M6F
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O8 | C9 | sing | 1.44Å | 1.42Å | |
| C9 | C8 | sing | 1.52Å | 1.52Å | |
| C9 | C10 | sing | 1.52Å | 1.52Å | |
| C31 | C6 | sing | 1.54Å | 1.51Å | |
| O7 | C6 | sing | 1.42Å | 1.41Å | |
| O9 | C11 | sing | 1.42Å | 1.42Å | |
| C8 | C32 | sing | 1.54Å | 1.52Å | |
| C8 | C7 | sing | 1.54Å | 1.54Å | |
| C33 | C10 | sing | 1.52Å | 1.52Å | |
| C6 | C7 | sing | 1.53Å | 1.54Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C10 | C11 | sing | 1.52Å | 1.54Å | |
| C11 | C12 | sing | 1.52Å | 1.52Å | |
| O1 | C1 | doub | 1.21Å | 1.21Å | |
| C5 | C4 | sing | 1.52Å | 1.53Å | |
| C5 | O6 | sing | 1.43Å | 1.44Å | |
| O4 | C14 | doub | 1.22Å | 1.23Å | |
| O10 | C12 | sing | 1.43Å | 1.42Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C12 | C34 | sing | 1.55Å | 1.52Å | |
| C4 | C3 | sing | 1.52Å | 1.54Å | |
| C4 | C30 | sing | 1.52Å | 1.52Å | |
| C13 | O2 | sing | 1.43Å | 1.42Å | |
| C13 | C27 | sing | 1.54Å | 1.53Å | |
| C1 | O2 | sing | 1.32Å | 1.45Å | |
| C1 | C2 | sing | 1.50Å | 1.49Å | |
| O6 | C21 | sing | 1.43Å | 1.42Å | |
| C3 | C2 | sing | 1.51Å | 1.53Å | |
| C3 | O3 | sing | 1.46Å | 1.42Å | |
| C21 | C22 | sing | 1.47Å | 1.47Å | |
| C14 | O3 | sing | 1.35Å | 1.44Å | |
| C14 | N1 | sing | 1.35Å | 1.32Å | |
| C29 | C2 | sing | 1.53Å | 1.51Å | |
| C22 | C23 | trip | 1.17Å | 1.28Å | |
| C27 | C28 | sing | 1.53Å | 1.52Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C15 | N1 | sing | 1.47Å | 1.46Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C20 | N5 | sing | 1.46Å | 1.45Å | |
| O5 | C19 | doub | 1.22Å | 1.22Å | |
| N5 | C19 | sing | 1.35Å | 1.26Å | |
| C19 | N4 | sing | 1.35Å | 1.34Å | |
| N2 | C17 | sing | 1.46Å | 1.47Å | |
| N2 | C18 | sing | 1.37Å | 1.28Å | |
| N4 | C18 | sing | 1.38Å | 1.33Å | |
| C18 | N3 | doub | 1.30Å | 1.26Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C2 | H2 | sing | 1.12Å | 1.10Å | |
| C3 | H3 | sing | 1.11Å | 1.10Å | |
| C5 | H4 | sing | 1.10Å | 1.10Å | |
| C29 | H5 | sing | 1.09Å | 1.10Å | |
| C29 | H6 | sing | 1.09Å | 1.10Å | |
| C29 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| N2 | H14 | sing | 0.97Å | 1.00Å | |
| N3 | H15 | sing | 0.97Å | 1.00Å | |
| N4 | H16 | sing | 0.97Å | 1.00Å | |
| N5 | H17 | sing | 0.97Å | 1.00Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.11Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C28 | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.09Å | 1.10Å | |
| O10 | H27 | sing | 0.97Å | 0.95Å | |
| C34 | H28 | sing | 1.09Å | 1.10Å | |
| C34 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| C11 | H31 | sing | 1.12Å | 1.10Å | |
| O9 | H32 | sing | 0.97Å | 0.95Å | |
| O8 | H33 | sing | 0.97Å | 0.95Å | |
| C9 | H34 | sing | 1.10Å | 1.10Å | |
| C10 | H35 | sing | 1.12Å | 1.10Å | |
| C33 | H36 | sing | 1.09Å | 1.10Å | |
| C33 | H37 | sing | 1.09Å | 1.10Å | |
| C33 | H38 | sing | 1.09Å | 1.10Å | |
| C8 | H39 | sing | 1.08Å | 1.10Å | |
| C32 | H40 | sing | 1.09Å | 1.10Å | |
| C32 | H41 | sing | 1.09Å | 1.10Å | |
| C32 | H42 | sing | 1.09Å | 1.10Å | |
| C7 | H43 | sing | 1.09Å | 1.10Å | |
| C7 | H44 | sing | 1.09Å | 1.10Å | |
| O7 | H45 | sing | 0.97Å | 0.95Å | |
| C31 | H46 | sing | 1.09Å | 1.10Å | |
| C31 | H47 | sing | 1.09Å | 1.10Å | |
