U9X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C34 | doub | 1.22Å | 1.22Å | |
| C33 | C34 | sing | 1.41Å | 1.44Å | |
| C33 | C31 | doub | 1.35Å | 1.36Å | |
| C32 | O5 | sing | 1.45Å | 1.48Å | |
| C5 | C8 | sing | 1.53Å | 1.51Å | |
| C34 | N3 | sing | 1.35Å | 1.40Å | |
| O5 | C31 | sing | 1.35Å | 1.35Å | |
| C31 | C4 | sing | 1.51Å | 1.54Å | |
| C8 | C1 | sing | 1.53Å | 1.54Å | |
| C8 | C13 | sing | 1.53Å | 1.55Å | |
| N3 | C4 | sing | 1.47Å | 1.52Å | |
| N3 | C2 | sing | 1.35Å | 1.32Å | |
| C4 | C27 | sing | 1.53Å | 1.55Å | |
| C7 | C2 | sing | 1.51Å | 1.49Å | |
| C7 | C9 | sing | 1.53Å | 1.58Å | |
| C2 | O7 | doub | 1.21Å | 1.22Å | |
| C13 | C6 | sing | 1.53Å | 1.54Å | |
| C6 | N2 | sing | 1.46Å | 1.46Å | |
| C6 | C10 | sing | 1.51Å | 1.54Å | |
| O3 | C19 | doub | 1.21Å | 1.22Å | |
| N1 | C10 | sing | 1.35Å | 1.35Å | |
| N1 | C12 | sing | 1.47Å | 1.50Å | |
| C27 | C28 | sing | 1.53Å | 1.58Å | |
| C29 | C28 | sing | 1.53Å | 1.56Å | |
| C9 | C12 | sing | 1.53Å | 1.57Å | |
| N2 | C14 | sing | 1.35Å | 1.34Å | |
| C28 | C30 | sing | 1.53Å | 1.57Å | |
| C10 | O1 | doub | 1.21Å | 1.23Å | |
| O4 | C14 | doub | 1.21Å | 1.27Å | |
| C12 | C11 | sing | 1.53Å | 1.54Å | |
| C25 | N4 | sing | 1.47Å | 1.48Å | |
| C19 | C20 | sing | 1.51Å | 1.55Å | |
| C19 | O2 | sing | 1.34Å | 1.37Å | |
| C14 | C15 | sing | 1.51Å | 1.52Å | |
| C20 | N4 | sing | 1.47Å | 1.49Å | |
| C20 | C21 | sing | 1.53Å | 1.60Å | |
| C22 | C21 | sing | 1.53Å | 1.57Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| C15 | O2 | sing | 1.45Å | 1.46Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| N4 | C26 | sing | 1.47Å | 1.50Å | |
| C21 | C24 | sing | 1.53Å | 1.55Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C18 | C17 | sing | 1.53Å | 1.55Å | |
| C17 | C3 | sing | 1.53Å | 1.51Å | |
| C33 | H1 | sing | 1.08Å | 1.08Å | |
| C32 | H2 | sing | 1.09Å | 1.10Å | |
| C32 | H3 | sing | 1.09Å | 1.10Å | |
| C32 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C27 | H6 | sing | 1.09Å | 1.10Å | |
| C27 | H7 | sing | 1.09Å | 1.10Å | |
| C28 | H8 | sing | 1.09Å | 1.10Å | |
| C30 | H9 | sing | 1.09Å | 1.10Å | |
| C30 | H10 | sing | 1.09Å | 1.10Å | |
| C30 | H11 | sing | 1.09Å | 1.10Å | |
| C29 | H12 | sing | 1.09Å | 1.10Å | |
| C29 | H13 | sing | 1.09Å | 1.10Å | |
| C29 | H14 | sing | 1.09Å | 1.10Å | |
| C7 | H15 | sing | 1.09Å | 1.10Å | |
| C7 | H16 | sing | 1.09Å | 1.10Å | |
| C9 | H17 | sing | 1.09Å | 1.10Å | |
| C9 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| N1 | H23 | sing | 0.97Å | 1.00Å | |
| C6 | H24 | sing | 1.09Å | 1.10Å | |
| C13 | H25 | sing | 1.09Å | 1.10Å | |
| C13 | H26 | sing | 1.09Å | 1.10Å | |
| C8 | H27 | sing | 1.09Å | 1.10Å | |
| C5 | H28 | sing | 1.09Å | 1.10Å | |
| C5 | H29 | sing | 1.09Å | 1.10Å | |
| C5 | H30 | sing | 1.09Å | 1.10Å | |
| C1 | H31 | sing | 1.09Å | 1.10Å | |
| C1 | H32 | sing | 1.09Å | 1.10Å | |
| C1 | H33 | sing | 1.09Å | 1.10Å | |
| N2 | H34 | sing | 0.97Å | 1.00Å | |
| C15 | H35 | sing | 1.09Å | 1.10Å | |
| C16 | H36 | sing | 1.09Å | 1.10Å | |
| C16 | H37 | sing | 1.09Å | 1.10Å | |
| C17 | H38 | sing | 1.09Å | 1.10Å | |
| C18 | H39 | sing | 1.09Å | 1.10Å | |
| C18 | H40 | sing | 1.09Å | 1.10Å | |
| C18 | H41 | sing | 1.09Å | 1.10Å | |
| C3 | H42 | sing | 1.09Å | 1.10Å | |
| C3 | H43 | sing | 1.09Å | 1.10Å | |
| C3 | H44 | sing | 1.09Å | 1.10Å | |
| C20 | H45 | sing | 1.09Å | 1.10Å | |
| C26 | H47 | sing | 1.09Å | 1.10Å | |
| C26 | H48 | sing | 1.09Å | 1.10Å | |
