 | C25 | sing | 1.47Å | 1.48Å | |
| C25 | O6 | sing | 1.43Å | 1.44Å | |
| O3 | C3 | sing | 1.47Å | 1.45Å | |
| C33 | C2 | sing | 1.46Å | 1.54Å | |
| C3 | C2 | sing | 1.56Å | 1.57Å | |
| C3 | C4 | sing | 1.52Å | 1.55Å | |
| O6 | C5 | sing | 1.38Å | 1.44Å | |
| C5 | C4 | sing | 1.59Å | 1.55Å | |
| C5 | C6 | sing | 1.52Å | 1.55Å | |
| C2 | C1 | sing | 1.49Å | 1.51Å | |
| C4 | C34 | sing | 1.53Å | 1.53Å | |
| C35 | C6 | sing | 1.51Å | 1.53Å | |
| C6 | O7 | sing | 1.50Å | 1.43Å | |
| C6 | C7 | sing | 1.49Å | 1.53Å | |
| C1 | O1 | doub | 1.23Å | 1.22Å | |
| C1 | O2 | sing | 1.40Å | 1.46Å | |
| C7 | C8 | sing | 1.56Å | 1.54Å | |
| O2 | C13 | sing | 1.41Å | 1.44Å | |
| C8 | C36 | sing | 1.54Å | 1.54Å | |
| C8 | C9 | sing | 1.58Å | 1.55Å | |
| C29 | C28 | sing | 1.51Å | 1.53Å | |
| C13 | C31 | sing | 1.56Å | 1.54Å | |
| C13 | C12 | sing | 1.43Å | 1.54Å | |
| O8 | C9 | sing | 1.43Å | 1.46Å | |
| O8 | C28 | sing | 1.42Å | 1.46Å | |
| C38 | C12 | sing | 1.56Å | 1.54Å | |
| C31 | C32 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.52Å | 1.55Å | |
| C11 | C10 | sing | 1.48Å | 1.54Å | |
| C11 | O9 | sing | 1.47Å | 1.44Å | |
| C9 | C10 | sing | 1.50Å | 1.53Å | |
| C28 | O9 | sing | 1.46Å | 1.43Å | |
| C28 | C30 | sing | 1.52Å | 1.52Å | |
| C12 | O10 | sing | 1.44Å | 1.43Å | |
| C10 | C37 | sing | 1.55Å | 1.52Å | |
| C24 | H1 | sing | 1.09Å | 1.10Å | |
| C24 | H2 | sing | 1.09Å | 1.10Å | |
| C24 | H3 | sing | 1.09Å | 1.10Å | |
| N5 | H4 | sing | 0.97Å | 1.00Å | |
| N4 | H5 | sing | 0.97Å | 1.00Å | |
| N3 | H6 | sing | 0.97Å | 1.00Å | |
| N2 | H7 | sing | 0.97Å | 1.00Å | |
| 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 | |
| N1 | H12 | sing | 0.97Å | 1.00Å | |
| C3 | H13 | sing | 1.09Å | 1.10Å | |
| C4 | H14 | sing | 1.16Å | 1.10Å | |
| C34 | H15 | sing | 1.09Å | 1.10Å | |
| C34 | H16 | sing | 1.09Å | 1.10Å | |
| C34 | H17 | sing | 1.09Å | 1.10Å | |
| C2 | H18 | sing | 1.04Å | 1.10Å | |
| C33 | H19 | sing | 1.09Å | 1.10Å | |
| C33 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.09Å | 1.10Å | |
| C13 | H22 | sing | 1.16Å | 1.10Å | |
| C31 | H23 | sing | 1.09Å | 1.10Å | |
| C31 | H24 | sing | 1.09Å | 1.10Å | |
| C32 | H25 | sing | 1.09Å | 1.10Å | |
| C32 | H26 | sing | 1.09Å | 1.10Å | |
| C32 | H27 | sing | 1.09Å | 1.10Å | |
| O10 | H28 | sing | 0.97Å | 0.95Å | |
| C38 | H29 | sing | 1.09Å | 1.10Å | |
| C38 | H30 | sing | 1.09Å | 1.10Å | |
| C38 | H31 | sing | 1.09Å | 1.10Å | |
| C11 | H32 | sing | 1.16Å | 1.10Å | |
| C10 | H33 | sing | 1.11Å | 1.10Å | |
| C37 | H34 | sing | 1.09Å | 1.10Å | |
| C37 | H35 | sing | 1.09Å | 1.10Å | |
| C37 | H36 | sing | 1.09Å | 1.10Å | |
| C29 | H37 | sing | 1.09Å | 1.10Å | |
| C29 | H38 | sing | 1.09Å | 1.10Å | |
| C29 | H39 | sing | 1.09Å | 1.10Å | |
| C30 | H40 | sing | 1.09Å | 1.10Å | |
| C30 | H41 | sing | 1.09Å | 1.10Å | |
| C30 | H42 | sing | 1.09Å | 1.10Å | |
| C9 | H43 | sing | 1.08Å | 1.10Å | |
| C8 | H44 | sing | 1.12Å | 1.10Å | |
| C36 | H45 | sing | 1.09Å | 1.10Å | |
| C36 | H46 | sing | 1.09Å | 1.10Å | |
| C36 | H47 | sing | 1.09Å | 1.10Å | |
| C7 | H48 | sing | 1.03Å | 1.10Å | |
| C7 | H49 | sing | 1.07Å | 1.10Å | |
| O7 | H50 | sing | 0.97Å | 0.95Å | |
| C35 | H51 | sing | 1.09Å | 1.10Å | |
| C35 | H52 | sing | 1.09Å | 1.10Å | |
| C35 | H53 | sing | 1.09Å | 1.10Å | |
| C5 | H54 | sing | 1.11Å | 1.10Å | |
| C25 | H55 | sing | 1.09Å | 1.10Å | |
| C25 | H56 | sing | 1.09Å | 1.10Å | |
| C27 | H57 | sing | 1.05Å | 1.06Å | |
| C17 | H58 | sing | 1.09Å | 1.10Å | |
| C17 | H59 | sing | 1.09Å | 1.10Å | |
| C18 | H60 | sing | 1.09Å | 1.10Å | |
| C18 | H61 | sing | 1.09Å | 1.10Å | |
| C19 | H62 | sing | 1.09Å | 1.10Å | |
| C19 | H63 | sing | 1.09Å | 1.10Å | |
| C20 | H64 | sing | 1.09Å | 1.10Å | |
| C20 | H65 | sing | 1.09Å | 1.10Å | |
| C21 | H66 | sing | 1.09Å | 1.10Å | |
| C21 | H67 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | N5 | C23 | 123.3° | 120.0° |
| N5 | C24 | H1 | 109.5° | 109.5° |
| N5 | C24 | H2 | 109.5° | 109.5° |
