E6V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C97 | C95 | sing | 1.53Å | 1.53Å | |
| C90 | C91 | doub | 1.38Å | 1.38Å | Aromatic |
| C90 | C93 | sing | 1.38Å | 1.39Å | Aromatic |
| C96 | C95 | sing | 1.53Å | 1.53Å | |
| C95 | C93 | sing | 1.51Å | 1.50Å | |
| C91 | C89 | sing | 1.39Å | 1.39Å | Aromatic |
| C93 | C92 | doub | 1.38Å | 1.39Å | Aromatic |
| C89 | O88 | sing | 1.36Å | 1.37Å | |
| C89 | C94 | doub | 1.38Å | 1.39Å | Aromatic |
| O88 | C85 | sing | 1.43Å | 1.44Å | |
| C92 | C94 | sing | 1.39Å | 1.39Å | Aromatic |
| C87 | C85 | sing | 1.53Å | 1.52Å | |
| C94 | C83 | sing | 1.51Å | 1.52Å | |
| C85 | C86 | sing | 1.53Å | 1.51Å | |
| C85 | C84 | sing | 1.53Å | 1.53Å | |
| C83 | C84 | sing | 1.53Å | 1.54Å | |
| C83 | N82 | sing | 1.47Å | 1.50Å | |
| N82 | C48 | sing | 1.47Å | 1.48Å | |
| C48 | C44 | sing | 1.53Å | 1.54Å | |
| O46 | C44 | sing | 1.43Å | 1.43Å | |
| O76 | C4 | doub | 1.22Å | 1.23Å | |
| C44 | C7 | sing | 1.52Å | 1.53Å | |
| C7 | C9 | sing | 1.52Å | 1.54Å | |
| C7 | N5 | sing | 1.48Å | 1.47Å | |
| C40 | C12 | sing | 1.53Å | 1.52Å | |
| C4 | N5 | sing | 1.36Å | 1.33Å | |
| C4 | C2 | sing | 1.51Å | 1.55Å | |
| C9 | C12 | sing | 1.53Å | 1.53Å | |
| C77 | C2 | sing | 1.52Å | 1.54Å | |
| C12 | C14 | sing | 1.53Å | 1.54Å | |
| C2 | N1 | sing | 1.47Å | 1.47Å | |
| C81 | N1 | sing | 1.48Å | 1.47Å | |
| C14 | C17 | sing | 1.53Å | 1.52Å | |
| N1 | C38 | sing | 1.36Å | 1.35Å | |
| C17 | C20 | sing | 1.53Å | 1.52Å | |
| C38 | O39 | doub | 1.21Å | 1.22Å | |
| C38 | C35 | sing | 1.51Å | 1.53Å | |
| C20 | C23 | sing | 1.53Å | 1.59Å | |
| C35 | C32 | sing | 1.53Å | 1.56Å | |
| C23 | C26 | sing | 1.53Å | 1.58Å | |
| C32 | C29 | sing | 1.53Å | 1.54Å | |
| C29 | C26 | sing | 1.53Å | 1.54Å | |
| C2 | H1 | sing | 1.11Å | 1.10Å | |
| C7 | H2 | sing | 1.11Å | 1.10Å | |
| C9 | H3 | sing | 1.10Å | 1.10Å | |
| C9 | H4 | sing | 1.10Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C14 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C32 | H10 | sing | 1.09Å | 1.10Å | |
| C32 | H11 | sing | 1.09Å | 1.10Å | |
| C35 | H12 | sing | 1.09Å | 1.10Å | |
| C35 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.08Å | 1.10Å | |
| C17 | H15 | sing | 1.10Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C26 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C29 | H20 | sing | 1.09Å | 1.10Å | |
| C29 | H21 | sing | 1.09Å | 1.10Å | |
| C40 | H22 | sing | 1.09Å | 1.10Å | |
| C40 | H23 | sing | 1.09Å | 1.10Å | |