| C26 | H49 | sing | 1.09Å | 1.10Å | |
| C25 | H50 | sing | 1.09Å | 1.10Å | |
| C25 | H51 | sing | 1.09Å | 1.10Å | |
| C25 | H52 | sing | 1.09Å | 1.10Å | |
| C21 | H53 | sing | 1.09Å | 1.10Å | |
| C24 | H54 | sing | 1.09Å | 1.10Å | |
| C24 | H55 | sing | 1.09Å | 1.10Å | |
| C24 | H56 | sing | 1.09Å | 1.10Å | |
| C22 | H57 | sing | 1.09Å | 1.10Å | |
| C22 | H58 | sing | 1.09Å | 1.10Å | |
| C23 | H59 | sing | 1.09Å | 1.10Å | |
| C23 | H60 | sing | 1.09Å | 1.10Å | |
| C23 | H61 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C34 | C33 | 128.9° | 124.4° |
| O6 | C34 | N3 | 123.4° | 124.5° |
| C34 | C33 | C31 | 109.0° | 110.5° |
| C33 | C34 | N3 | 107.6° | 111.2° |
| C34 | C33 | H1 | 125.5° | 124.8° |
| C33 | C31 | O5 | 128.0° | 126.8° |
| C33 | C31 | C4 | 112.7° | 106.3° |
| C31 | C33 | H1 | 125.5° | 124.8° |
| C32 | O5 | C31 | 119.4° | 117.0° |
| O5 | C32 | H2 | 109.5° | 109.5° |
| O5 | C32 | H3 | 109.5° | 109.5° |
| O5 | C32 | H4 | 109.4° | 109.5° |
| C5 | C8 | C1 | 112.3° | 109.5° |
| C5 | C8 | C13 | 109.4° | 109.4° |
| C5 | C8 | H27 | 108.0° | 109.5° |
| C8 | C5 | H28 | 109.5° | 109.5° |
| C8 | C5 | H29 | 109.4° | 109.5° |
| C8 | C5 | H30 | 109.5° | 109.5° |
| C34 | N3 | C4 | 112.5° | 107.2° |
| C34 | N3 | C2 | 124.5° | 126.4° |
| O5 | C31 | C4 | 119.3° | 126.8° |
| C31 | C4 | N3 | 97.9° | 104.9° |
| C31 | C4 | C27 | 112.2° | 110.6° |
| C31 | C4 | H5 | 109.3° | 110.2° |
| C1 | C8 | C13 | 111.8° | 109.5° |
| C1 | C8 | H27 | 107.7° | 109.5° |
| C8 | C1 | H31 | 109.5° | 109.5° |
| C8 | C1 | H32 | 109.4° | 109.5° |
| C8 | C1 | H33 | 109.5° | 109.5° |
| C8 | C13 | C6 | 115.3° | 109.5° |
| C8 | C13 | H25 | 108.0° | 109.5° |
| C8 | C13 | H26 | 108.0° | 109.4° |
| C13 | C8 | H27 | 107.5° | 109.4° |
| C4 | N3 | C2 | 122.2° | 126.4° |
| N3 | C4 | C27 | 118.0° | 110.4° |
| N3 | C4 | H5 | 109.6° | 110.4° |
| N3 | C2 | C7 | 126.3° | 120.0° |
| N3 | C2 | O7 | 113.9° | 120.0° |
| C4 | C27 | C28 | 119.3° | 109.4° |
| C27 | C4 | H5 | 109.2° | 110.4° |
| C4 | C27 | H6 | 107.0° | 109.5° |
| C4 | C27 | H7 | 106.9° | 109.5° |
| C2 | C7 | C9 | 105.4° | 109.4° |
| C7 | C2 | O7 | 119.8° | 120.0° |
| C2 | C7 | H15 | 110.5° | 109.5° |
| C2 | C7 | H16 | 110.5° | 109.5° |
| C7 | C9 | C12 | 107.5° | 109.5° |
| C9 | C7 | H15 | 110.5° | 109.5° |
| C9 | C7 | H16 | 110.5° | 109.4° |
| C7 | C9 | H17 | 109.9° | 109.5° |
| C7 | C9 | H18 | 110.0° | 109.5° |
| C13 | C6 | N2 | 113.9° | 109.5° |
| C13 | C6 | C10 | 108.3° | 109.5° |
| C13 | C6 | H24 | 107.3° | 109.5° |
| C6 | C13 | H25 | 108.0° | 109.5° |
| C6 | C13 | H26 | 108.0° | 109.5° |
| N2 | C6 | C10 | 111.6° | 109.4° |
| C6 | N2 | C14 | 124.4° | 120.0° |
| N2 | C6 | H24 | 108.3° | 109.4° |
| C6 | N2 | H34 | 117.8° | 120.1° |
| C6 | C10 | N1 | 119.3° | 120.0° |
| C6 | C10 | O1 | 117.9° | 120.0° |
| C10 | C6 | H24 | 107.2° | 109.5° |
| O3 | C19 | C20 | 128.8° | 120.0° |
| O3 | C19 | O2 | 121.8° | 120.0° |
| C10 | N1 | C12 | 124.7° | 120.0° |
| N1 | C10 | O1 | 122.6° | 120.0° |
| C10 | N1 | H23 | 117.7° | 120.0° |
| N1 | C12 | C9 | 115.0° | 109.4° |
| N1 | C12 | C11 | 105.0° | 109.5° |
| N1 | C12 | H19 | 107.1° | 109.4° |
| C12 | N1 | H23 | 117.7° | 120.0° |
| C27 | C28 | C29 | 113.6° | 109.5° |
| C27 | C28 | C30 | 110.5° | 109.4° |
| C28 | C27 | H6 | 107.0° | 109.5° |
| C28 | C27 | H7 | 107.0° | 109.4° |
| C27 | C28 | H8 | 107.1° | 109.5° |
| C29 | C28 | C30 | 110.7° | 109.5° |
| C29 | C28 | H8 | 107.3° | 109.5° |
| C28 | C29 | H12 | 109.5° | 109.5° |