| C31 | H48 | sing | 1.09Å | 1.10Å | |
| C4 | H49 | sing | 1.12Å | 1.10Å | |
| C30 | H50 | sing | 1.09Å | 1.10Å | |
| C30 | H51 | sing | 1.09Å | 1.10Å | |
| C30 | H52 | sing | 1.09Å | 1.10Å | |
| C21 | H53 | sing | 1.09Å | 1.10Å | |
| C21 | H54 | sing | 1.09Å | 1.10Å | |
| C23 | H55 | sing | 1.05Å | 1.06Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O8 | C9 | C8 | 108.3° | 108.2° |
| O8 | C9 | C10 | 109.9° | 108.1° |
| C9 | O8 | H33 | 109.5° | 114.0° |
| O8 | C9 | H34 | 109.4° | 105.9° |
| C8 | C9 | C10 | 113.0° | 116.2° |
| C9 | C8 | C32 | 106.8° | 108.8° |
| C9 | C8 | C7 | 112.5° | 109.2° |
| C8 | C9 | H34 | 108.1° | 108.4° |
| C9 | C8 | H39 | 108.3° | 114.9° |
| C9 | C10 | C33 | 107.6° | 113.9° |
| C9 | C10 | C11 | 112.5° | 110.8° |
| C10 | C9 | H34 | 108.0° | 109.6° |
| C9 | C10 | H35 | 108.6° | 106.0° |
| C31 | C6 | O7 | 107.6° | 108.7° |
| C31 | C6 | C7 | 110.3° | 108.3° |
| C31 | C6 | C5 | 109.8° | 108.4° |
| C6 | C31 | H46 | 109.5° | 109.4° |
| C6 | C31 | H47 | 109.4° | 109.5° |
| C6 | C31 | H48 | 109.4° | 109.5° |
| O7 | C6 | C7 | 112.1° | 109.8° |
| O7 | C6 | C5 | 103.3° | 111.8° |
| C6 | O7 | H45 | 109.5° | 114.0° |
| O9 | C11 | C10 | 108.0° | 112.3° |
| O9 | C11 | C12 | 106.9° | 110.6° |
| O9 | C11 | H31 | 109.8° | 104.9° |
| C11 | O9 | H32 | 109.5° | 114.0° |
| C32 | C8 | C7 | 112.8° | 107.9° |
| C32 | C8 | H39 | 108.2° | 108.5° |
| C8 | C32 | H40 | 109.5° | 109.5° |
| C8 | C32 | H41 | 109.5° | 109.5° |
| C8 | C32 | H42 | 109.5° | 109.4° |
| C8 | C7 | C6 | 114.0° | 110.6° |
| C7 | C8 | H39 | 108.1° | 107.3° |
| C8 | C7 | H43 | 108.3° | 109.5° |
| C8 | C7 | H44 | 108.3° | 108.6° |
| C33 | C10 | C11 | 110.9° | 113.2° |
| C33 | C10 | H35 | 108.7° | 106.0° |
| C10 | C33 | H36 | 109.5° | 109.5° |
| C10 | C33 | H37 | 109.4° | 109.4° |
| C10 | C33 | H38 | 109.4° | 109.5° |
| C7 | C6 | C5 | 113.4° | 109.8° |
| C6 | C7 | H43 | 108.3° | 109.9° |
| C6 | C7 | H44 | 108.3° | 109.0° |
| C6 | C5 | C4 | 110.6° | 112.9° |
| C6 | C5 | O6 | 108.8° | 108.6° |
| C6 | C5 | H4 | 108.0° | 107.7° |
| C10 | C11 | C12 | 115.6° | 115.8° |
| C10 | C11 | H31 | 108.2° | 106.0° |
| C11 | C10 | H35 | 108.5° | 106.1° |
| C11 | C12 | O10 | 108.1° | 111.7° |
| C11 | C12 | C13 | 110.3° | 114.1° |
| C11 | C12 | C34 | 111.7° | 107.2° |
| C12 | C11 | H31 | 108.3° | 106.3° |
| O1 | C1 | O2 | 122.3° | 121.8° |
| O1 | C1 | C2 | 119.8° | 116.8° |
| C4 | C5 | O6 | 112.1° | 110.6° |
| C5 | C4 | C3 | 114.6° | 112.4° |
| C5 | C4 | C30 | 109.1° | 112.2° |
| C4 | C5 | H4 | 108.0° | 109.0° |
| C5 | C4 | H49 | 107.3° | 106.8° |
| C5 | O6 | C21 | 110.3° | 114.0° |
| O6 | C5 | H4 | 109.2° | 107.9° |
| O4 | C14 | O3 | 117.9° | 120.0° |
| O4 | C14 | N1 | 122.9° | 120.0° |
| O10 | C12 | C13 | 108.3° | 110.2° |
| O10 | C12 | C34 | 107.1° | 106.3° |
| C12 | O10 | H27 | 109.5° | 114.0° |
| C13 | C12 | C34 | 111.2° | 106.9° |
| C12 | C13 | O2 | 109.2° | 114.7° |
| C12 | C13 | C27 | 111.5° | 109.1° |
| C12 | C13 | H21 | 109.4° | 106.9° |
| C12 | C34 | H28 | 109.5° | 109.5° |
| C12 | C34 | H29 | 109.4° | 109.5° |
| C12 | C34 | H30 | 109.5° | 109.4° |
| C3 | C4 | C30 | 111.0° | 112.0° |
| C4 | C3 | C2 | 112.8° | 117.7° |
| C4 | C3 | O3 | 110.2° | 109.1° |
| C4 | C3 | H3 | 109.3° | 107.0° |
| C3 | C4 | H49 | 107.2° | 106.6° |