| N5 | C24 | H3 | 109.5° | 109.5° |
| C24 | N5 | H4 | 118.3° | 120.0° |
| O5 | C23 | N5 | 120.3° | 120.0° |
| O5 | C23 | N4 | 126.6° | 120.0° |
| N5 | C23 | N4 | 113.1° | 120.0° |
| C23 | N5 | H4 | 118.4° | 120.0° |
| C23 | N4 | C22 | 125.5° | 120.0° |
| C23 | N4 | H5 | 117.2° | 120.0° |
| N3 | C22 | N4 | 125.0° | 120.0° |
| N3 | C22 | N2 | 117.0° | 120.0° |
| C22 | N3 | H6 | 112.0° | 120.0° |
| N4 | C22 | N2 | 117.7° | 120.0° |
| C22 | N4 | H5 | 117.2° | 120.0° |
| C22 | N2 | C21 | 120.8° | 120.0° |
| C22 | N2 | H7 | 119.6° | 120.0° |
| C19 | C18 | C17 | 113.1° | 109.4° |
| C18 | C19 | C20 | 113.8° | 109.4° |
| C19 | C18 | H60 | 108.6° | 109.5° |
| C19 | C18 | H61 | 108.5° | 109.5° |
| C18 | C19 | H62 | 108.4° | 109.5° |
| C18 | C19 | H63 | 108.4° | 109.5° |
| C18 | C17 | C16 | 110.4° | 109.5° |
| C18 | C17 | H58 | 109.3° | 109.5° |
| C18 | C17 | H59 | 109.3° | 109.4° |
| C17 | C18 | H60 | 108.5° | 109.5° |
| C17 | C18 | H61 | 108.6° | 109.4° |
| C19 | C20 | C21 | 112.4° | 109.4° |
| C20 | C19 | H62 | 108.4° | 109.4° |
| C20 | C19 | H63 | 108.4° | 109.5° |
| C19 | C20 | H64 | 108.8° | 109.5° |
| C19 | C20 | H65 | 108.7° | 109.5° |
| C17 | C16 | C15 | 112.3° | 109.5° |
| C17 | C16 | H8 | 108.8° | 109.5° |
| C17 | C16 | H9 | 108.8° | 109.4° |
| C16 | C17 | H58 | 109.2° | 109.5° |
| C16 | C17 | H59 | 109.3° | 109.4° |
| N2 | C21 | C20 | 114.3° | 109.4° |
| C21 | N2 | H7 | 119.6° | 120.1° |
| N2 | C21 | H66 | 108.3° | 109.5° |
| N2 | C21 | H67 | 108.2° | 109.4° |
| C16 | C15 | N1 | 108.1° | 109.5° |
| C15 | C16 | H8 | 108.7° | 109.5° |
| C15 | C16 | H9 | 108.7° | 109.4° |
| C16 | C15 | H10 | 109.8° | 109.4° |
| C16 | C15 | H11 | 109.8° | 109.5° |
| C15 | N1 | C14 | 121.0° | 120.0° |
| N1 | C15 | H10 | 109.8° | 109.4° |
| N1 | C15 | H11 | 109.8° | 109.5° |
| C15 | N1 | H12 | 119.5° | 120.0° |
| C21 | C20 | H64 | 108.7° | 109.5° |
| C21 | C20 | H65 | 108.7° | 109.5° |
| C20 | C21 | H66 | 108.2° | 109.5° |
| C20 | C21 | H67 | 108.2° | 109.5° |
| N1 | C14 | O4 | 121.4° | 120.0° |
| N1 | C14 | O3 | 117.3° | 120.0° |
| C14 | N1 | H12 | 119.5° | 120.0° |
| O4 | C14 | O3 | 120.9° | 120.0° |
| C14 | O3 | C3 | 119.0° | 117.0° |
| C27 | C26 | C25 | 178.9° | 180.0° |
| C26 | C27 | H57 | 180.0° | 179.9° |
| C26 | C25 | O6 | 110.7° | 109.5° |
| C26 | C25 | H55 | 109.1° | 109.5° |
| C26 | C25 | H56 | 109.1° | 109.5° |
| C25 | O6 | C5 | 116.6° | 114.0° |
| O6 | C25 | H55 | 109.2° | 109.4° |
| O6 | C25 | H56 | 109.2° | 109.5° |
| O3 | C3 | C2 | 113.1° | 109.1° |
| O3 | C3 | C4 | 105.7° | 108.8° |
| O3 | C3 | H13 | 108.7° | 105.9° |
| C33 | C2 | C3 | 117.1° | 116.1° |
| C33 | C2 | C1 | 106.1° | 110.1° |
| C33 | C2 | H18 | 106.8° | 109.7° |
| C2 | C33 | H19 | 109.5° | 109.5° |
| C2 | C33 | H20 | 109.5° | 109.5° |
| C2 | C33 | H21 | 109.4° | 109.5° |
| C2 | C3 | C4 | 114.4° | 120.0° |
| C3 | C2 | C1 | 112.6° | 112.5° |
| C2 | C3 | H13 | 107.2° | 103.9° |
| C3 | C2 | H18 | 106.5° | 103.4° |
| C3 | C4 | C5 | 112.8° | 113.5° |
| C3 | C4 | C34 | 111.6° | 114.2° |
| C4 | C3 | H13 | 107.4° | 108.1° |
| C3 | C4 | H14 | 107.1° | 103.6° |
| O6 | C5 | C4 | 110.2° | 110.7° |
| O6 | C5 | C6 | 109.0° | 110.1° |
| O6 | C5 | H54 | 108.4° | 106.2° |
| C4 | C5 | C6 | 114.8° | 117.8° |
| C5 | C4 | C34 | 110.6° | 114.7° |
| C5 | C4 | H14 | 107.1° | 102.7° |
| C4 | C5 | H54 | 107.1° | 103.4° |
| C5 | C6 | C35 | 110.8° | 110.2° |
| C5 | C6 | O7 | 108.8° | 108.9° |
| C5 | C6 | C7 | 111.6° | 105.8° |
| C6 | C5 | H54 | 107.1° | 107.8° |
| C2 | C1 | O1 | 121.2° | 123.8° |
| C2 | C1 | O2 | 117.6° | 118.9° |
| C1 | C2 | H18 | 107.2° | 104.0° |
| C34 | C4 | H14 | 107.3° | 106.5° |
| C4 | C34 | H15 | 109.5° | 109.5° |
| C4 | C34 | H16 | 109.5° | 109.5° |
| C4 | C34 | H17 | 109.5° | 109.5° |
| C35 | C6 | O7 | 107.3° | 108.4° |
| C35 | C6 | C7 | 109.2° | 108.8° |
| C6 | C35 | H51 | 109.5° | 109.5° |
| C6 | C35 | H52 | 109.5° | 109.4° |
| C6 | C35 | H53 | 109.4° | 109.5° |
| O7 | C6 | C7 | 109.0° | 114.7° |