| C28 | C29 | H13 | 109.5° | 109.5° |
| C28 | C29 | H14 | 109.4° | 109.5° |
| C9 | C12 | C11 | 116.4° | 109.5° |
| C12 | C9 | H17 | 110.0° | 109.5° |
| C12 | C9 | H18 | 110.0° | 109.4° |
| C9 | C12 | H19 | 106.2° | 109.5° |
| N2 | C14 | O4 | 124.9° | 120.0° |
| N2 | C14 | C15 | 116.6° | 120.1° |
| C14 | N2 | H34 | 117.8° | 119.9° |
| C30 | C28 | H8 | 107.3° | 109.5° |
| C28 | C30 | H9 | 109.5° | 109.5° |
| C28 | C30 | H10 | 109.5° | 109.4° |
| C28 | C30 | H11 | 109.5° | 109.5° |
| O4 | C14 | C15 | 118.4° | 120.0° |
| C11 | C12 | H19 | 106.6° | 109.5° |
| C12 | C11 | H20 | 109.5° | 109.5° |
| C12 | C11 | H21 | 109.4° | 109.4° |
| C12 | C11 | H22 | 109.5° | 109.5° |
| C25 | N4 | C20 | 111.7° | 111.0° |
| C25 | N4 | C26 | 112.0° | 111.0° |
| N4 | C25 | H50 | 109.5° | 109.5° |
| N4 | C25 | H51 | 109.5° | 109.5° |
| N4 | C25 | H52 | 109.5° | 109.4° |
| C20 | C19 | O2 | 109.4° | 120.0° |
| C19 | C20 | N4 | 113.9° | 109.5° |
| C19 | C20 | C21 | 110.2° | 109.5° |
| C19 | C20 | H45 | 103.5° | 109.5° |
| C19 | O2 | C15 | 120.8° | 117.0° |
| C14 | C15 | O2 | 106.6° | 109.5° |
| C14 | C15 | C16 | 116.9° | 109.5° |
| C14 | C15 | H35 | 109.6° | 109.5° |
| N4 | C20 | C21 | 119.8° | 109.4° |
| C20 | N4 | C26 | 123.4° | 111.0° |
| N4 | C20 | H45 | 104.2° | 109.5° |
| C20 | C21 | C22 | 119.2° | 109.5° |
| C20 | C21 | C24 | 114.7° | 109.5° |
| C21 | C20 | H45 | 103.1° | 109.4° |
| C20 | C21 | H53 | 102.9° | 109.5° |
| C21 | C22 | C23 | 122.1° | 109.5° |
| C22 | C21 | C24 | 110.9° | 109.5° |
| C22 | C21 | H53 | 103.2° | 109.5° |
| C21 | C22 | H57 | 106.2° | 109.5° |
| C21 | C22 | H58 | 106.2° | 109.5° |
| C23 | C22 | H57 | 106.2° | 109.5° |
| C23 | C22 | H58 | 106.2° | 109.5° |
| C22 | C23 | H59 | 109.5° | 109.5° |
| C22 | C23 | H60 | 109.5° | 109.4° |
| C22 | C23 | H61 | 109.5° | 109.4° |
| O2 | C15 | C16 | 103.3° | 109.5° |
| O2 | C15 | H35 | 110.5° | 109.4° |
| C15 | C16 | C17 | 117.9° | 109.5° |
| C16 | C15 | H35 | 109.6° | 109.4° |
| C15 | C16 | H36 | 107.3° | 109.4° |
| C15 | C16 | H37 | 107.3° | 109.4° |
| N4 | C26 | H47 | 109.5° | 109.5° |
| N4 | C26 | H48 | 109.5° | 109.5° |
| N4 | C26 | H49 | 109.5° | 109.5° |
| C24 | C21 | H53 | 103.4° | 109.5° |
| C21 | C24 | H54 | 109.5° | 109.5° |
| C21 | C24 | H55 | 109.4° | 109.5° |
| C21 | C24 | H56 | 109.4° | 109.4° |
| C16 | C17 | C18 | 112.6° | 109.5° |
| C16 | C17 | C3 | 110.3° | 109.5° |
| C17 | C16 | H36 | 107.3° | 109.5° |
| C17 | C16 | H37 | 107.3° | 109.5° |
| C16 | C17 | H38 | 106.4° | 109.4° |
| C18 | C17 | C3 | 113.8° | 109.5° |
| C18 | C17 | H38 | 106.3° | 109.5° |
| C17 | C18 | H39 | 109.5° | 109.5° |
| C17 | C18 | H40 | 109.5° | 109.5° |
| C17 | C18 | H41 | 109.5° | 109.5° |
| C3 | C17 | H38 | 106.8° | 109.5° |
| C17 | C3 | H42 | 109.5° | 109.5° |
| C17 | C3 | H43 | 109.4° | 109.5° |
| C17 | C3 | H44 | 109.5° | 109.4° |
| H2 | C32 | H3 | 109.5° | 109.4° |
| H2 | C32 | H4 | 109.5° | 109.5° |
| H3 | C32 | H4 | 109.5° | 109.4° |
| H6 | C27 | H7 | 109.5° | 109.6° |
| H9 | C30 | H10 | 109.5° | 109.4° |
| H9 | C30 | H11 | 109.5° | 109.5° |
| H10 | C30 | H11 | 109.4° | 109.5° |
| H12 | C29 | H13 | 109.5° | 109.5° |
| H12 | C29 | H14 | 109.5° | 109.4° |
| H13 | C29 | H14 | 109.5° | 109.5° |
| H15 | C7 | H16 | 109.5° | 109.5° |
| H17 | C9 | H18 | 109.5° | 109.5° |
| H20 | C11 | H21 | 109.5° | 109.4° |
| H20 | C11 | H22 | 109.4° | 109.5° |
| H21 | C11 | H22 | 109.5° | 109.5° |
| H25 | C13 | H26 | 109.5° | 109.5° |
| H28 | C5 | H29 | 109.5° | 109.5° |