| C30 | C4 | H49 | 107.4° | 106.3° |
| C4 | C30 | H50 | 109.5° | 109.5° |
| C4 | C30 | H51 | 109.5° | 109.4° |
| C4 | C30 | H52 | 109.5° | 109.5° |
| O2 | C13 | C27 | 106.4° | 111.2° |
| C13 | O2 | C1 | 118.1° | 124.9° |
| O2 | C13 | H21 | 110.8° | 108.1° |
| C13 | C27 | C28 | 110.6° | 109.5° |
| C27 | C13 | H21 | 109.4° | 106.4° |
| C13 | C27 | H22 | 109.2° | 109.5° |
| C13 | C27 | H23 | 109.2° | 109.4° |
| O2 | C1 | C2 | 117.8° | 121.3° |
| C1 | C2 | C3 | 111.9° | 115.3° |
| C1 | C2 | C29 | 108.0° | 111.1° |
| C1 | C2 | H2 | 108.3° | 105.2° |
| O6 | C21 | C22 | 110.6° | 109.5° |
| O6 | C21 | H53 | 109.2° | 109.4° |
| O6 | C21 | H54 | 109.2° | 109.5° |
| C2 | C3 | O3 | 104.1° | 109.0° |
| C3 | C2 | C29 | 112.7° | 112.5° |
| C3 | C2 | H2 | 107.7° | 106.5° |
| C2 | C3 | H3 | 109.4° | 107.8° |
| C3 | O3 | C14 | 114.3° | 117.0° |
| O3 | C3 | H3 | 110.9° | 105.6° |
| C21 | C22 | C23 | 178.6° | 180.0° |
| C22 | C21 | H53 | 109.2° | 109.5° |
| C22 | C21 | H54 | 109.2° | 109.5° |
| O3 | C14 | N1 | 117.3° | 120.0° |
| C14 | N1 | C15 | 127.3° | 120.0° |
| C14 | N1 | H1 | 116.4° | 120.0° |
| C29 | C2 | H2 | 108.0° | 105.3° |
| C2 | C29 | H5 | 109.5° | 109.5° |
| C2 | C29 | H6 | 109.5° | 109.4° |
| C2 | C29 | H7 | 109.5° | 109.5° |
| C22 | C23 | H55 | 180.0° | 180.0° |
| C28 | C27 | H22 | 109.2° | 109.5° |
| C28 | C27 | H23 | 109.2° | 109.5° |
| C27 | C28 | H24 | 109.5° | 109.5° |
| C27 | C28 | H25 | 109.4° | 109.5° |
| C27 | C28 | H26 | 109.4° | 109.4° |
| C16 | C15 | N1 | 105.4° | 109.5° |
| C15 | C16 | C17 | 112.2° | 109.5° |
| C16 | C15 | H8 | 110.5° | 109.5° |
| C16 | C15 | H9 | 110.5° | 109.5° |
| C15 | C16 | H10 | 108.8° | 109.5° |
| C15 | C16 | H11 | 108.8° | 109.4° |
| C15 | N1 | H1 | 116.4° | 120.0° |
| N1 | C15 | H8 | 110.4° | 109.5° |
| N1 | C15 | H9 | 110.5° | 109.5° |
| C16 | C17 | N2 | 108.4° | 109.5° |
| C17 | C16 | H10 | 108.8° | 109.5° |
| C17 | C16 | H11 | 108.8° | 109.4° |
| C16 | C17 | H12 | 109.7° | 109.4° |
| C16 | C17 | H13 | 109.8° | 109.4° |
| C20 | N5 | C19 | 129.6° | 120.1° |
| C20 | N5 | H17 | 115.2° | 120.0° |
| N5 | C20 | H18 | 109.5° | 109.5° |
| N5 | C20 | H19 | 109.5° | 109.5° |
| N5 | C20 | H20 | 109.5° | 109.4° |
| O5 | C19 | N5 | 121.9° | 120.0° |
| O5 | C19 | N4 | 121.0° | 120.0° |
| N5 | C19 | N4 | 117.0° | 120.1° |
| C19 | N5 | H17 | 115.2° | 120.0° |
| C19 | N4 | C18 | 123.2° | 120.0° |
| C19 | N4 | H16 | 118.4° | 120.0° |
| C17 | N2 | C18 | 127.7° | 120.0° |
| N2 | C17 | H12 | 109.7° | 109.5° |
| N2 | C17 | H13 | 109.7° | 109.5° |
| C17 | N2 | H14 | 116.2° | 120.0° |
| N2 | C18 | N4 | 123.5° | 120.0° |
| N2 | C18 | N3 | 121.5° | 120.0° |
| C18 | N2 | H14 | 116.1° | 120.0° |
| N4 | C18 | N3 | 114.9° | 120.0° |
| C18 | N4 | H16 | 118.4° | 120.0° |
| C18 | N3 | H15 | 112.0° | 120.0° |
| H5 | C29 | H6 | 109.4° | 109.4° |
| H5 | C29 | H7 | 109.5° | 109.5° |
| H6 | C29 | H7 | 109.5° | 109.5° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H10 | C16 | H11 | 109.5° | 109.5° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H18 | C20 | H19 | 109.5° | 109.5° |
| H18 | C20 | H20 | 109.4° | 109.5° |
| H19 | C20 | H20 | 109.4° | 109.5° |
| H22 | C27 | H23 | 109.5° | 109.5° |
| H24 | C28 | H25 | 109.5° | 109.5° |
| H24 | C28 | H26 | 109.5° | 109.4° |