| C6 | O7 | H50 | 109.5° | 114.0° |
| C6 | C7 | C8 | 114.5° | 111.4° |
| C6 | C7 | H48 | 108.2° | 109.4° |
| C6 | C7 | H49 | 108.2° | 106.5° |
| O1 | C1 | O2 | 121.1° | 117.3° |
| C1 | O2 | C13 | 118.6° | 120.3° |
| C7 | C8 | C36 | 109.9° | 110.9° |
| C7 | C8 | C9 | 112.9° | 107.9° |
| C7 | C8 | H44 | 107.4° | 111.5° |
| C8 | C7 | H48 | 108.2° | 110.6° |
| C8 | C7 | H49 | 108.2° | 101.8° |
| O2 | C13 | C31 | 111.1° | 110.3° |
| O2 | C13 | C12 | 106.7° | 116.6° |
| O2 | C13 | H22 | 109.1° | 103.0° |
| C36 | C8 | C9 | 111.6° | 110.3° |
| C36 | C8 | H44 | 107.4° | 105.5° |
| C8 | C36 | H45 | 109.5° | 109.5° |
| C8 | C36 | H46 | 109.5° | 109.5° |
| C8 | C36 | H47 | 109.5° | 109.4° |
| C8 | C9 | O8 | 112.1° | 105.7° |
| C8 | C9 | C10 | 110.8° | 114.0° |
| C8 | C9 | H43 | 106.8° | 106.8° |
| C9 | C8 | H44 | 107.3° | 110.7° |
| C29 | C28 | O8 | 109.1° | 108.6° |
| C29 | C28 | O9 | 110.5° | 112.6° |
| C29 | C28 | C30 | 104.8° | 108.7° |
| C28 | C29 | H37 | 109.5° | 109.5° |
| C28 | C29 | H38 | 109.5° | 109.4° |
| C28 | C29 | H39 | 109.5° | 109.5° |
| C31 | C13 | C12 | 114.4° | 113.9° |
| C13 | C31 | C32 | 112.3° | 109.5° |
| C31 | C13 | H22 | 107.7° | 102.8° |
| C13 | C31 | H23 | 108.7° | 109.5° |
| C13 | C31 | H24 | 108.8° | 109.5° |
| C13 | C12 | C38 | 112.7° | 110.5° |
| C13 | C12 | C11 | 105.7° | 116.3° |
| C13 | C12 | O10 | 108.9° | 109.8° |
| C12 | C13 | H22 | 107.7° | 108.8° |
| C9 | O8 | C28 | 119.7° | 117.7° |
| O8 | C9 | C10 | 112.0° | 108.1° |
| O8 | C9 | H43 | 107.9° | 109.8° |
| O8 | C28 | O9 | 111.1° | 111.0° |
| O8 | C28 | C30 | 112.9° | 106.2° |
| C38 | C12 | C11 | 112.2° | 107.1° |
| C38 | C12 | O10 | 106.8° | 106.8° |
| C12 | C38 | H29 | 109.5° | 109.5° |
| C12 | C38 | H30 | 109.4° | 109.5° |
| C12 | C38 | H31 | 109.5° | 109.4° |
| C32 | C31 | H23 | 108.8° | 109.5° |
| C32 | C31 | H24 | 108.8° | 109.4° |
| C31 | C32 | H25 | 109.5° | 109.5° |
| C31 | C32 | H26 | 109.5° | 109.5° |
| C31 | C32 | H27 | 109.5° | 109.4° |
| C12 | C11 | C10 | 115.6° | 122.0° |
| C12 | C11 | O9 | 111.3° | 107.4° |
| C11 | C12 | O10 | 110.6° | 105.8° |
| C12 | C11 | H32 | 105.9° | 103.8° |
| C10 | C11 | O9 | 110.4° | 110.8° |
| C11 | C10 | C9 | 108.8° | 111.6° |
| C11 | C10 | C37 | 114.5° | 112.7° |
| C10 | C11 | H32 | 106.0° | 108.4° |
| C11 | C10 | H33 | 107.5° | 111.2° |
| C11 | O9 | C28 | 115.3° | 115.5° |
| O9 | C11 | H32 | 107.0° | 102.6° |
| C9 | C10 | C37 | 110.7° | 111.7° |
| C9 | C10 | H33 | 107.5° | 106.4° |
| C10 | C9 | H43 | 107.0° | 112.2° |
| O9 | C28 | C30 | 108.2° | 109.5° |
| C28 | C30 | H40 | 109.5° | 109.5° |
| C28 | C30 | H41 | 109.4° | 109.4° |
| C28 | C30 | H42 | 109.5° | 109.5° |
| C12 | O10 | H28 | 109.5° | 114.0° |
| C37 | C10 | H33 | 107.6° | 102.7° |
| C10 | C37 | H34 | 109.5° | 109.5° |
| C10 | C37 | H35 | 109.5° | 109.4° |
| C10 | C37 | H36 | 109.5° | 109.5° |
| H1 | C24 | H2 | 109.5° | 109.4° |
| H1 | C24 | H3 | 109.4° | 109.5° |
| H2 | C24 | H3 | 109.5° | 109.5° |
| H8 | C16 | H9 | 109.5° | 109.5° |
| H10 | C15 | H11 | 109.5° | 109.5° |
| H15 | C34 | H16 | 109.5° | 109.5° |
| H15 | C34 | H17 | 109.5° | 109.4° |
| H16 | C34 | H17 | 109.5° | 109.5° |
| H19 | C33 | H20 | 109.5° | 109.4° |
| H19 | C33 | H21 | 109.5° | 109.5° |
| H20 | C33 | H21 | 109.5° | 109.5° |
| H23 | C31 | H24 | 109.5° | 109.5° |
| H25 | C32 | H26 | 109.5° | 109.5° |
| H25 | C32 | H27 | 109.5° | 109.5° |
| H26 | C32 | H27 | 109.5° | 109.5° |
| H29 | C38 | H30 | 109.5° | 109.5° |
| H29 | C38 | H31 | 109.5° | 109.5° |
| H30 | C38 | H31 | 109.5° | 109.5° |
| H34 | C37 | H35 | 109.4° | 109.5° |
| H34 | C37 | H36 | 109.5° | 109.5° |
| H35 | C37 | H36 | 109.5° | 109.5° |
| H37 | C29 | H38 | 109.5° | 109.5° |
| H37 | C29 | H39 | 109.4° | 109.4° |
| H38 | C29 | H39 | 109.5° | 109.4° |
| H40 | C30 | H41 | 109.5° | 109.5° |
| H40 | C30 | H42 | 109.5° | 109.5° |
| H41 | C30 | H42 | 109.5° | 109.4° |
| H45 | C36 | H46 | 109.4° | 109.4° |
| H45 | C36 | H47 | 109.5° | 109.5° |
| H46 | C36 | H47 | 109.4° | 109.5° |