| H28 | C5 | H30 | 109.5° | 109.5° |
| H29 | C5 | H30 | 109.5° | 109.5° |
| H31 | C1 | H32 | 109.5° | 109.5° |
| H31 | C1 | H33 | 109.4° | 109.4° |
| H32 | C1 | H33 | 109.5° | 109.5° |
| H36 | C16 | H37 | 109.5° | 109.5° |
| H39 | C18 | H40 | 109.5° | 109.4° |
| H39 | C18 | H41 | 109.5° | 109.5° |
| H40 | C18 | H41 | 109.5° | 109.5° |
| H42 | C3 | H43 | 109.5° | 109.5° |
| H42 | C3 | H44 | 109.4° | 109.5° |
| H43 | C3 | H44 | 109.5° | 109.5° |
| H47 | C26 | H48 | 109.5° | 109.4° |
| H47 | C26 | H49 | 109.5° | 109.4° |
| H48 | C26 | H49 | 109.4° | 109.5° |
| H50 | C25 | H51 | 109.5° | 109.5° |
| H50 | C25 | H52 | 109.5° | 109.5° |
| H51 | C25 | H52 | 109.5° | 109.5° |
| H54 | C24 | H55 | 109.5° | 109.4° |
| H54 | C24 | H56 | 109.5° | 109.5° |
| H55 | C24 | H56 | 109.5° | 109.4° |
| H57 | C22 | H58 | 109.5° | 109.5° |
| H59 | C23 | H60 | 109.5° | 109.4° |
| H59 | C23 | H61 | 109.5° | 109.5° |
| H60 | C23 | H61 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C34 | C33 | N3 | 176.6° | 180.0° |
| O6 | C34 | C33 | C31 | 179.0° | 180.0° |
| O6 | C34 | N3 | C4 | 177.2° | 180.0° |
| O6 | C34 | N3 | C2 | 6.7° | 0.3° |
| O6 | C34 | C33 | H1 | 1.0° | 0.1° |
| C34 | C33 | C31 | H1 | 180.0° | 179.9° |
| C34 | C33 | C31 | O5 | 179.6° | 180.0° |
| C34 | C33 | C31 | C4 | 1.3° | 0.0° |
| C33 | C34 | N3 | C4 | 6.0° | 0.0° |
| C33 | C34 | N3 | C2 | 176.5° | 179.7° |
| C33 | C31 | O5 | C32 | 27.2° | 0.1° |
| C31 | C33 | C34 | N3 | 4.4° | 0.0° |
| C33 | C31 | O5 | C4 | 178.2° | 179.9° |
| C33 | C31 | C4 | N3 | 2.1° | 0.1° |
| C33 | C31 | C4 | C27 | 126.8° | 119.0° |
| C33 | C31 | C4 | H5 | 112.0° | 118.7° |
| C32 | O5 | C31 | C4 | 151.0° | 180.0° |
| O5 | C32 | H2 | H3 | 120.0° | 120.0° |
| O5 | C32 | H2 | H4 | 120.0° | 120.0° |
| O5 | C32 | H3 | H4 | 120.0° | 120.0° |
| C5 | C8 | C1 | C13 | 123.4° | 120.0° |
| C5 | C8 | C1 | H27 | 118.7° | 120.1° |
| C5 | C8 | C13 | H27 | 117.0° | 120.0° |
| C5 | C8 | C13 | C6 | 73.0° | 64.4° |
| C5 | C8 | C13 | H25 | 47.8° | 55.6° |
| C5 | C8 | C13 | H26 | 166.1° | 175.6° |
| C8 | C5 | H28 | H29 | 120.0° | 120.0° |
| C8 | C5 | H28 | H30 | 120.0° | 120.0° |
| C8 | C5 | H29 | H30 | 120.0° | 120.0° |
| C5 | C8 | C1 | H31 | 180.0° | 179.9° |
| C5 | C8 | C1 | H32 | 60.0° | 60.0° |
| C5 | C8 | C1 | H33 | 60.0° | 60.0° |
| C34 | N3 | C4 | C31 | 4.9° | 0.1° |
| C34 | N3 | C4 | C2 | 170.8° | 179.7° |
| C34 | N3 | C4 | C27 | 125.3° | 119.1° |
| C34 | N3 | C2 | C7 | 10.2° | 4.3° |
| C34 | N3 | C2 | O7 | 166.9° | 175.4° |
| N3 | C34 | C33 | H1 | 175.6° | 179.9° |
| C34 | N3 | C4 | H5 | 108.9° | 118.6° |
| O5 | C31 | C4 | N3 | 176.4° | 180.0° |
| O5 | C31 | C4 | C27 | 51.7° | 61.1° |
| O5 | C31 | C33 | H1 | 0.4° | 0.1° |
| C31 | O5 | C32 | H2 | 180.0° | 60.0° |
| C31 | O5 | C32 | H3 | 60.0° | 60.0° |
| C31 | O5 | C32 | H4 | 60.0° | 180.0° |
| O5 | C31 | C4 | H5 | 69.5° | 61.2° |
| C31 | C4 | N3 | C27 | 120.4° | 119.1° |
| C31 | C4 | N3 | H5 | 113.8° | 118.7° |
| C31 | C4 | N3 | C2 | 175.7° | 179.8° |
| C31 | C4 | C27 | H5 | 121.3° | 122.2° |
| C31 | C4 | C27 | C28 | 50.6° | 50.2° |
| C4 | C31 | C33 | H1 | 178.7° | 179.9° |
| C31 | C4 | C27 | H6 | 70.8° | 69.8° |
| C31 | C4 | C27 | H7 | 172.0° | 170.1° |
| C1 | C8 | C13 | H27 | 118.0° | 120.0° |
| C1 | C8 | C13 | C6 | 162.0° | 175.6° |
| C1 | C8 | C13 | H25 | 77.2° | 64.4° |
| C1 | C8 | C13 | H26 | 41.1° | 55.6° |
| C1 | C8 | C5 | H28 | 180.0° | 56.2° |
| C1 | C8 | C5 | H29 | 60.0° | 63.8° |
| C1 | C8 | C5 | H30 | 60.0° | 176.2° |