| H25 | C28 | H26 | 109.5° | 109.5° |
| H28 | C34 | H29 | 109.5° | 109.5° |
| H28 | C34 | H30 | 109.5° | 109.4° |
| H29 | C34 | H30 | 109.5° | 109.5° |
| H36 | C33 | H37 | 109.5° | 109.4° |
| H36 | C33 | H38 | 109.5° | 109.5° |
| H37 | C33 | H38 | 109.5° | 109.4° |
| H40 | C32 | H41 | 109.5° | 109.5° |
| H40 | C32 | H42 | 109.4° | 109.4° |
| H41 | C32 | H42 | 109.5° | 109.4° |
| H43 | C7 | H44 | 109.5° | 109.1° |
| H46 | C31 | H47 | 109.5° | 109.5° |
| H46 | C31 | H48 | 109.5° | 109.5° |
| H47 | C31 | H48 | 109.5° | 109.5° |
| H50 | C30 | H51 | 109.5° | 109.4° |
| H50 | C30 | H52 | 109.5° | 109.5° |
| H51 | C30 | H52 | 109.5° | 109.4° |
| H53 | C21 | H54 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O8 | C9 | C8 | C10 | 122.0° | 121.7° |
| O8 | C9 | C8 | H34 | 118.4° | 114.3° |
| O8 | C9 | C10 | H34 | 119.2° | 114.9° |
| O8 | C9 | C8 | C32 | 161.0° | 20.9° |
| O8 | C9 | C8 | C7 | 74.8° | 96.7° |
| O8 | C9 | C10 | C33 | 106.7° | 125.6° |
| O8 | C9 | C10 | C11 | 15.7° | 105.3° |
| O8 | C9 | C10 | H35 | 135.8° | 9.4° |
| O8 | C9 | C8 | H39 | 44.6° | 142.8° |
| C8 | C9 | C10 | H34 | 119.6° | 123.3° |
| C9 | C8 | C32 | C7 | 124.1° | 118.4° |
| C9 | C8 | C32 | H39 | 116.4° | 125.7° |
| C9 | C8 | C7 | H39 | 119.6° | 125.1° |
| C8 | C9 | C10 | C33 | 132.1° | 3.9° |
| C9 | C8 | C7 | C6 | 95.8° | 126.5° |
| C8 | C9 | C10 | C11 | 105.4° | 132.9° |
| C8 | C9 | O8 | H33 | 180.0° | 60.0° |
| C8 | C9 | C10 | H35 | 14.6° | 112.4° |
| C9 | C8 | C32 | H40 | 180.0° | 59.9° |
| C9 | C8 | C32 | H41 | 60.0° | 179.9° |
| C9 | C8 | C32 | H42 | 60.0° | 60.0° |
| C9 | C8 | C7 | H43 | 24.9° | 5.2° |
| C9 | C8 | C7 | H44 | 143.5° | 113.9° |
| C9 | C10 | C11 | O9 | 61.5° | 32.2° |
| C10 | C9 | C8 | C32 | 77.0° | 100.9° |
| C10 | C9 | C8 | C7 | 47.3° | 141.6° |
| C9 | C10 | C33 | C11 | 123.4° | 127.8° |
| C9 | C10 | C33 | H35 | 117.4° | 116.2° |
| C9 | C10 | C11 | H35 | 120.2° | 114.7° |
| C9 | C10 | C11 | C12 | 178.9° | 160.5° |
| C9 | C10 | C11 | H31 | 57.3° | 81.9° |
| C10 | C9 | O8 | H33 | 56.0° | 173.4° |
| C9 | C10 | C33 | H36 | 180.0° | 65.3° |
| C9 | C10 | C33 | H37 | 60.0° | 174.7° |
| C9 | C10 | C33 | H38 | 60.0° | 54.8° |
| C10 | C9 | C8 | H39 | 166.7° | 21.0° |
| C31 | C6 | O7 | C7 | 121.4° | 118.3° |
| C31 | C6 | O7 | C5 | 116.1° | 119.6° |
| C31 | C6 | C7 | C8 | 57.0° | 167.7° |
| C31 | C6 | C7 | C5 | 123.6° | 118.2° |
| C31 | C6 | C5 | C4 | 175.0° | 103.2° |
| C31 | C6 | C5 | O6 | 61.5° | 133.8° |
| C31 | C6 | C5 | H4 | 57.0° | 17.1° |
| C31 | C6 | C7 | H43 | 177.7° | 71.3° |
| C31 | C6 | C7 | H44 | 63.7° | 48.3° |
| C31 | C6 | O7 | H45 | 180.0° | 58.3° |
| C6 | C31 | H46 | H47 | 120.0° | 120.0° |
| C6 | C31 | H46 | H48 | 120.0° | 120.0° |
| C6 | C31 | H47 | H48 | 119.9° | 120.0° |
| O7 | C6 | C7 | C8 | 62.8° | 49.2° |
| O7 | C6 | C7 | C5 | 116.6° | 123.3° |
| O7 | C6 | C5 | C4 | 60.4° | 16.6° |
| O7 | C6 | C5 | O6 | 176.0° | 106.5° |
| O7 | C6 | C5 | H4 | 57.6° | 136.9° |
| O7 | C6 | C7 | H43 | 57.9° | 170.2° |
| O7 | C6 | C7 | H44 | 176.5° | 70.2° |
| O7 | C6 | C31 | H46 | 180.0° | 59.2° |
| O7 | C6 | C31 | H47 | 60.0° | 60.8° |
| O7 | C6 | C31 | H48 | 60.0° | 179.1° |
| O9 | C11 | C10 | C33 | 59.1° | 97.2° |
| O9 | C11 | C10 | C12 | 119.6° | 128.3° |
| O9 | C11 | C10 | H31 | 118.8° | 114.1° |