| H48 | C7 | H49 | 109.5° | 116.9° |
| H51 | C35 | H52 | 109.4° | 109.5° |
| H51 | C35 | H53 | 109.4° | 109.5° |
| H52 | C35 | H53 | 109.5° | 109.4° |
| H55 | C25 | H56 | 109.5° | 109.5° |
| H58 | C17 | H59 | 109.5° | 109.5° |
| H60 | C18 | H61 | 109.5° | 109.5° |
| H62 | C19 | H63 | 109.5° | 109.5° |
| H64 | C20 | H65 | 109.5° | 109.5° |
| H66 | C21 | H67 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | N5 | C23 | O5 | 1.3° | 0.1° |
| C24 | N5 | C23 | H4 | 180.0° | 180.0° |
| C24 | N5 | C23 | N4 | 178.8° | 180.0° |
| N5 | C24 | H1 | H2 | 120.0° | 120.0° |
| N5 | C24 | H1 | H3 | 120.0° | 120.0° |
| N5 | C24 | H2 | H3 | 120.0° | 120.0° |
| O5 | C23 | N5 | N4 | 177.5° | 179.9° |
| O5 | C23 | N4 | C22 | 1.0° | 0.0° |
| O5 | C23 | N5 | H4 | 178.7° | 180.0° |
| O5 | C23 | N4 | H5 | 179.1° | 180.0° |
| N5 | C23 | N4 | C22 | 178.3° | 180.0° |
| C23 | N5 | C24 | H1 | 180.0° | 59.9° |
| C23 | N5 | C24 | H2 | 60.0° | 60.0° |
| C23 | N5 | C24 | H3 | 60.0° | 180.0° |
| N5 | C23 | N4 | H5 | 1.8° | 0.0° |
| C23 | N4 | C22 | N3 | 8.8° | 0.0° |
| C23 | N4 | C22 | H5 | 180.0° | 180.0° |
| C23 | N4 | C22 | N2 | 164.6° | 180.0° |
| N4 | C23 | N5 | H4 | 1.2° | 0.0° |
| N3 | C22 | N4 | N2 | 173.4° | 180.0° |
| N3 | C22 | N2 | C21 | 14.8° | 0.0° |
| N3 | C22 | N4 | H5 | 171.2° | 180.0° |
| N3 | C22 | N2 | H7 | 165.2° | 180.0° |
| N4 | C22 | N2 | C21 | 159.2° | 180.0° |
| N4 | C22 | N3 | H6 | 173.4° | 180.0° |
| N4 | C22 | N2 | H7 | 20.9° | 0.0° |
| C22 | N2 | C21 | H7 | 180.0° | 180.0° |
| C22 | N2 | C21 | C20 | 112.9° | 180.0° |
| N2 | C22 | N4 | H5 | 15.4° | 0.0° |
| N2 | C22 | N3 | H6 | 0.0° | 0.0° |
| C22 | N2 | C21 | H66 | 126.3° | 60.0° |
| C22 | N2 | C21 | H67 | 7.7° | 60.0° |
| C19 | C18 | C17 | H60 | 120.6° | 120.1° |
| C19 | C18 | C17 | H61 | 120.5° | 120.0° |
| C18 | C19 | C20 | H62 | 120.6° | 120.0° |
| C18 | C19 | C20 | H63 | 120.7° | 120.0° |
| C19 | C18 | C17 | C16 | 124.7° | 180.0° |
| C18 | C19 | C20 | C21 | 153.2° | 180.0° |
| C19 | C18 | C17 | H58 | 4.6° | 59.9° |
| C19 | C18 | C17 | H59 | 115.2° | 60.0° |
| C19 | C18 | H60 | H61 | 118.3° | 120.0° |
| C18 | C19 | H62 | H63 | 118.0° | 120.0° |
| C18 | C19 | C20 | H64 | 86.4° | 60.0° |
| C18 | C19 | C20 | H65 | 32.8° | 60.0° |
| C17 | C18 | C19 | C20 | 93.5° | 180.0° |
| C18 | C17 | C16 | H58 | 120.1° | 120.1° |
| C18 | C17 | C16 | H59 | 120.1° | 119.9° |
| C18 | C17 | C16 | C15 | 146.3° | NaN° |
| C18 | C17 | C16 | H8 | 25.9° | 59.9° |
| C18 | C17 | C16 | H9 | 93.2° | 60.1° |
| C18 | C17 | H58 | H59 | 119.6° | 120.0° |
| C17 | C18 | H60 | H61 | 118.3° | 120.0° |
| C17 | C18 | C19 | H62 | 145.8° | 60.0° |
| C17 | C18 | C19 | H63 | 27.1° | 60.1° |
| C19 | C20 | C21 | N2 | 63.7° | 180.0° |
| C19 | C20 | C21 | H64 | 120.5° | 120.0° |
| C19 | C20 | C21 | H65 | 120.4° | 120.0° |
| C20 | C19 | C18 | H60 | 145.9° | 60.0° |
| C20 | C19 | C18 | H61 | 27.0° | 60.0° |
| C20 | C19 | H62 | H63 | 118.0° | 120.0° |
| C19 | C20 | H64 | H65 | 118.6° | 120.0° |
| C19 | C20 | C21 | H66 | 175.6° | 60.0° |
| C19 | C20 | C21 | H67 | 57.0° | 60.0° |
| C17 | C16 | C15 | H8 | 120.4° | 120.1° |
| C17 | C16 | C15 | H9 | 120.4° | 119.9° |
| C17 | C16 | C15 | N1 | 174.1° | 180.0° |
| C17 | C16 | H8 | H9 | 118.7° | 120.0° |
| C17 | C16 | C15 | H10 | 54.3° | 60.1° |
| C17 | C16 | C15 | H11 | 66.1° | 59.9° |
| C16 | C17 | H58 | H59 | 119.6° | 120.0° |
| C16 | C17 | C18 | H60 | 114.8° | 59.9° |
| C16 | C17 | C18 | H61 | 4.2° | 60.1° |
| N2 | C21 | C20 | H66 | 120.7° | 120.0° |
| N2 | C21 | C20 | H67 | 120.7° | 119.9° |
| N2 | C21 | C20 | H64 | 175.9° | 60.0° |
| N2 | C21 | C20 | H65 | 56.7° | 60.0° |
| N2 | C21 | H66 | H67 | 117.8° | 120.0° |
| C16 | C15 | N1 | H10 | 119.8° | 119.9° |
| C16 | C15 | N1 | H11 | 119.8° | 120.1° |
| C16 | C15 | N1 | C14 | 72.9° | 180.0° |
| C15 | C16 | H8 | H9 | 118.7° | 120.0° |
| C16 | C15 | H10 | H11 | 120.6° | 120.0° |
| C16 | C15 | N1 | H12 | 107.1° | 0.1° |
| C15 | C16 | C17 | H58 | 93.5° | 59.9° |