| C8 | C1 | H31 | H32 | 120.0° | 120.0° |
| C8 | C1 | H31 | H33 | 120.0° | 120.0° |
| C8 | C1 | H32 | H33 | 120.0° | 120.0° |
| C8 | C13 | C6 | H25 | 120.8° | 120.0° |
| C8 | C13 | C6 | H26 | 120.9° | 120.0° |
| C8 | C13 | C6 | N2 | 61.8° | 179.0° |
| C8 | C13 | C6 | C10 | 173.4° | 61.1° |
| C8 | C13 | C6 | H24 | 58.0° | 59.0° |
| C8 | C13 | H25 | H26 | 117.4° | 120.0° |
| C13 | C8 | C5 | H28 | 55.3° | 63.8° |
| C13 | C8 | C5 | H29 | 175.3° | 176.2° |
| C13 | C8 | C5 | H30 | 64.7° | 56.2° |
| C13 | C8 | C1 | H31 | 56.6° | 60.0° |
| C13 | C8 | C1 | H32 | 63.4° | 180.0° |
| C13 | C8 | C1 | H33 | 176.6° | 60.0° |
| N3 | C4 | C27 | H5 | 126.0° | 122.3° |
| C4 | N3 | C2 | C7 | 179.9° | 175.3° |
| C4 | N3 | C2 | O7 | 2.8° | 4.9° |
| N3 | C4 | C27 | C28 | 62.1° | 65.4° |
| N3 | C4 | C27 | H6 | 176.5° | 174.7° |
| N3 | C4 | C27 | H7 | 59.3° | 54.6° |
| C2 | N3 | C4 | C27 | 63.9° | 61.2° |
| N3 | C2 | C7 | O7 | 177.0° | 179.7° |
| N3 | C2 | C7 | C9 | 157.1° | 179.7° |
| C2 | N3 | C4 | H5 | 61.8° | 61.1° |
| N3 | C2 | C7 | H15 | 83.5° | 60.3° |
| N3 | C2 | C7 | H16 | 37.7° | 59.8° |
| C4 | C27 | C28 | H6 | 121.4° | 120.0° |
| C4 | C27 | C28 | H7 | 121.4° | 119.9° |
| C4 | C27 | C28 | C29 | 94.2° | 72.4° |
| C4 | C27 | C28 | C30 | 140.7° | 167.6° |
| C4 | C27 | H6 | H7 | 115.5° | 120.0° |
| C4 | C27 | C28 | H8 | 24.1° | 47.7° |
| C2 | C7 | C9 | H15 | 119.3° | 120.0° |
| C2 | C7 | C9 | H16 | 119.3° | 120.0° |
| C2 | C7 | C9 | C12 | 105.5° | 180.0° |
| C2 | C7 | H15 | H16 | 121.9° | 120.0° |
| C2 | C7 | C9 | H17 | 14.2° | 60.0° |
| C2 | C7 | C9 | H18 | 134.8° | 60.0° |
| C9 | C7 | C2 | O7 | 25.9° | 0.0° |
| C7 | C9 | C12 | N1 | 66.4° | 65.0° |
| C7 | C9 | C12 | H17 | 119.7° | 120.1° |
| C7 | C9 | C12 | H18 | 119.7° | 120.0° |
| C7 | C9 | C12 | C11 | 57.0° | 175.0° |
| C9 | C7 | H15 | H16 | 121.9° | 120.0° |
| C7 | C9 | H17 | H18 | 120.9° | 120.0° |
| C7 | C9 | C12 | H19 | 175.4° | 54.9° |
| O7 | C2 | C7 | H15 | 93.5° | 120.0° |
| O7 | C2 | C7 | H16 | 145.3° | 120.0° |
| C13 | C6 | N2 | C10 | 123.0° | 120.0° |
| C13 | C6 | N2 | H24 | 119.2° | 120.0° |
| C13 | C6 | C10 | H24 | 115.5° | 120.1° |
| C13 | C6 | C10 | N1 | 106.0° | 85.5° |
| C13 | C6 | N2 | C14 | 170.7° | 88.2° |
| C13 | C6 | C10 | O1 | 69.6° | 94.4° |
| C6 | C13 | H25 | H26 | 117.3° | 120.0° |
| C6 | C13 | C8 | H27 | 44.0° | 55.5° |
| C13 | C6 | N2 | H34 | 9.3° | 91.7° |
| N2 | C6 | C10 | H24 | 118.4° | 119.9° |
| N2 | C6 | C10 | N1 | 127.9° | 154.6° |
| C6 | N2 | C14 | H34 | 180.0° | 179.9° |
| N2 | C6 | C10 | O1 | 56.6° | 25.6° |
| C6 | N2 | C14 | O4 | 8.3° | 5.6° |
| C6 | N2 | C14 | C15 | 168.2° | 174.4° |
| N2 | C6 | C13 | H25 | 177.3° | 59.0° |
| N2 | C6 | C13 | H26 | 59.1° | 61.1° |
| C6 | C10 | N1 | O1 | 175.3° | 179.9° |
| C6 | C10 | N1 | C12 | 178.9° | 174.2° |
| C10 | C6 | N2 | C14 | 47.7° | 151.7° |
| C6 | C10 | N1 | H23 | 1.1° | 5.7° |
| C10 | C6 | C13 | H25 | 52.6° | 179.0° |
| C10 | C6 | C13 | H26 | 65.7° | 58.9° |
| C10 | C6 | N2 | H34 | 132.3° | 28.3° |
| O3 | C19 | C20 | O2 | 179.0° | 179.9° |
| O3 | C19 | C20 | N4 | 121.4° | 6.8° |
| O3 | C19 | C20 | C21 | 100.7° | 113.1° |
| O3 | C19 | O2 | C15 | 4.8° | 5.1° |
| O3 | C19 | C20 | H45 | 9.0° | 126.9° |
| C10 | N1 | C12 | H23 | 180.0° | 179.9° |
| C10 | N1 | C12 | C9 | 122.7° | 155.1° |
| C10 | N1 | C12 | C11 | 108.1° | 84.9° |
| C10 | N1 | C12 | H19 | 5.0° | 35.1° |
| N1 | C10 | C6 | H24 | 9.5° | 34.6° |
| N1 | C12 | C9 | C11 | 123.4° | 120.0° |
| N1 | C12 | C9 | H19 | 118.2° | 119.9° |