| C40 | H24 | sing | 1.09Å | 1.10Å | |
| C44 | H25 | sing | 1.09Å | 1.10Å | |
| C48 | H26 | sing | 1.09Å | 1.10Å | |
| C48 | H27 | sing | 1.09Å | 1.10Å | |
| C77 | H28 | sing | 1.09Å | 1.10Å | |
| C77 | H29 | sing | 1.09Å | 1.10Å | |
| C77 | H30 | sing | 1.09Å | 1.10Å | |
| C81 | H31 | sing | 1.09Å | 1.10Å | |
| C81 | H32 | sing | 1.09Å | 1.10Å | |
| C81 | H33 | sing | 1.09Å | 1.10Å | |
| C83 | H34 | sing | 1.09Å | 1.10Å | |
| C84 | H35 | sing | 1.09Å | 1.10Å | |
| C84 | H36 | sing | 1.09Å | 1.10Å | |
| C86 | H37 | sing | 1.09Å | 1.10Å | |
| C86 | H38 | sing | 1.09Å | 1.10Å | |
| C86 | H39 | sing | 1.09Å | 1.10Å | |
| C87 | H40 | sing | 1.09Å | 1.10Å | |
| C87 | H41 | sing | 1.09Å | 1.10Å | |
| C87 | H42 | sing | 1.09Å | 1.10Å | |
| C90 | H43 | sing | 1.08Å | 1.08Å | |
| C91 | H44 | sing | 1.08Å | 1.08Å | |
| C92 | H45 | sing | 1.08Å | 1.08Å | |
| C95 | H46 | sing | 1.09Å | 1.10Å | |
| C96 | H47 | sing | 1.09Å | 1.10Å | |
| C96 | H48 | sing | 1.09Å | 1.10Å | |
| C96 | H49 | sing | 1.09Å | 1.10Å | |
| C97 | H50 | sing | 1.09Å | 1.10Å | |
| C97 | H51 | sing | 1.09Å | 1.10Å | |
| C97 | H52 | sing | 1.09Å | 1.10Å | |
| N5 | H53 | sing | 0.98Å | 1.00Å | |
| N82 | H54 | sing | 1.01Å | 1.00Å | |
| O46 | H56 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C97 | C95 | C96 | 109.9° | 109.5° |
| C97 | C95 | C93 | 110.4° | 109.5° |
| C97 | C95 | H46 | 108.6° | 109.5° |
| C95 | C97 | H50 | 109.5° | 109.5° |
| C95 | C97 | H51 | 109.5° | 109.5° |
| C95 | C97 | H52 | 109.5° | 109.5° |
| C91 | C90 | C93 | 120.8° | 120.0° |
| C90 | C91 | C89 | 119.5° | 120.2° |
| C91 | C90 | H43 | 119.6° | 120.0° |
| C90 | C91 | H44 | 120.3° | 119.9° |
| C90 | C93 | C95 | 120.4° | 120.0° |
| C90 | C93 | C92 | 118.7° | 120.0° |
| C93 | C90 | H43 | 119.6° | 120.0° |
| C96 | C95 | C93 | 110.3° | 109.5° |
| C96 | C95 | H46 | 108.6° | 109.5° |
| C95 | C96 | H47 | 109.5° | 109.4° |
| C95 | C96 | H48 | 109.5° | 109.5° |
| C95 | C96 | H49 | 109.5° | 109.5° |
| C95 | C93 | C92 | 121.0° | 120.0° |
| C93 | C95 | H46 | 109.0° | 109.4° |
| C91 | C89 | O88 | 116.2° | 118.5° |
| C91 | C89 | C94 | 121.3° | 119.7° |
| C89 | C91 | H44 | 120.3° | 119.9° |
| C93 | C92 | C94 | 122.1° | 120.3° |
| C93 | C92 | H45 | 119.0° | 119.9° |
| O88 | C89 | C94 | 122.5° | 121.8° |
| C89 | O88 | C85 | 117.3° | 117.8° |
| C89 | C94 | C92 | 117.5° | 119.8° |
| C89 | C94 | C83 | 121.3° | 121.4° |
| O88 | C85 | C87 | 106.9° | 109.7° |
| O88 | C85 | C86 | 106.1° | 109.6° |