| C15 | C16 | C17 | H59 | 26.2° | 60.1° |
| C15 | N1 | C14 | H12 | 180.0° | 179.9° |
| C15 | N1 | C14 | O4 | 19.5° | 0.0° |
| C15 | N1 | C14 | O3 | 153.6° | 180.0° |
| N1 | C15 | C16 | H8 | 65.5° | 59.9° |
| N1 | C15 | C16 | H9 | 53.7° | 60.0° |
| N1 | C15 | H10 | H11 | 120.7° | 120.0° |
| C20 | C21 | N2 | H7 | 67.0° | 0.0° |
| C21 | C20 | C19 | H62 | 32.6° | 60.0° |
| C21 | C20 | C19 | H63 | 86.2° | 60.0° |
| C21 | C20 | H64 | H65 | 118.7° | 120.0° |
| C20 | C21 | H66 | H67 | 117.8° | 120.1° |
| N1 | C14 | O4 | O3 | 172.9° | 180.0° |
| N1 | C14 | O3 | C3 | 176.5° | 180.0° |
| C14 | N1 | C15 | H10 | 46.9° | 60.0° |
| C14 | N1 | C15 | H11 | 167.4° | 60.0° |
| O4 | C14 | O3 | C3 | 3.3° | 0.0° |
| O4 | C14 | N1 | H12 | 160.5° | 180.0° |
| C14 | O3 | C3 | C2 | 85.8° | 90.0° |
| C14 | O3 | C3 | C4 | 148.2° | 137.4° |
| O3 | C14 | N1 | H12 | 26.3° | 0.0° |
| C14 | O3 | C3 | H13 | 33.2° | 21.3° |
| C27 | C26 | C25 | O6 | 173.3° | 165.8° |
| C27 | C26 | C25 | H55 | 53.1° | 45.8° |
| C27 | C26 | C25 | H56 | 66.5° | 74.2° |
| C26 | C25 | O6 | H55 | 120.2° | 120.0° |
| C26 | C25 | O6 | H56 | 120.2° | 120.0° |
| C26 | C25 | O6 | C5 | 154.1° | 154.8° |
| C26 | C25 | H55 | H56 | 119.4° | 120.0° |
| C25 | C26 | C27 | H57 | 112.1° | 131.7° |
| C25 | O6 | C5 | C4 | 100.5° | 75.9° |
| C25 | O6 | C5 | C6 | 132.7° | 152.1° |
| C25 | O6 | C5 | H54 | 16.5° | 35.7° |
| O6 | C25 | H55 | H56 | 119.5° | 120.0° |
| O3 | C3 | C2 | C33 | 68.4° | 152.8° |
| O3 | C3 | C2 | C4 | 121.2° | 126.5° |
| O3 | C3 | C2 | H13 | 119.8° | 112.6° |
| O3 | C3 | C4 | H13 | 115.9° | 114.6° |
| O3 | C3 | C4 | C5 | 62.8° | 62.5° |
| O3 | C3 | C2 | C1 | 168.2° | 24.6° |
| O3 | C3 | C4 | C34 | 62.5° | 163.5° |
| O3 | C3 | C4 | H14 | 179.6° | 48.1° |
| O3 | C3 | C2 | H18 | 51.0° | 87.0° |
| C33 | C2 | C3 | C1 | 123.5° | 128.2° |
| C33 | C2 | C3 | H18 | 119.3° | 120.2° |
| C33 | C2 | C3 | C4 | 170.4° | 26.3° |
| C33 | C2 | C1 | H18 | 113.8° | 117.4° |
| C33 | C2 | C1 | O1 | 28.6° | 162.1° |
| C33 | C2 | C1 | O2 | 148.4° | 18.5° |
| C33 | C2 | C3 | H13 | 51.5° | 94.6° |
| C2 | C33 | H19 | H20 | 120.0° | 120.0° |
| C2 | C33 | H19 | H21 | 120.0° | 120.0° |
| C2 | C33 | H20 | H21 | 120.0° | 120.0° |
| C2 | C3 | C4 | H13 | 118.9° | 118.8° |
| C2 | C3 | C4 | C5 | 172.0° | 64.1° |
| C3 | C2 | C1 | H18 | 116.8° | 111.3° |
| C2 | C3 | C4 | C34 | 62.7° | 69.9° |
| C3 | C2 | C1 | O1 | 100.8° | 66.7° |
| C3 | C2 | C1 | O2 | 82.3° | 112.8° |
| C2 | C3 | C4 | H14 | 54.4° | 174.7° |
| C3 | C2 | C33 | H19 | 180.0° | 60.0° |
| C3 | C2 | C33 | H20 | 60.0° | 179.9° |
| C3 | C2 | C33 | H21 | 60.0° | 60.0° |
| C3 | C4 | C5 | O6 | 113.3° | 12.5° |
| C3 | C4 | C5 | C34 | 125.9° | 133.7° |
| C3 | C4 | C5 | H14 | 117.5° | 111.2° |
| C3 | C4 | C5 | C6 | 123.2° | 140.4° |
| C4 | C3 | C2 | C1 | 47.0° | 101.9° |
| C3 | C4 | C34 | H14 | 117.0° | 113.7° |
| C3 | C4 | C34 | H15 | 180.0° | 36.1° |
| C3 | C4 | C34 | H16 | 60.0° | 156.1° |
| C3 | C4 | C34 | H17 | 60.0° | 83.8° |
| C4 | C3 | C2 | H18 | 70.2° | 146.5° |
| C3 | C4 | C5 | H54 | 4.4° | 100.9° |
| O6 | C5 | C4 | C6 | 123.5° | 128.0° |
| O6 | C5 | C4 | H54 | 117.8° | 113.3° |
| O6 | C5 | C6 | H54 | 117.1° | 115.4° |
| O6 | C5 | C4 | C34 | 12.5° | 121.3° |
| O6 | C5 | C6 | C35 | 66.2° | 166.7° |
| O6 | C5 | C6 | O7 | 176.1° | 74.5° |
| O6 | C5 | C6 | C7 | 55.8° | 49.3° |
| O6 | C5 | C4 | H14 | 129.1° | 123.6° |
| C5 | O6 | C25 | H55 | 85.7° | 85.3° |
| C5 | O6 | C25 | H56 | 34.0° | 34.8° |
| C4 | C5 | C6 | H54 | 118.8° | 116.3° |
| C5 | C4 | C34 | H14 | 116.5° | 112.9° |
| C4 | C5 | C6 | C35 | 169.7° | 65.0° |
| C4 | C5 | C6 | O7 | 52.0° | 53.7° |
| C4 | C5 | C6 | C7 | 68.4° | 177.5° |
| C5 | C4 | C3 | H13 | 53.1° | 177.1° |
| C5 | C4 | C34 | H15 | 53.5° | 169.5° |
| C5 | C4 | C34 | H16 | 66.5° | 70.5° |
| C5 | C4 | C34 | H17 | 173.5° | 49.5° |
| C6 | C5 | C4 | C34 | 110.9° | 6.7° |
| C5 | C6 | C35 | O7 | 118.7° | 119.1° |
| C5 | C6 | C35 | C7 | 123.3° | 115.5° |
| C5 | C6 | O7 | C7 | 121.9° | 118.3° |