| C12 | N1 | C10 | O1 | 3.6° | 6.0° |
| N1 | C12 | C11 | H19 | 113.4° | 120.0° |
| N1 | C12 | C9 | H17 | 173.9° | 55.1° |
| N1 | C12 | C9 | H18 | 53.3° | 175.0° |
| N1 | C12 | C11 | H20 | 180.0° | 60.0° |
| N1 | C12 | C11 | H21 | 60.0° | 179.9° |
| N1 | C12 | C11 | H22 | 60.0° | 60.1° |
| C27 | C28 | C29 | C30 | 125.0° | 120.0° |
| C27 | C28 | C29 | H8 | 118.2° | 120.0° |
| C27 | C28 | C30 | H8 | 116.5° | 120.0° |
| C28 | C27 | C4 | H5 | 171.9° | 172.4° |
| C28 | C27 | H6 | H7 | 115.5° | 120.0° |
| C27 | C28 | C30 | H9 | 180.0° | 60.0° |
| C27 | C28 | C30 | H10 | 60.0° | 180.0° |
| C27 | C28 | C30 | H11 | 60.0° | 60.0° |
| C27 | C28 | C29 | H12 | 180.0° | 58.8° |
| C27 | C28 | C29 | H13 | 60.0° | 61.3° |
| C27 | C28 | C29 | H14 | 60.0° | 178.7° |
| C29 | C28 | C30 | H8 | 116.8° | 120.1° |
| C29 | C28 | C27 | H6 | 27.2° | 167.7° |
| C29 | C28 | C27 | H7 | 144.4° | 47.6° |
| C29 | C28 | C30 | H9 | 53.3° | 59.9° |
| C29 | C28 | C30 | H10 | 66.7° | 60.0° |
| C29 | C28 | C30 | H11 | 173.3° | 180.0° |
| C28 | C29 | H12 | H13 | 120.0° | 120.0° |
| C28 | C29 | H12 | H14 | 120.0° | 120.0° |
| C28 | C29 | H13 | H14 | 119.9° | 120.0° |
| C9 | C12 | C11 | H19 | 118.2° | 120.1° |
| C12 | C9 | C7 | H15 | 135.2° | 60.0° |
| C12 | C9 | C7 | H16 | 13.9° | 60.1° |
| C12 | C9 | H17 | H18 | 120.9° | 119.9° |
| C9 | C12 | C11 | H20 | 51.6° | 59.9° |
| C9 | C12 | C11 | H21 | 171.6° | 60.0° |
| C9 | C12 | C11 | H22 | 68.4° | 180.0° |
| C9 | C12 | N1 | H23 | 57.3° | 25.1° |
| N2 | C14 | O4 | C15 | 176.4° | 180.0° |
| N2 | C14 | C15 | O2 | 163.5° | 160.8° |
| N2 | C14 | C15 | C16 | 81.6° | 79.1° |
| C14 | N2 | C6 | H24 | 70.1° | 31.8° |
| N2 | C14 | C15 | H35 | 43.9° | 40.8° |
| C30 | C28 | C27 | H6 | 97.9° | 47.6° |
| C30 | C28 | C27 | H7 | 19.3° | 72.4° |
| C28 | C30 | H9 | H10 | 120.0° | 119.9° |
| C28 | C30 | H9 | H11 | 120.0° | 120.1° |
| C28 | C30 | H10 | H11 | 120.0° | 120.0° |
| C30 | C28 | C29 | H12 | 55.0° | 61.2° |
| C30 | C28 | C29 | H13 | 175.0° | 178.8° |
| C30 | C28 | C29 | H14 | 65.0° | 58.7° |
| O1 | C10 | N1 | H23 | 176.5° | 174.2° |
| O1 | C10 | C6 | H24 | 174.9° | 145.5° |
| O4 | C14 | C15 | O2 | 19.8° | 19.1° |
| O4 | C14 | C15 | C16 | 95.2° | 100.9° |
| O4 | C14 | N2 | H34 | 171.7° | 174.5° |
| O4 | C14 | C15 | H35 | 139.4° | 139.2° |
| C11 | C12 | C9 | H17 | 62.7° | 64.9° |
| C11 | C12 | C9 | H18 | 176.7° | 55.0° |
| C12 | C11 | H20 | H21 | 120.0° | 120.0° |
| C12 | C11 | H20 | H22 | 120.0° | 120.1° |
| C12 | C11 | H21 | H22 | 120.0° | 120.0° |
| C11 | C12 | N1 | H23 | 71.9° | 94.9° |
| C25 | N4 | C20 | C19 | 61.0° | 62.7° |
| C25 | N4 | C20 | C26 | 138.2° | 124.0° |
| C25 | N4 | C20 | C21 | 165.4° | 57.3° |
| C25 | N4 | C20 | H45 | 51.0° | 177.2° |
| C25 | N4 | C26 | H47 | 180.0° | 58.0° |
| C25 | N4 | C26 | H48 | 60.0° | 61.9° |
| C25 | N4 | C26 | H49 | 60.0° | 178.0° |
| N4 | C25 | H50 | H51 | 120.0° | 120.0° |
| N4 | C25 | H50 | H52 | 120.0° | 119.9° |
| N4 | C25 | H51 | H52 | 120.0° | 120.0° |
| C19 | C20 | N4 | C21 | 133.5° | 120.0° |
| C19 | C20 | N4 | H45 | 112.0° | 120.1° |
| C19 | C20 | C21 | H45 | 110.0° | 120.0° |
| C19 | C20 | C21 | C22 | 52.7° | 180.0° |
| C20 | C19 | O2 | C15 | 174.3° | 174.9° |
| C19 | C20 | N4 | C26 | 77.1° | 61.3° |
| C19 | C20 | C21 | C24 | 82.3° | 60.0° |
| C19 | C20 | C21 | H53 | 166.1° | 60.0° |
| C19 | O2 | C15 | C14 | 75.4° | 146.6° |
| O2 | C19 | C20 | N4 | 59.5° | 173.1° |
| O2 | C19 | C20 | C21 | 78.3° | 66.9° |
| C19 | O2 | C15 | C16 | 160.8° | 93.4° |