| O88 | C85 | C84 | 107.3° | 108.4° |
| C92 | C94 | C83 | 121.1° | 118.8° |
| C94 | C92 | H45 | 118.9° | 119.8° |
| C87 | C85 | C86 | 110.4° | 109.6° |
| C87 | C85 | C84 | 113.2° | 109.7° |
| C85 | C87 | H40 | 109.5° | 109.5° |
| C85 | C87 | H41 | 109.5° | 109.5° |
| C85 | C87 | H42 | 109.5° | 109.5° |
| C94 | C83 | C84 | 109.8° | 109.7° |
| C94 | C83 | N82 | 108.7° | 109.4° |
| C94 | C83 | H34 | 108.2° | 109.4° |
| C86 | C85 | C84 | 112.4° | 109.7° |
| C85 | C86 | H37 | 109.5° | 109.5° |
| C85 | C86 | H38 | 109.4° | 109.5° |
| C85 | C86 | H39 | 109.5° | 109.5° |
| C85 | C84 | C83 | 112.7° | 108.3° |
| C85 | C84 | H35 | 108.7° | 109.7° |
| C85 | C84 | H36 | 108.7° | 109.7° |
| C84 | C83 | N82 | 113.4° | 109.4° |
| C84 | C83 | H34 | 108.0° | 109.5° |
| C83 | C84 | H35 | 108.7° | 109.7° |
| C83 | C84 | H36 | 108.7° | 109.7° |
| C83 | N82 | C48 | 115.4° | 111.0° |
| N82 | C83 | H34 | 108.5° | 109.4° |
| C83 | N82 | H54 | 108.0° | 111.0° |
| N82 | C48 | C44 | 109.6° | 109.5° |
| N82 | C48 | H26 | 109.4° | 109.5° |
| N82 | C48 | H27 | 109.4° | 109.5° |
| C48 | N82 | H54 | 108.0° | 111.0° |
| C48 | C44 | O46 | 109.0° | 109.4° |
| C48 | C44 | C7 | 115.0° | 109.5° |
| C48 | C44 | H25 | 107.6° | 109.5° |
| C44 | C48 | H26 | 109.5° | 109.4° |
| C44 | C48 | H27 | 109.4° | 109.5° |
| O46 | C44 | C7 | 108.1° | 109.5° |
| O46 | C44 | H25 | 109.2° | 109.5° |
| C44 | O46 | H56 | 109.5° | 114.0° |
| O76 | C4 | N5 | 121.9° | 121.5° |
| O76 | C4 | C2 | 121.2° | 119.0° |
| C44 | C7 | C9 | 109.6° | 111.6° |
| C44 | C7 | N5 | 111.5° | 112.4° |
| C44 | C7 | H2 | 107.9° | 107.9° |
| C7 | C44 | H25 | 107.8° | 109.5° |
| C9 | C7 | N5 | 111.1° | 109.2° |
| C7 | C9 | C12 | 115.4° | 114.1° |
| C9 | C7 | H2 | 107.9° | 107.8° |
| C7 | C9 | H3 | 108.0° | 108.8° |
| C7 | C9 | H4 | 108.0° | 109.0° |
| C7 | N5 | C4 | 121.0° | 117.5° |
| N5 | C7 | H2 | 108.8° | 107.7° |
| C7 | N5 | H53 | 119.5° | 121.3° |
| C40 | C12 | C9 | 111.4° | 111.5° |
| C40 | C12 | C14 | 111.3° | 108.9° |
| C40 | C12 | H5 | 107.8° | 109.7° |
| C12 | C40 | H22 | 109.5° | 109.5° |
| C12 | C40 | H23 | 109.5° | 109.5° |
| C12 | C40 | H24 | 109.5° | 109.5° |
| N5 | C4 | C2 | 116.9° | 119.5° |
| C4 | N5 | H53 | 119.5° | 121.2° |
| C4 | C2 | C77 | 112.9° | 111.1° |
| C4 | C2 | N1 | 111.0° | 111.0° |
| C4 | C2 | H1 | 106.4° | 107.2° |
| C9 | C12 | C14 | 110.6° | 108.3° |
| C12 | C9 | H3 | 108.0° | 108.7° |
| C12 | C9 | H4 | 108.0° | 108.8° |
| C9 | C12 | H5 | 107.8° | 110.0° |