| O9 | C11 | C12 | H31 | 118.2° | 113.4° |
| O9 | C11 | C12 | O10 | 54.3° | 164.4° |
| O9 | C11 | C12 | C13 | 64.0° | 38.7° |
| O9 | C11 | C12 | C34 | 171.9° | 79.5° |
| O9 | C11 | C10 | H35 | 178.4° | 146.9° |
| C32 | C8 | C7 | H39 | 119.6° | 116.7° |
| C32 | C8 | C7 | C6 | 143.3° | 115.4° |
| C32 | C8 | C9 | H34 | 42.5° | 135.2° |
| C8 | C32 | H40 | H41 | 120.0° | 120.1° |
| C8 | C32 | H40 | H42 | 120.0° | 120.0° |
| C8 | C32 | H41 | H42 | 120.0° | 119.9° |
| C32 | C8 | C7 | H43 | 96.0° | 123.3° |
| C32 | C8 | C7 | H44 | 22.7° | 4.2° |
| C8 | C7 | C6 | H43 | 120.7° | 121.0° |
| C8 | C7 | C6 | H44 | 120.7° | 119.4° |
| C8 | C7 | C6 | C5 | 179.3° | 74.1° |
| C7 | C8 | C9 | H34 | 166.8° | 17.7° |
| C7 | C8 | C32 | H40 | 55.9° | 178.3° |
| C7 | C8 | C32 | H41 | 64.1° | 61.6° |
| C7 | C8 | C32 | H42 | 175.9° | 58.3° |
| C8 | C7 | H43 | H44 | 117.9° | 118.8° |
| C33 | C10 | C11 | H35 | 119.2° | 115.9° |
| C33 | C10 | C11 | C12 | 60.5° | 31.1° |
| C33 | C10 | C11 | H31 | 177.9° | 148.7° |
| C33 | C10 | C9 | H34 | 12.5° | 119.4° |
| C10 | C33 | H36 | H37 | 120.0° | 120.0° |
| C10 | C33 | H36 | H38 | 120.0° | 120.1° |
| C10 | C33 | H37 | H38 | 120.0° | 120.0° |
| C7 | C6 | C5 | C4 | 61.2° | 138.7° |
| C7 | C6 | C5 | O6 | 62.4° | 15.6° |
| C7 | C6 | C5 | H4 | 179.2° | 101.0° |
| C6 | C7 | C8 | H39 | 23.7° | 1.3° |
| C6 | C7 | H43 | H44 | 117.9° | 119.5° |
| C7 | C6 | O7 | H45 | 58.7° | 60.0° |
| C7 | C6 | C31 | H46 | 57.5° | 60.0° |
| C7 | C6 | C31 | H47 | 62.5° | 180.0° |
| C7 | C6 | C31 | H48 | 177.5° | 59.9° |
| C6 | C5 | C4 | O6 | 121.7° | 121.9° |
| C6 | C5 | C4 | H4 | 118.0° | 119.6° |
| C6 | C5 | O6 | H4 | 117.7° | 116.5° |
| C6 | C5 | C4 | C3 | 126.5° | 157.6° |
| C6 | C5 | C4 | C30 | 108.4° | 75.1° |
| C6 | C5 | O6 | C21 | 140.7° | 106.1° |
| C5 | C6 | C7 | H43 | 58.7° | 46.9° |
| C5 | C6 | C7 | H44 | 60.0° | 166.5° |
| C5 | C6 | O7 | H45 | 63.8° | 177.9° |
| C5 | C6 | C31 | H46 | 68.2° | 179.1° |
| C5 | C6 | C31 | H47 | 171.8° | 60.9° |
| C5 | C6 | C31 | H48 | 51.8° | 59.1° |
| C6 | C5 | C4 | H49 | 7.6° | 41.1° |
| C10 | C11 | C12 | H31 | 121.5° | 117.4° |
| C10 | C11 | C12 | O10 | 66.0° | 35.2° |
| C10 | C11 | C12 | C13 | 175.8° | 90.5° |
| C10 | C11 | C12 | C34 | 51.6° | 151.3° |
| C10 | C11 | O9 | H32 | 180.0° | 105.2° |
| C11 | C10 | C9 | H34 | 135.0° | 9.6° |
| C11 | C10 | C33 | H36 | 56.6° | 166.9° |
| C11 | C10 | C33 | H37 | 63.4° | 46.9° |
| C11 | C10 | C33 | H38 | 176.5° | 73.0° |
| C11 | C12 | O10 | C13 | 119.5° | 127.9° |
| C11 | C12 | O10 | C34 | 120.5° | 116.6° |
| C11 | C12 | C13 | C34 | 124.4° | 118.3° |
| C11 | C12 | C13 | O2 | 80.5° | 17.0° |
| C11 | C12 | C13 | C27 | 162.2° | 108.5° |
| C11 | C12 | C13 | H21 | 41.0° | 136.8° |
| C11 | C12 | O10 | H27 | 180.0° | 172.0° |
| C11 | C12 | C34 | H28 | 180.0° | 172.5° |
| C11 | C12 | C34 | H29 | 60.0° | 52.5° |
| C11 | C12 | C34 | H30 | 60.0° | 67.5° |
| C12 | C11 | O9 | H32 | 55.0° | 25.9° |
| C12 | C11 | C10 | H35 | 58.8° | 84.8° |
| O1 | C1 | O2 | C13 | 3.7° | 63.7° |
| O1 | C1 | O2 | C2 | 175.3° | 178.8° |
| O1 | C1 | C2 | C3 | 67.1° | 82.2° |
| O1 | C1 | C2 | C29 | 57.5° | 148.3° |
| O1 | C1 | C2 | H2 | 174.3° | 34.8° |
| C4 | C5 | O6 | H4 | 119.6° | 119.1° |
| C5 | C4 | C3 | C30 | 124.0° | 127.4° |
| C5 | C4 | C3 | H49 | 119.0° | 116.7° |