| C5 | C6 | C7 | C8 | 168.6° | 112.0° |
| C6 | C5 | C4 | H14 | 5.6° | 108.4° |
| C5 | C6 | C7 | H48 | 70.7° | 10.6° |
| C5 | C6 | C7 | H49 | 47.8° | 137.9° |
| C5 | C6 | O7 | H50 | 180.0° | 178.3° |
| C5 | C6 | C35 | H51 | 180.0° | 34.0° |
| C5 | C6 | C35 | H52 | 60.0° | 86.0° |
| C5 | C6 | C35 | H53 | 60.0° | 154.0° |
| C2 | C1 | O1 | O2 | 176.8° | 179.5° |
| C2 | C1 | O2 | C13 | 174.8° | 174.6° |
| C1 | C2 | C3 | H13 | 72.0° | 137.3° |
| C1 | C2 | C33 | H19 | 53.3° | 69.3° |
| C1 | C2 | C33 | H20 | 173.3° | 50.6° |
| C1 | C2 | C33 | H21 | 66.7° | 170.7° |
| C34 | C4 | C3 | H13 | 178.5° | 48.9° |
| C4 | C34 | H15 | H16 | 120.0° | 120.0° |
| C4 | C34 | H15 | H17 | 120.0° | 120.0° |
| C4 | C34 | H16 | H17 | 120.0° | 120.0° |
| C34 | C4 | C5 | H54 | 130.3° | 125.4° |
| C35 | C6 | O7 | C7 | 118.1° | 121.8° |
| C35 | C6 | C7 | C8 | 68.5° | 129.7° |
| C35 | C6 | C7 | H48 | 52.2° | 107.7° |
| C35 | C6 | C7 | H49 | 170.7° | 19.5° |
| C35 | C6 | O7 | H50 | 60.0° | 61.9° |
| C6 | C35 | H51 | H52 | 120.0° | 120.0° |
| C6 | C35 | H51 | H53 | 120.0° | 120.0° |
| C6 | C35 | H52 | H53 | 120.0° | 120.0° |
| C35 | C6 | C5 | H54 | 50.9° | 51.3° |
| O7 | C6 | C7 | C8 | 48.3° | 8.1° |
| O7 | C6 | C7 | H48 | 169.1° | 130.7° |
| O7 | C6 | C7 | H49 | 72.4° | 102.1° |
| O7 | C6 | C35 | H51 | 61.3° | 85.0° |
| O7 | C6 | C35 | H52 | 58.7° | 154.9° |
| O7 | C6 | C35 | H53 | 178.7° | 35.0° |
| O7 | C6 | C5 | H54 | 66.8° | 170.0° |
| C6 | C7 | C8 | H48 | 120.7° | 121.9° |
| C6 | C7 | C8 | H49 | 120.8° | 113.2° |
| C6 | C7 | C8 | C36 | 148.8° | 130.7° |
| C6 | C7 | C8 | C9 | 86.0° | 108.4° |
| C6 | C7 | C8 | H44 | 32.2° | 13.4° |
| C6 | C7 | H48 | H49 | 117.7° | 121.1° |
| C7 | C6 | O7 | H50 | 58.1° | 60.0° |
| C7 | C6 | C35 | H51 | 56.6° | 149.6° |
| C7 | C6 | C35 | H52 | 176.6° | 29.5° |
| C7 | C6 | C35 | H53 | 63.3° | 90.4° |
| C7 | C6 | C5 | H54 | 172.9° | 66.1° |
| O1 | C1 | O2 | C13 | 2.1° | 5.9° |
| O1 | C1 | C2 | H18 | 142.4° | 44.6° |
| C1 | O2 | C13 | C31 | 97.2° | 75.7° |
| C1 | O2 | C13 | C12 | 137.5° | 152.5° |
| O2 | C1 | C2 | H18 | 34.6° | 135.9° |
| C1 | O2 | C13 | H22 | 21.4° | 33.4° |
| C7 | C8 | C36 | C9 | 126.1° | 119.5° |
| C7 | C8 | C36 | H44 | 116.6° | 120.9° |
| C7 | C8 | C9 | H44 | 118.2° | 122.2° |
| C7 | C8 | C9 | O8 | 71.0° | 96.4° |
| C7 | C8 | C9 | C10 | 54.9° | 144.9° |
| C7 | C8 | C9 | H43 | 171.1° | 20.4° |
| C7 | C8 | C36 | H45 | 180.0° | 179.4° |
| C7 | C8 | C36 | H46 | 60.0° | 60.6° |
| C7 | C8 | C36 | H47 | 60.0° | 59.4° |
| C8 | C7 | H48 | H49 | 117.7° | 115.8° |
| O2 | C13 | C31 | C12 | 120.9° | 133.3° |
| O2 | C13 | C31 | H22 | 119.4° | 109.3° |
| O2 | C13 | C12 | H22 | 117.0° | 115.9° |
| O2 | C13 | C12 | C38 | 46.9° | 163.3° |
| O2 | C13 | C31 | C32 | 109.2° | 81.9° |
| O2 | C13 | C12 | C11 | 76.0° | 74.4° |
| O2 | C13 | C12 | O10 | 165.2° | 45.7° |
| O2 | C13 | C31 | H23 | 130.4° | 158.1° |
| O2 | C13 | C31 | H24 | 11.2° | 38.1° |
| C36 | C8 | C9 | H44 | 117.4° | 116.4° |
| C36 | C8 | C9 | O8 | 164.6° | 24.9° |
| C36 | C8 | C9 | C10 | 69.5° | 93.8° |
| C36 | C8 | C9 | H43 | 46.7° | 141.7° |
| C8 | C36 | H45 | H46 | 120.0° | 120.0° |
| C8 | C36 | H45 | H47 | 120.0° | 120.0° |
| C8 | C36 | H46 | H47 | 120.0° | 120.0° |
| C36 | C8 | C7 | H48 | 28.0° | 107.3° |
| C36 | C8 | C7 | H49 | 90.5° | 17.5° |
| C8 | C9 | O8 | C10 | 125.3° | 122.4° |
| C8 | C9 | O8 | H43 | 117.3° | 114.8° |
| C8 | C9 | O8 | C28 | 167.5° | 162.3° |
| C8 | C9 | C10 | C11 | 117.6° | 179.6° |
| C8 | C9 | C10 | H43 | 116.1° | 121.5° |
| C8 | C9 | C10 | C37 | 115.8° | 52.5° |
| C8 | C9 | C10 | H33 | 1.5° | 58.9° |
| C9 | C8 | C36 | H45 | 54.0° | 60.0° |
| C9 | C8 | C36 | H46 | 173.9° | 180.0° |
| C9 | C8 | C36 | H47 | 66.1° | 60.1° |
| C9 | C8 | C7 | H48 | 153.3° | 13.6° |
| C9 | C8 | C7 | H49 | 34.8° | 138.4° |
| C29 | C28 | O8 | C9 | 165.3° | 108.1° |
| C29 | C28 | O8 | O9 | 122.1° | 124.2° |
| C29 | C28 | O8 | C30 | 116.2° | 116.8° |
| C29 | C28 | O9 | C11 | 111.7° | 66.6° |