| C77 | C2 | N1 | 112.1° | 112.5° |
| C77 | C2 | H1 | 106.6° | 107.5° |
| C2 | C77 | H28 | 109.5° | 109.5° |
| C2 | C77 | H29 | 109.5° | 109.5° |
| C2 | C77 | H30 | 109.5° | 109.5° |
| C12 | C14 | C17 | 115.6° | 111.2° |
| C14 | C12 | H5 | 107.8° | 108.4° |
| C12 | C14 | H6 | 107.9° | 108.9° |
| C12 | C14 | H7 | 107.9° | 108.9° |
| C2 | N1 | C81 | 117.9° | 119.5° |
| C2 | N1 | C38 | 117.7° | 120.3° |
| N1 | C2 | H1 | 107.4° | 107.4° |
| C81 | N1 | C38 | 124.4° | 120.1° |
| N1 | C81 | H31 | 109.5° | 109.5° |
| N1 | C81 | H32 | 109.5° | 109.5° |
| N1 | C81 | H33 | 109.4° | 109.4° |
| C14 | C17 | C20 | 114.8° | 110.1° |
| C17 | C14 | H6 | 107.9° | 109.5° |
| C17 | C14 | H7 | 107.9° | 109.5° |
| C14 | C17 | H14 | 108.1° | 111.6° |
| C14 | C17 | H15 | 108.1° | 108.4° |
| N1 | C38 | O39 | 121.4° | 122.9° |
| N1 | C38 | C35 | 118.0° | 118.6° |
| C17 | C20 | C23 | 115.2° | 110.5° |
| C17 | C20 | H8 | 108.0° | 109.3° |
| C17 | C20 | H9 | 108.0° | 109.5° |
| C20 | C17 | H14 | 108.2° | 110.8° |
| C20 | C17 | H15 | 108.1° | 108.2° |
| O39 | C38 | C35 | 120.6° | 118.5° |
| C38 | C35 | C32 | 110.3° | 109.8° |
| C38 | C35 | H12 | 109.3° | 109.7° |
| C38 | C35 | H13 | 109.3° | 109.3° |
| C20 | C23 | C26 | 112.7° | 109.6° |
| C23 | C20 | H8 | 108.0° | 109.3° |
| C23 | C20 | H9 | 108.0° | 109.5° |
| C20 | C23 | H16 | 108.7° | 110.1° |
| C20 | C23 | H17 | 108.7° | 109.2° |
| C35 | C32 | C29 | 115.4° | 109.7° |
| C35 | C32 | H10 | 108.0° | 110.1° |
| C35 | C32 | H11 | 108.0° | 109.1° |
| C32 | C35 | H12 | 109.3° | 109.3° |
| C32 | C35 | H13 | 109.3° | 108.9° |
| C23 | C26 | C29 | 113.8° | 109.9° |
| C26 | C23 | H16 | 108.7° | 109.9° |
| C26 | C23 | H17 | 108.7° | 109.1° |
| C23 | C26 | H18 | 108.3° | 109.3° |
| C23 | C26 | H19 | 108.4° | 109.5° |
| C32 | C29 | C26 | 113.2° | 109.5° |
| C29 | C32 | H10 | 108.0° | 109.8° |
| C29 | C32 | H11 | 108.0° | 109.1° |
| C32 | C29 | H20 | 108.5° | 109.2° |
| C32 | C29 | H21 | 108.6° | 109.6° |
| C29 | C26 | H18 | 108.4° | 109.4° |
| C29 | C26 | H19 | 108.4° | 109.5° |
| C26 | C29 | H20 | 108.5° | 109.3° |
| C26 | C29 | H21 | 108.5° | 109.9° |
| H3 | C9 | H4 | 109.5° | 107.2° |
| H6 | C14 | H7 | 109.5° | 108.8° |
| H8 | C20 | H9 | 109.5° | 108.8° |
| H10 | C32 | H11 | 109.4° | 109.1° |
| H12 | C35 | H13 | 109.4° | 109.8° |
| H14 | C17 | H15 | 109.4° | 107.7° |
| H16 | C23 | H17 | 109.5° | 109.0° |
| H18 | C26 | H19 | 109.5° | 109.3° |
| H20 | C29 | H21 | 109.5° | 109.3° |
| H22 | C40 | H23 | 109.5° | 109.4° |