| C5 | C4 | C30 | H49 | 116.0° | 116.4° |
| C4 | C5 | O6 | C21 | 96.6° | 129.5° |
| C5 | C4 | C3 | C2 | 170.3° | 81.5° |
| C5 | C4 | C3 | O3 | 73.9° | 43.3° |
| C5 | C4 | C3 | H3 | 48.3° | 157.1° |
| C5 | C4 | C30 | H50 | 180.0° | 57.6° |
| C5 | C4 | C30 | H51 | 60.0° | 177.5° |
| C5 | C4 | C30 | H52 | 60.0° | 62.6° |
| O6 | C5 | C4 | C3 | 111.8° | 80.5° |
| O6 | C5 | C4 | C30 | 13.2° | 46.8° |
| C5 | O6 | C21 | C22 | 160.4° | 140.7° |
| O6 | C5 | C4 | H49 | 129.2° | 162.9° |
| C5 | O6 | C21 | H53 | 40.2° | 20.7° |
| C5 | O6 | C21 | H54 | 79.4° | 99.3° |
| O4 | C14 | O3 | C3 | 25.8° | 0.0° |
| O4 | C14 | O3 | N1 | 164.7° | 180.0° |
| O4 | C14 | N1 | C15 | 1.4° | 0.2° |
| O4 | C14 | N1 | H1 | 178.6° | 180.0° |
| O10 | C12 | C13 | C34 | 117.5° | 115.1° |
| O10 | C12 | C13 | O2 | 161.4° | 109.6° |
| O10 | C12 | C13 | C27 | 44.1° | 124.9° |
| O10 | C12 | C13 | H21 | 77.1° | 10.2° |
| O10 | C12 | C34 | H28 | 61.8° | 53.0° |
| O10 | C12 | C34 | H29 | 58.2° | 67.0° |
| O10 | C12 | C34 | H30 | 178.2° | 172.9° |
| O10 | C12 | C11 | H31 | 172.5° | 82.2° |
| C12 | C13 | O2 | C27 | 120.5° | 124.4° |
| C12 | C13 | O2 | H21 | 120.6° | 119.1° |
| C12 | C13 | C27 | H21 | 121.2° | 115.0° |
| C12 | C13 | O2 | C1 | 115.3° | 124.9° |
| C12 | C13 | C27 | C28 | 159.9° | 171.8° |
| C12 | C13 | C27 | H22 | 79.9° | 51.7° |
| C12 | C13 | C27 | H23 | 39.7° | 68.2° |
| C13 | C12 | O10 | H27 | 60.6° | 60.1° |
| C13 | C12 | C34 | H28 | 56.4° | 64.7° |
| C13 | C12 | C34 | H29 | 176.4° | 175.3° |
| C13 | C12 | C34 | H30 | 63.6° | 55.2° |
| C13 | C12 | C11 | H31 | 54.3° | 152.1° |
| C34 | C12 | C13 | O2 | 44.0° | 135.3° |
| C34 | C12 | C13 | C27 | 73.4° | 9.8° |
| C34 | C12 | C13 | H21 | 165.5° | 104.9° |
| C34 | C12 | O10 | H27 | 59.5° | 55.4° |
| C12 | C34 | H28 | H29 | 120.0° | 120.0° |
| C12 | C34 | H28 | H30 | 120.0° | 119.9° |
| C12 | C34 | H29 | H30 | 120.0° | 120.0° |
| C34 | C12 | C11 | H31 | 69.9° | 33.9° |
| C3 | C4 | C30 | H49 | 116.9° | 116.1° |
| C4 | C3 | C2 | C1 | 51.4° | 42.3° |
| C4 | C3 | C2 | O3 | 119.5° | 124.9° |
| C4 | C3 | C2 | H3 | 121.9° | 120.9° |
| C4 | C3 | O3 | H3 | 121.2° | 114.7° |
| C4 | C3 | O3 | C14 | 126.8° | 140.3° |
| C4 | C3 | C2 | C29 | 173.3° | 86.5° |
| C4 | C3 | C2 | H2 | 67.6° | 158.6° |
| C3 | C4 | C5 | H4 | 8.5° | 38.0° |
| C3 | C4 | C30 | H50 | 52.9° | 70.0° |
| C3 | C4 | C30 | H51 | 172.9° | 49.9° |
| C3 | C4 | C30 | H52 | 67.1° | 169.9° |
| C30 | C4 | C3 | C2 | 65.7° | 45.9° |
| C30 | C4 | C3 | O3 | 50.2° | 170.7° |
| C30 | C4 | C3 | H3 | 172.4° | 75.5° |
| C30 | C4 | C5 | H4 | 133.5° | 165.4° |
| C4 | C30 | H50 | H51 | 120.0° | 119.9° |
| C4 | C30 | H50 | H52 | 120.0° | 120.1° |
| C4 | C30 | H51 | H52 | 120.0° | 120.0° |
| O2 | C13 | C27 | H21 | 119.8° | 117.5° |
| C13 | O2 | C1 | C2 | 179.0° | 115.1° |
| O2 | C13 | C27 | C28 | 40.9° | 60.7° |
| O2 | C13 | C27 | H22 | 161.0° | 179.2° |
| O2 | C13 | C27 | H23 | 79.3° | 59.2° |
| C27 | C13 | O2 | C1 | 124.2° | 0.5° |
| C13 | C27 | C28 | H22 | 120.1° | 120.0° |
| C13 | C27 | C28 | H23 | 120.2° | 120.0° |
| C13 | C27 | H22 | H23 | 119.4° | 120.0° |
| C13 | C27 | C28 | H24 | 180.0° | 179.0° |
| C13 | C27 | C28 | H25 | 60.0° | 58.9° |
| C13 | C27 | C28 | H26 | 60.0° | 61.1° |
| O2 | C1 | C2 | C3 | 108.3° | 99.0° |