| C19 | O2 | C15 | H35 | 43.6° | 26.5° |
| O2 | C19 | C20 | H45 | 172.0° | 53.1° |
| C14 | C15 | O2 | C16 | 123.8° | 120.0° |
| C14 | C15 | O2 | H35 | 119.0° | 120.1° |
| C14 | C15 | C16 | H35 | 125.5° | 120.0° |
| C14 | C15 | C16 | C17 | 174.5° | 66.9° |
| C15 | C14 | N2 | H34 | 11.8° | 5.5° |
| C14 | C15 | C16 | H36 | 53.3° | 173.1° |
| C14 | C15 | C16 | H37 | 64.2° | 53.1° |
| N4 | C20 | C21 | H45 | 115.0° | 120.0° |
| N4 | C20 | C21 | C22 | 172.3° | 60.0° |
| N4 | C20 | C21 | C24 | 52.7° | 180.0° |
| C20 | N4 | C26 | H47 | 42.0° | 65.9° |
| C20 | N4 | C26 | H48 | 162.0° | 174.1° |
| C20 | N4 | C26 | H49 | 78.1° | 54.0° |
| C20 | N4 | C25 | H50 | 180.0° | 52.7° |
| C20 | N4 | C25 | H51 | 60.0° | 172.7° |
| C20 | N4 | C25 | H52 | 60.0° | 67.3° |
| N4 | C20 | C21 | H53 | 58.9° | 60.0° |
| C20 | C21 | C22 | C24 | 136.6° | 120.0° |
| C20 | C21 | C22 | H53 | 113.3° | 120.0° |
| C20 | C21 | C22 | C23 | 180.0° | 175.0° |
| C21 | C20 | N4 | C26 | 56.4° | 178.7° |
| C20 | C21 | C24 | H53 | 111.3° | 120.0° |
| C20 | C21 | C24 | H54 | 180.0° | 60.0° |
| C20 | C21 | C24 | H55 | 60.0° | 180.0° |
| C20 | C21 | C24 | H56 | 60.0° | 60.0° |
| C20 | C21 | C22 | H57 | 58.3° | 65.0° |
| C20 | C21 | C22 | H58 | 58.2° | 55.0° |
| C21 | C22 | C23 | H57 | 121.7° | 120.0° |
| C21 | C22 | C23 | H58 | 121.8° | 120.0° |
| C22 | C21 | C24 | H53 | 110.0° | 120.0° |
| C22 | C21 | C20 | H45 | 57.3° | 60.0° |
| C22 | C21 | C24 | H54 | 41.3° | 60.0° |
| C22 | C21 | C24 | H55 | 161.3° | 60.0° |
| C22 | C21 | C24 | H56 | 78.7° | 180.0° |
| C21 | C22 | H57 | H58 | 114.3° | 120.0° |
| C21 | C22 | C23 | H59 | 180.0° | 60.0° |
| C21 | C22 | C23 | H60 | 60.0° | 180.0° |
| C21 | C22 | C23 | H61 | 60.0° | 60.0° |
| C23 | C22 | C21 | C24 | 43.4° | 65.0° |
| C23 | C22 | C21 | H53 | 66.7° | 55.0° |
| C23 | C22 | H57 | H58 | 114.3° | 120.0° |
| C22 | C23 | H59 | H60 | 120.0° | 119.9° |
| C22 | C23 | H59 | H61 | 120.0° | 120.0° |
| C22 | C23 | H60 | H61 | 120.0° | 120.0° |
| O2 | C15 | C16 | H35 | 117.9° | 119.9° |
| O2 | C15 | C16 | C17 | 57.9° | 173.0° |
| O2 | C15 | C16 | H36 | 63.4° | 53.1° |
| O2 | C15 | C16 | H37 | 179.1° | 66.9° |
| C15 | C16 | C17 | H36 | 121.2° | 120.0° |
| C15 | C16 | C17 | H37 | 121.2° | 120.0° |
| C15 | C16 | C17 | C18 | 46.1° | 66.5° |
| C15 | C16 | C17 | C3 | 174.4° | 173.5° |
| C15 | C16 | H36 | H37 | 116.2° | 119.9° |
| C15 | C16 | C17 | H38 | 70.1° | 53.5° |
| C26 | N4 | C20 | H45 | 170.8° | 58.8° |
| N4 | C26 | H47 | H48 | 120.0° | 120.0° |
| N4 | C26 | H47 | H49 | 120.0° | 120.0° |
| N4 | C26 | H48 | H49 | 120.0° | 120.1° |
| C26 | N4 | C25 | H50 | 36.9° | 176.6° |
| C26 | N4 | C25 | H51 | 156.9° | 63.3° |
| C26 | N4 | C25 | H52 | 83.1° | 56.7° |
| C24 | C21 | C20 | H45 | 167.7° | 60.0° |
| C21 | C24 | H54 | H55 | 120.0° | 120.0° |
| C21 | C24 | H54 | H56 | 120.0° | 120.0° |
| C21 | C24 | H55 | H56 | 119.9° | 119.9° |
| C24 | C21 | C22 | H57 | 78.3° | 55.0° |
| C24 | C21 | C22 | H58 | 165.2° | 175.0° |
| C16 | C17 | C18 | C3 | 126.5° | 120.0° |
| C16 | C17 | C18 | H38 | 116.2° | 120.0° |
| C16 | C17 | C3 | H38 | 115.3° | 119.9° |
| C17 | C16 | C15 | H35 | 60.0° | 53.1° |
| C17 | C16 | H36 | H37 | 116.2° | 120.1° |
| C16 | C17 | C18 | H39 | 180.0° | 174.6° |
| C16 | C17 | C18 | H40 | 60.0° | 65.4° |
| C16 | C17 | C18 | H41 | 60.0° | 54.6° |
| C16 | C17 | C3 | H42 | 180.0° | 60.0° |
| C16 | C17 | C3 | H43 | 60.0° | 180.0° |
| C16 | C17 | C3 | H44 | 60.0° | 60.0° |