| C29 | C28 | O9 | C30 | 114.2° | 121.1° |
| C28 | C29 | H37 | H38 | 120.0° | 120.0° |
| C28 | C29 | H37 | H39 | 120.0° | 120.0° |
| C28 | C29 | H38 | H39 | 120.0° | 120.0° |
| C29 | C28 | C30 | H40 | 180.0° | 63.4° |
| C29 | C28 | C30 | H41 | 60.0° | 56.6° |
| C29 | C28 | C30 | H42 | 60.0° | 176.6° |
| C31 | C13 | C12 | H22 | 119.7° | 113.9° |
| C31 | C13 | C12 | C38 | 76.4° | 66.6° |
| C13 | C31 | C32 | H23 | 120.4° | 120.0° |
| C13 | C31 | C32 | H24 | 120.4° | 120.0° |
| C31 | C13 | C12 | C11 | 160.7° | 55.8° |
| C31 | C13 | C12 | O10 | 41.9° | 175.9° |
| C13 | C31 | H23 | H24 | 118.7° | 120.0° |
| C13 | C31 | C32 | H25 | 180.0° | 154.2° |
| C13 | C31 | C32 | H26 | 60.0° | 85.7° |
| C13 | C31 | C32 | H27 | 60.0° | 34.3° |
| C13 | C12 | C38 | C11 | 119.2° | 127.6° |
| C13 | C12 | C38 | O10 | 119.5° | 119.4° |
| C12 | C13 | C31 | C32 | 129.9° | 144.9° |
| C13 | C12 | C11 | O10 | 117.7° | 122.3° |
| C13 | C12 | C11 | C10 | 171.1° | 59.2° |
| C13 | C12 | C11 | O9 | 61.9° | 70.1° |
| C12 | C13 | C31 | H23 | 9.5° | 24.8° |
| C12 | C13 | C31 | H24 | 109.7° | 95.2° |
| C13 | C12 | O10 | H28 | 180.0° | 60.0° |
| C13 | C12 | C38 | H29 | 180.0° | 60.0° |
| C13 | C12 | C38 | H30 | 60.0° | 180.0° |
| C13 | C12 | C38 | H31 | 60.0° | 60.0° |
| C13 | C12 | C11 | H32 | 54.1° | 178.3° |
| O8 | C9 | C10 | C11 | 8.4° | 63.2° |
| O8 | C9 | C10 | H43 | 118.0° | 121.2° |
| C9 | O8 | C28 | O9 | 43.2° | 16.1° |
| C9 | O8 | C28 | C30 | 78.5° | 135.1° |
| O8 | C9 | C10 | C37 | 118.3° | 169.7° |
| O8 | C9 | C10 | H33 | 124.5° | 58.4° |
| O8 | C9 | C8 | H44 | 47.2° | 141.3° |
| O8 | C28 | O9 | C11 | 9.5° | 55.4° |
| C28 | O8 | C9 | C10 | 42.3° | 39.9° |
| O8 | C28 | O9 | C30 | 124.5° | 117.0° |
| O8 | C28 | C29 | H37 | 180.0° | 63.3° |
| O8 | C28 | C29 | H38 | 60.0° | 56.7° |
| O8 | C28 | C29 | H39 | 60.0° | 176.7° |
| O8 | C28 | C30 | H40 | 61.3° | 179.9° |
| O8 | C28 | C30 | H41 | 178.7° | 60.1° |
| O8 | C28 | C30 | H42 | 58.7° | 59.8° |
| C28 | O8 | C9 | H43 | 75.2° | 82.8° |
| C38 | C12 | C11 | O10 | 119.1° | 113.7° |
| C38 | C12 | C11 | C10 | 47.9° | 176.7° |
| C38 | C12 | C11 | O9 | 174.9° | 53.9° |
| C38 | C12 | C13 | H22 | 163.9° | 47.4° |
| C38 | C12 | O10 | H28 | 58.1° | 59.8° |
| C12 | C38 | H29 | H30 | 120.0° | 120.0° |
| C12 | C38 | H29 | H31 | 120.0° | 119.9° |
| C12 | C38 | H30 | H31 | 120.0° | 119.9° |
| C38 | C12 | C11 | H32 | 69.1° | 54.3° |
| C32 | C31 | C13 | H22 | 10.2° | 27.4° |
| C32 | C31 | H23 | H24 | 118.7° | 119.9° |
| C31 | C32 | H25 | H26 | 120.0° | 120.1° |
| C31 | C32 | H25 | H27 | 120.0° | 119.9° |
| C31 | C32 | H26 | H27 | 120.0° | 119.9° |
| C12 | C11 | C10 | O9 | 127.4° | 127.8° |
| C12 | C11 | C10 | H32 | 117.0° | 120.3° |
| C12 | C11 | O9 | H32 | 115.3° | 109.1° |
| C12 | C11 | C10 | C9 | 176.1° | 101.0° |
| C12 | C11 | O9 | C28 | 171.3° | 166.9° |
| C12 | C11 | C10 | C37 | 59.5° | 25.5° |
| C11 | C12 | C13 | H22 | 41.0° | 169.7° |
| C11 | C12 | O10 | H28 | 64.2° | 173.7° |
| C11 | C12 | C38 | H29 | 60.8° | 172.4° |
| C11 | C12 | C38 | H30 | 59.2° | 52.4° |
| C11 | C12 | C38 | H31 | 179.2° | 67.6° |
| C12 | C11 | C10 | H33 | 60.0° | 140.2° |
| C10 | C11 | O9 | H32 | 115.0° | 115.5° |
| C11 | C10 | C9 | C37 | 126.7° | 127.1° |
| C11 | C10 | C9 | H33 | 116.1° | 121.5° |
| C10 | C11 | O9 | C28 | 59.0° | 31.5° |
| C10 | C11 | C12 | O10 | 71.1° | 63.0° |
| C11 | C10 | C37 | H33 | 119.4° | 119.8° |
| C11 | C10 | C37 | H34 | 180.0° | 60.4° |
| C11 | C10 | C37 | H35 | 60.0° | 179.7° |
| C11 | C10 | C37 | H36 | 60.0° | 59.7° |
| C11 | C10 | C9 | H43 | 126.3° | 58.0° |
| O9 | C11 | C10 | C9 | 56.5° | 26.8° |
| C11 | O9 | C28 | C30 | 134.0° | 172.4° |
| O9 | C11 | C12 | O10 | 55.8° | 167.6° |
| O9 | C11 | C10 | C37 | 68.0° | 153.4° |
| O9 | C11 | C10 | H33 | 172.6° | 91.9° |
| C9 | C10 | C37 | H33 | 117.1° | 113.7° |
| C9 | C10 | C11 | H32 | 59.1° | 138.7° |
| C9 | C10 | C37 | H34 | 56.6° | 66.2° |
| C9 | C10 | C37 | H35 | 176.5° | 53.8° |
| C9 | C10 | C37 | H36 | 63.5° | 173.8° |