| O2 | C1 | C2 | C29 | 127.1° | 30.6° |
| O2 | C1 | C2 | H2 | 10.4° | 144.0° |
| C1 | O2 | C13 | H21 | 5.3° | 116.0° |
| C1 | C2 | C3 | C29 | 122.0° | 128.9° |
| C1 | C2 | C3 | H2 | 119.0° | 116.3° |
| C1 | C2 | C3 | O3 | 170.8° | 82.6° |
| C1 | C2 | C29 | H2 | 117.0° | 113.4° |
| C1 | C2 | C3 | H3 | 70.5° | 163.3° |
| C1 | C2 | C29 | H5 | 180.0° | 71.6° |
| C1 | C2 | C29 | H6 | 60.0° | 48.3° |
| C1 | C2 | C29 | H7 | 60.0° | 168.3° |
| O6 | C21 | C22 | H53 | 120.2° | 120.0° |
| O6 | C21 | C22 | H54 | 120.2° | 120.0° |
| O6 | C21 | C22 | C23 | 71.8° | 22.8° |
| C21 | O6 | C5 | H4 | 23.0° | 10.4° |
| O6 | C21 | H53 | H54 | 119.5° | 120.0° |
| C2 | C3 | O3 | H3 | 117.6° | 115.6° |
| C2 | C3 | O3 | C14 | 112.0° | 90.0° |
| C3 | C2 | C29 | H2 | 118.9° | 115.6° |
| C3 | C2 | C29 | H5 | 55.9° | 59.3° |
| C3 | C2 | C29 | H6 | 64.1° | 179.3° |
| C3 | C2 | C29 | H7 | 175.9° | 60.7° |
| C2 | C3 | C4 | H49 | 51.3° | 161.8° |
| C3 | O3 | C14 | N1 | 169.5° | 180.0° |
| O3 | C3 | C2 | C29 | 67.2° | 148.6° |
| O3 | C3 | C2 | H2 | 51.9° | 33.7° |
| O3 | C3 | C4 | H49 | 167.2° | 73.3° |
| C22 | C21 | H53 | H54 | 119.5° | 120.0° |
| C21 | C22 | C23 | H55 | 20.1° | 113.7° |
| O3 | C14 | N1 | C15 | 162.5° | 179.8° |
| O3 | C14 | N1 | H1 | 17.5° | 0.0° |
| C14 | O3 | C3 | H3 | 5.6° | 25.6° |
| C14 | N1 | C15 | C16 | 92.8° | 179.7° |
| C14 | N1 | C15 | H1 | 180.0° | 179.8° |
| C14 | N1 | C15 | H8 | 147.9° | 60.3° |
| C14 | N1 | C15 | H9 | 26.6° | 59.7° |
| C29 | C2 | C3 | H3 | 51.4° | 34.4° |
| C2 | C29 | H5 | H6 | 120.0° | 119.9° |
| C2 | C29 | H5 | H7 | 120.0° | 120.1° |
| C2 | C29 | H6 | H7 | 120.0° | 120.1° |
| C23 | C22 | C21 | H53 | 48.4° | 97.2° |
| C23 | C22 | C21 | H54 | 168.1° | 142.8° |
| C28 | C27 | C13 | H21 | 78.9° | 56.8° |
| C28 | C27 | H22 | H23 | 119.5° | 120.0° |
| C27 | C28 | H24 | H25 | 120.0° | 120.1° |
| C27 | C28 | H24 | H26 | 120.0° | 119.9° |
| C27 | C28 | H25 | H26 | 120.0° | 120.0° |
| C16 | C15 | N1 | H8 | 119.3° | 120.0° |
| C16 | C15 | N1 | H9 | 119.4° | 120.0° |
| C15 | C16 | C17 | H10 | 120.4° | 120.1° |
| C15 | C16 | C17 | H11 | 120.4° | 119.9° |
| C15 | C16 | C17 | N2 | 170.0° | 180.0° |
| C16 | C15 | N1 | H1 | 87.2° | 0.0° |
| C16 | C15 | H8 | H9 | 121.9° | 120.0° |
| C15 | C16 | H10 | H11 | 118.7° | 120.0° |
| C15 | C16 | C17 | H12 | 70.2° | 60.0° |
| C15 | C16 | C17 | H13 | 50.2° | 60.1° |
| N1 | C15 | C16 | C17 | 66.6° | 180.0° |
| N1 | C15 | H8 | H9 | 121.9° | 120.0° |
| N1 | C15 | C16 | H10 | 53.8° | 59.9° |
| N1 | C15 | C16 | H11 | 172.9° | 60.0° |
| C16 | C17 | N2 | H12 | 119.8° | 120.0° |
| C16 | C17 | N2 | H13 | 119.8° | 120.0° |
| C16 | C17 | N2 | C18 | 145.9° | 180.0° |
| C17 | C16 | C15 | H8 | 52.7° | 60.0° |
| C17 | C16 | C15 | H9 | 174.0° | 60.0° |
| C17 | C16 | H10 | H11 | 118.8° | 120.0° |
| C16 | C17 | H12 | H13 | 120.5° | 120.0° |
| C16 | C17 | N2 | H14 | 34.0° | 0.0° |
| C20 | N5 | C19 | O5 | 1.0° | 0.1° |
| C20 | N5 | C19 | H17 | 180.0° | 180.0° |
| C20 | N5 | C19 | N4 | 176.9° | 180.0° |
| N5 | C20 | H18 | H19 | 120.0° | 120.0° |
| N5 | C20 | H18 | H20 | 120.0° | 120.0° |
| N5 | C20 | H19 | H20 | 120.0° | 119.9° |
| O5 | C19 | N5 | N4 | 175.9° | 179.9° |
| O5 | C19 | N4 | C18 | 12.6° | 5.4° |
| O5 | C19 | N4 | H16 | 167.4° | 174.6° |