| C18 | C17 | C3 | H38 | 117.0° | 120.0° |
| C18 | C17 | C16 | H36 | 167.3° | 53.4° |
| C18 | C17 | C16 | H37 | 75.2° | 173.5° |
| C17 | C18 | H39 | H40 | 120.0° | 120.0° |
| C17 | C18 | H39 | H41 | 120.0° | 120.0° |
| C17 | C18 | H40 | H41 | 120.0° | 120.0° |
| C18 | C17 | C3 | H42 | 52.3° | 180.0° |
| C18 | C17 | C3 | H43 | 172.3° | 60.0° |
| C18 | C17 | C3 | H44 | 67.7° | 60.0° |
| C3 | C17 | C16 | H36 | 64.4° | 66.6° |
| C3 | C17 | C16 | H37 | 53.2° | 53.5° |
| C3 | C17 | C18 | H39 | 53.5° | 54.6° |
| C3 | C17 | C18 | H40 | 66.5° | 174.6° |
| C3 | C17 | C18 | H41 | 173.5° | 65.4° |
| C17 | C3 | H42 | H43 | 120.0° | 120.0° |
| C17 | C3 | H42 | H44 | 120.0° | 119.9° |
| C17 | C3 | H43 | H44 | 120.0° | 120.0° |
| H2 | C32 | H3 | H4 | 120.0° | 120.0° |
| H5 | C4 | C27 | H6 | 50.5° | 52.4° |
| H5 | C4 | C27 | H7 | 66.7° | 67.7° |
| H6 | C27 | C28 | H8 | 145.5° | 72.3° |
| H7 | C27 | C28 | H8 | 97.3° | 167.6° |
| H8 | C28 | C30 | H9 | 63.5° | 180.0° |
| H8 | C28 | C30 | H10 | 176.4° | 60.1° |
| H8 | C28 | C30 | H11 | 56.5° | 59.9° |
| H8 | C28 | C29 | H12 | 61.8° | 178.8° |
| H8 | C28 | C29 | H13 | 58.2° | 58.7° |
| H8 | C28 | C29 | H14 | 178.2° | 61.3° |
| H9 | C30 | H10 | H11 | 120.0° | 120.0° |
| H12 | C29 | H13 | H14 | 120.0° | 120.0° |
| H15 | C7 | C9 | H17 | 105.1° | 180.0° |
| H15 | C7 | C9 | H18 | 15.5° | 60.0° |
| H16 | C7 | C9 | H17 | 133.6° | 60.0° |
| H16 | C7 | C9 | H18 | 105.8° | 180.0° |
| H17 | C9 | C12 | H19 | 55.7° | 175.0° |
| H18 | C9 | C12 | H19 | 64.9° | 65.0° |
| H19 | C12 | C11 | H20 | 66.6° | 180.0° |
| H19 | C12 | C11 | H21 | 53.4° | 60.1° |
| H19 | C12 | C11 | H22 | 173.4° | 59.9° |
| H19 | C12 | N1 | H23 | 175.0° | 145.0° |
| H20 | C11 | H21 | H22 | 120.0° | 120.0° |
| H24 | C6 | C13 | H25 | 62.9° | 61.0° |
| H24 | C6 | C13 | H26 | 178.8° | 178.9° |
| H24 | C6 | N2 | H34 | 109.9° | 148.3° |
| H25 | C13 | C8 | H27 | 164.9° | 175.5° |
| H26 | C13 | C8 | H27 | 76.9° | 64.4° |
| H27 | C8 | C5 | H28 | 61.4° | 176.3° |
| H27 | C8 | C5 | H29 | 58.5° | 56.3° |
| H27 | C8 | C5 | H30 | 178.5° | 63.7° |
| H27 | C8 | C1 | H31 | 61.3° | 60.0° |
| H27 | C8 | C1 | H32 | 178.7° | 60.0° |
| H27 | C8 | C1 | H33 | 58.7° | 180.0° |
| H28 | C5 | H29 | H30 | 120.0° | 120.0° |
| H31 | C1 | H32 | H33 | 120.0° | 120.0° |
| H35 | C15 | C16 | H36 | 178.8° | 66.9° |
| H35 | C15 | C16 | H37 | 61.2° | 173.2° |
| H36 | C16 | C17 | H38 | 51.1° | 173.5° |
| H37 | C16 | C17 | H38 | 168.7° | 66.5° |
| H38 | C17 | C18 | H39 | 63.8° | 65.4° |
| H38 | C17 | C18 | H40 | 176.2° | 54.6° |
| H38 | C17 | C18 | H41 | 56.2° | 174.5° |
| H38 | C17 | C3 | H42 | 64.7° | 60.0° |
| H38 | C17 | C3 | H43 | 55.3° | 60.0° |
| H38 | C17 | C3 | H44 | 175.3° | 179.9° |
| H39 | C18 | H40 | H41 | 120.0° | 120.0° |
| H42 | C3 | H43 | H44 | 120.0° | 120.0° |
| H45 | C20 | C21 | H53 | 56.1° | 180.0° |
| H47 | C26 | H48 | H49 | 120.0° | 119.9° |
| H50 | C25 | H51 | H52 | 120.0° | 120.0° |
| H53 | C21 | C24 | H54 | 68.7° | 180.0° |
| H53 | C21 | C24 | H55 | 51.3° | 60.0° |
| H53 | C21 | C24 | H56 | 171.3° | 60.0° |
| H53 | C21 | C22 | H57 | 171.6° | 175.0° |
| H53 | C21 | C22 | H58 | 55.1° | 65.0° |
| H54 | C24 | H55 | H56 | 120.0° | 120.0° |
| H57 | C22 | C23 | H59 | 58.3° | 60.0° |
| H57 | C22 | C23 | H60 | 178.3° | 60.0° |
| H57 | C22 | C23 | H61 | 61.8° | 180.0° |
| H58 | C22 | C23 | H59 | 58.2° | 180.0° |
| H58 | C22 | C23 | H60 | 61.8° | 60.1° |
| H58 | C22 | C23 | H61 | 178.2° | 59.9° |
| H59 | C23 | H60 | H61 | 120.0° | 120.1° |