| C10 | C9 | C8 | H44 | 173.1° | 22.7° |
| C28 | O9 | C11 | H32 | 56.0° | 84.0° |
| O9 | C28 | C29 | H37 | 57.6° | 60.0° |
| O9 | C28 | C29 | H38 | 62.4° | 180.0° |
| O9 | C28 | C29 | H39 | 177.5° | 60.0° |
| O9 | C28 | C30 | H40 | 62.1° | 60.0° |
| O9 | C28 | C30 | H41 | 57.9° | 180.0° |
| O9 | C28 | C30 | H42 | 177.9° | 60.0° |
| C30 | C28 | C29 | H37 | 58.7° | 178.5° |
| C30 | C28 | C29 | H38 | 178.7° | 58.5° |
| C30 | C28 | C29 | H39 | 61.2° | 61.5° |
| C28 | C30 | H40 | H41 | 120.0° | 120.0° |
| C28 | C30 | H40 | H42 | 120.0° | 120.0° |
| C28 | C30 | H41 | H42 | 120.0° | 119.9° |
| O10 | C12 | C13 | H22 | 77.9° | 70.2° |
| O10 | C12 | C38 | H29 | 60.5° | 59.5° |
| O10 | C12 | C38 | H30 | 179.5° | 60.6° |
| O10 | C12 | C38 | H31 | 59.5° | 179.4° |
| O10 | C12 | C11 | H32 | 171.8° | 59.4° |
| C37 | C10 | C11 | H32 | 176.4° | 94.8° |
| C10 | C37 | H34 | H35 | 120.0° | 120.0° |
| C10 | C37 | H34 | H36 | 120.0° | 120.0° |
| C10 | C37 | H35 | H36 | 120.0° | 120.0° |
| C37 | C10 | C9 | H43 | 0.3° | 69.1° |
| H1 | C24 | H2 | H3 | 120.0° | 120.0° |
| H1 | C24 | N5 | H4 | 0.0° | 120.0° |
| H2 | C24 | N5 | H4 | 120.0° | 120.0° |
| H3 | C24 | N5 | H4 | 120.0° | 0.0° |
| H7 | N2 | C21 | H66 | 53.7° | 120.0° |
| H7 | N2 | C21 | H67 | 172.3° | 120.0° |
| H8 | C16 | C15 | H10 | 174.7° | 60.0° |
| H8 | C16 | C15 | H11 | 54.3° | 180.0° |
| H8 | C16 | C17 | H58 | 146.1° | 180.0° |
| H8 | C16 | C17 | H59 | 94.2° | 60.0° |
| H9 | C16 | C15 | H10 | 66.1° | 180.0° |
| H9 | C16 | C15 | H11 | 173.5° | 60.0° |
| H9 | C16 | C17 | H58 | 26.9° | 60.0° |
| H9 | C16 | C17 | H59 | 146.6° | NaN° |
| H10 | C15 | N1 | H12 | 133.1° | 120.0° |
| H11 | C15 | N1 | H12 | 12.7° | 120.0° |
| H13 | C3 | C4 | H14 | 64.4° | 66.5° |
| H13 | C3 | C2 | H18 | 170.8° | 25.6° |
| H14 | C4 | C34 | H15 | 63.0° | 77.6° |
| H14 | C4 | C34 | H16 | 177.0° | 42.4° |
| H14 | C4 | C34 | H17 | 57.0° | 162.4° |
| H14 | C4 | C5 | H54 | 113.1° | 10.3° |
| H15 | C34 | H16 | H17 | 120.0° | 120.0° |
| H18 | C2 | C33 | H19 | 60.8° | 176.8° |
| H18 | C2 | C33 | H20 | 59.2° | 63.3° |
| H18 | C2 | C33 | H21 | 179.2° | 56.8° |
| H19 | C33 | H20 | H21 | 120.0° | 120.0° |
| H22 | C13 | C31 | H23 | 110.2° | 92.6° |
| H22 | C13 | C31 | H24 | 130.6° | 147.3° |
| H23 | C31 | C32 | H25 | 59.6° | 34.2° |
| H23 | C31 | C32 | H26 | 179.6° | 154.3° |
| H23 | C31 | C32 | H27 | 60.4° | 85.7° |
| H24 | C31 | C32 | H25 | 59.6° | 85.8° |
| H24 | C31 | C32 | H26 | 60.4° | 34.3° |
| H24 | C31 | C32 | H27 | 179.6° | 154.3° |
| H25 | C32 | H26 | H27 | 120.0° | 120.0° |
| H29 | C38 | H30 | H31 | 120.0° | 120.0° |
| H32 | C11 | C10 | H33 | 57.0° | 19.9° |
| H33 | C10 | C37 | H34 | 60.6° | 179.9° |
| H33 | C10 | C37 | H35 | 59.4° | 59.9° |
| H33 | C10 | C37 | H36 | 179.4° | 60.1° |
| H33 | C10 | C9 | H43 | 117.5° | 179.6° |
| H34 | C37 | H35 | H36 | 120.0° | 120.0° |
| H37 | C29 | H38 | H39 | 120.0° | 120.0° |
| H40 | C30 | H41 | H42 | 120.0° | 120.0° |
| H43 | C9 | C8 | H44 | 70.7° | 101.8° |
| H44 | C8 | C36 | H45 | 63.4° | 59.7° |
| H44 | C8 | C36 | H46 | 56.6° | 60.3° |
| H44 | C8 | C36 | H47 | 176.5° | 179.7° |
| H44 | C8 | C7 | H48 | 88.6° | 135.3° |
| H44 | C8 | C7 | H49 | 153.0° | 99.8° |
| H45 | C36 | H46 | H47 | 120.0° | 120.0° |
| H51 | C35 | H52 | H53 | 120.0° | 120.0° |
| H58 | C17 | C18 | H60 | 125.1° | 180.0° |
| H58 | C17 | C18 | H61 | 116.0° | 60.0° |
| H59 | C17 | C18 | H60 | 5.4° | 60.0° |
| H59 | C17 | C18 | H61 | 124.3° | 180.0° |
| H60 | C18 | C19 | H62 | 25.3° | 180.0° |
| H60 | C18 | C19 | H63 | 93.4° | 60.0° |
| H61 | C18 | C19 | H62 | 93.6° | 59.9° |
| H61 | C18 | C19 | H63 | 147.6° | 180.0° |
| H62 | C19 | C20 | H64 | 153.0° | 180.0° |
| H62 | C19 | C20 | H65 | 87.9° | 60.0° |
| H63 | C19 | C20 | H64 | 34.3° | 60.0° |
| H63 | C19 | C20 | H65 | 153.4° | NaN° |
| H64 | C20 | C21 | H66 | 55.1° | 60.0° |
| H64 | C20 | C21 | H67 | 63.5° | 179.9° |
| H65 | C20 | C21 | H66 | 64.0° | 180.0° |
| H65 | C20 | C21 | H67 | 177.4° | 59.9° |