| O5 | C19 | N5 | H17 | 179.0° | 179.9° |
| N5 | C19 | N4 | C18 | 171.5° | 174.5° |
| N5 | C19 | N4 | H16 | 8.5° | 5.4° |
| C19 | N5 | C20 | H18 | 180.0° | 180.0° |
| C19 | N5 | C20 | H19 | 60.0° | 60.0° |
| C19 | N5 | C20 | H20 | 60.0° | 60.0° |
| C19 | N4 | C18 | N2 | 3.8° | 5.4° |
| C19 | N4 | C18 | H16 | 180.0° | 180.0° |
| C19 | N4 | C18 | N3 | 178.3° | 174.6° |
| N4 | C19 | N5 | H17 | 3.1° | 0.0° |
| C17 | N2 | C18 | H14 | 180.0° | 180.0° |
| C17 | N2 | C18 | N4 | 179.4° | 173.8° |
| C17 | N2 | C18 | N3 | 5.3° | 6.3° |
| N2 | C17 | C16 | H10 | 49.6° | 60.0° |
| N2 | C17 | C16 | H11 | 69.6° | 60.0° |
| N2 | C17 | H12 | H13 | 120.5° | 120.0° |
| N2 | C18 | N4 | N3 | 174.5° | 180.0° |
| C18 | N2 | C17 | H12 | 94.2° | 60.0° |
| C18 | N2 | C17 | H13 | 26.1° | 60.0° |
| N2 | C18 | N3 | H15 | 174.6° | 175.0° |
| N2 | C18 | N4 | H16 | 176.2° | 174.5° |
| N4 | C18 | N2 | H14 | 0.6° | 6.3° |
| N4 | C18 | N3 | H15 | 0.0° | 4.9° |
| N3 | C18 | N2 | H14 | 174.7° | 173.7° |
| N3 | C18 | N4 | H16 | 1.7° | 5.4° |
| H1 | N1 | C15 | H8 | 32.1° | 120.0° |
| H1 | N1 | C15 | H9 | 153.4° | 120.0° |
| H2 | C2 | C3 | H3 | 170.5° | 80.4° |
| H2 | C2 | C29 | H5 | 63.1° | 174.9° |
| H2 | C2 | C29 | H6 | 177.0° | 65.1° |
| H2 | C2 | C29 | H7 | 57.0° | 54.9° |
| H3 | C3 | C4 | H49 | 70.6° | 40.5° |
| H4 | C5 | C4 | H49 | 110.4° | 78.5° |
| H5 | C29 | H6 | H7 | 120.0° | 120.0° |
| H8 | C15 | C16 | H10 | 173.1° | 180.0° |
| H8 | C15 | C16 | H11 | 67.7° | 60.0° |
| H9 | C15 | C16 | H10 | 65.6° | 60.1° |
| H9 | C15 | C16 | H11 | 53.6° | 180.0° |
| H10 | C16 | C17 | H12 | 169.4° | 180.0° |
| H10 | C16 | C17 | H13 | 70.2° | 60.0° |
| H11 | C16 | C17 | H12 | 50.2° | 60.0° |
| H11 | C16 | C17 | H13 | 170.6° | 180.0° |
| H12 | C17 | N2 | H14 | 85.8° | 120.0° |
| H13 | C17 | N2 | H14 | 153.9° | 120.0° |
| H17 | N5 | C20 | H18 | 0.0° | 0.1° |
| H17 | N5 | C20 | H19 | 120.0° | 120.0° |
| H17 | N5 | C20 | H20 | 120.0° | 120.1° |
| H18 | C20 | H19 | H20 | 119.9° | 120.0° |
| H21 | C13 | C27 | H22 | 41.2° | 63.3° |
| H21 | C13 | C27 | H23 | 160.9° | 176.7° |
| H22 | C27 | C28 | H24 | 59.8° | 61.0° |
| H22 | C27 | C28 | H25 | 179.8° | 179.0° |
| H22 | C27 | C28 | H26 | 60.2° | 58.9° |
| H23 | C27 | C28 | H24 | 59.9° | 59.0° |
| H23 | C27 | C28 | H25 | 60.2° | 61.0° |
| H23 | C27 | C28 | H26 | 179.8° | 178.9° |
| H24 | C28 | H25 | H26 | 120.0° | 119.9° |
| H28 | C34 | H29 | H30 | 120.0° | 120.0° |
| H31 | C11 | O9 | H32 | 62.3° | 140.1° |
| H31 | C11 | C10 | H35 | 62.9° | 32.8° |
| H33 | O8 | C9 | H34 | 62.4° | 56.0° |
| H34 | C9 | C10 | H35 | 104.9° | 124.3° |
| H34 | C9 | C8 | H39 | 73.8° | 102.9° |
| H35 | C10 | C33 | H36 | 62.6° | 50.9° |
| H35 | C10 | C33 | H37 | 177.4° | 69.1° |
| H35 | C10 | C33 | H38 | 57.4° | 171.0° |
| H36 | C33 | H37 | H38 | 120.0° | 120.0° |
| H39 | C8 | C32 | H40 | 63.6° | 65.8° |
| H39 | C8 | C32 | H41 | 176.4° | 54.4° |
| H39 | C8 | C32 | H42 | 56.4° | 174.3° |
| H39 | C8 | C7 | H43 | 144.4° | 119.9° |
| H39 | C8 | C7 | H44 | 96.9° | 121.0° |
| H40 | C32 | H41 | H42 | 120.0° | 120.0° |
| H46 | C31 | H47 | H48 | 120.0° | 120.0° |
| H49 | C4 | C30 | H50 | 64.0° | 173.9° |
| H49 | C4 | C30 | H51 | 56.0° | 66.2° |
| H49 | C4 | C30 | H52 | 176.0° | 53.8° |
| H50 | C30 | H51 | H52 | 120.0° | 120.0° |