| H22 | C40 | H24 | 109.5° | 109.4° |
| H23 | C40 | H24 | 109.5° | 109.5° |
| H26 | C48 | H27 | 109.4° | 109.5° |
| H28 | C77 | H29 | 109.5° | 109.5° |
| H28 | C77 | H30 | 109.5° | 109.5° |
| H29 | C77 | H30 | 109.5° | 109.4° |
| H31 | C81 | H32 | 109.5° | 109.5° |
| H31 | C81 | H33 | 109.5° | 109.4° |
| H32 | C81 | H33 | 109.5° | 109.5° |
| H35 | C84 | H36 | 109.4° | 109.8° |
| H37 | C86 | H38 | 109.5° | 109.5° |
| H37 | C86 | H39 | 109.5° | 109.5° |
| H38 | C86 | H39 | 109.5° | 109.5° |
| H40 | C87 | H41 | 109.5° | 109.4° |
| H40 | C87 | H42 | 109.5° | 109.4° |
| H41 | C87 | H42 | 109.4° | 109.4° |
| H47 | C96 | H48 | 109.5° | 109.4° |
| H47 | C96 | H49 | 109.5° | 109.5° |
| H48 | C96 | H49 | 109.4° | 109.5° |
| H50 | C97 | H51 | 109.4° | 109.5° |
| H50 | C97 | H52 | 109.5° | 109.5° |
| H51 | C97 | H52 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C97 | C95 | C93 | C90 | 1.1° | 64.7° |
| C97 | C95 | C96 | C93 | 121.9° | 120.0° |
| C97 | C95 | C96 | H46 | 118.7° | 120.0° |
| C97 | C95 | C93 | H46 | 119.2° | 120.0° |
| C97 | C95 | C93 | C92 | 179.3° | 115.4° |
| C97 | C95 | C96 | H47 | 180.0° | 54.9° |
| C97 | C95 | C96 | H48 | 60.0° | 65.1° |
| C97 | C95 | C96 | H49 | 60.0° | 174.9° |
| C95 | C97 | H50 | H51 | 120.0° | 120.0° |
| C95 | C97 | H50 | H52 | 120.0° | 120.0° |
| C95 | C97 | H51 | H52 | 120.0° | 120.0° |
| C91 | C90 | C93 | H43 | 180.0° | 180.0° |
| C91 | C90 | C93 | C95 | 180.0° | 179.9° |
| C90 | C91 | C89 | H44 | 180.0° | 179.9° |
| C91 | C90 | C93 | C92 | 0.4° | 0.1° |
| C90 | C91 | C89 | O88 | 178.9° | 179.8° |
| C90 | C91 | C89 | C94 | 1.2° | 0.1° |
| C90 | C93 | C95 | C96 | 120.5° | 55.4° |
| C90 | C93 | C95 | C92 | 179.6° | 180.0° |
| C93 | C90 | C91 | C89 | 0.7° | 0.1° |
| C90 | C93 | C92 | C94 | 0.6° | 0.0° |
| C93 | C90 | C91 | H44 | 179.4° | 180.0° |
| C90 | C93 | C92 | H45 | 179.4° | 180.0° |
| C90 | C93 | C95 | H46 | 120.3° | 175.4° |
| C96 | C95 | C93 | H46 | 119.1° | 120.0° |
| C96 | C95 | C93 | C92 | 59.0° | 124.6° |
| C95 | C96 | H47 | H48 | 120.0° | 120.0° |
| C95 | C96 | H47 | H49 | 120.0° | 120.0° |
| C95 | C96 | H48 | H49 | 120.0° | 120.0° |
| C96 | C95 | C97 | H50 | 180.0° | 55.2° |
| C96 | C95 | C97 | H51 | 60.0° | 64.8° |
| C96 | C95 | C97 | H52 | 60.0° | 175.2° |
| C95 | C93 | C92 | C94 | 179.8° | 180.0° |
| C95 | C93 | C90 | H43 | 0.0° | 0.1° |
| C95 | C93 | C92 | H45 | 0.2° | 0.0° |
| C93 | C95 | C96 | H47 | 58.1° | 65.2° |
| C93 | C95 | C96 | H48 | 62.0° | 174.9° |
| C93 | C95 | C96 | H49 | 178.1° | 54.8° |
| C93 | C95 | C97 | H50 | 58.2° | 175.2° |
| C93 | C95 | C97 | H51 | 178.2° | 55.2° |
| C93 | C95 | C97 | H52 | 61.8° | 64.8° |
| C91 | C89 | O88 | C94 | 179.9° | 180.0° |
| C91 | C89 | O88 | C85 | 157.3° | 162.9° |
| C91 | C89 | C94 | C92 | 1.4° | 0.3° |
| C91 | C89 | C94 | C83 | 179.7° | 179.5° |
| C89 | C91 | C90 | H43 | 179.3° | 180.0° |
| C93 | C92 | C94 | C89 | 1.1° | 0.2° |
| C93 | C92 | C94 | H45 | 180.0° | 180.0° |
| C93 | C92 | C94 | C83 | 179.4° | 179.6° |
| C92 | C93 | C90 | H43 | 179.6° | 179.9° |
| C92 | C93 | C95 | H46 | 60.1° | 4.6° |
| O88 | C89 | C94 | C92 | 178.7° | 179.7° |
| C89 | O88 | C85 | C87 | 70.2° | 70.7° |
| O88 | C89 | C94 | C83 | 0.4° | 0.5° |
| C89 | O88 | C85 | C86 | 171.9° | 168.9° |
| C89 | O88 | C85 | C84 | 51.5° | 49.2° |
| O88 | C89 | C91 | H44 | 1.1° | 0.2° |
| C94 | C89 | O88 | C85 | 22.8° | 17.2° |
| C89 | C94 | C92 | C83 | 178.3° | 179.8° |
| C89 | C94 | C83 | C84 | 10.4° | 17.9° |
| C89 | C94 | C83 | N82 | 135.0° | 138.0° |
| C89 | C94 | C83 | H34 | 107.4° | 102.2° |
| C94 | C89 | C91 | H44 | 178.9° | 179.8° |
| C89 | C94 | C92 | H45 | 178.9° | 179.8° |
| O88 | C85 | C87 | C86 | 115.0° | 120.5° |
| O88 | C85 | C87 | C84 | 117.9° | 119.0° |
| O88 | C85 | C86 | C84 | 117.0° | 118.9° |
| O88 | C85 | C84 | C83 | 61.2° | 64.8° |
| O88 | C85 | C84 | H35 | 59.3° | 175.6° |
| O88 | C85 | C84 | H36 | 178.3° | 55.0° |
| O88 | C85 | C86 | H37 | 180.0° | 58.9° |
| O88 | C85 | C86 | H38 | 60.0° | 61.1° |
| O88 | C85 | C86 | H39 | 60.0° | 178.9° |
| O88 | C85 | C87 | H40 | 180.0° | 60.5° |
| O88 | C85 | C87 | H41 | 60.0° | 59.5° |
| O88 | C85 | C87 | H42 | 60.0° | 179.5° |
| C92 | C94 | C83 | C84 | 171.4° | 162.3° |
| C92 | C94 | C83 | N82 | 46.8° | 42.3° |
| C92 | C94 | C83 | H34 | 70.8° | 77.6° |
| C87 | C85 | C86 | C84 | 127.5° | 120.5° |
| C87 | C85 | C84 | C83 | 56.5° | 55.1° |
| C87 | C85 | C84 | H35 | 177.0° | 64.6° |
| C87 | C85 | C84 | H36 | 64.0° | 174.8° |
| C87 | C85 | C86 | H37 | 64.5° | 179.5° |
| C87 | C85 | C86 | H38 | 175.5° | 59.5° |
| C87 | C85 | C86 | H39 | 55.5° | 60.5° |
| C85 | C87 | H40 | H41 | 120.0° | 120.0° |
| C85 | C87 | H40 | H42 | 120.0° | 120.0° |
| C85 | C87 | H41 | H42 | 120.0° | 120.0° |
| C94 | C83 | C84 | C85 | 40.6° | 48.3° |
| C94 | C83 | C84 | N82 | 121.9° | 120.0° |
| C94 | C83 | C84 | H34 | 117.8° | 120.1° |
| C94 | C83 | N82 | H34 | 117.4° | 119.9° |
| C94 | C83 | N82 | C48 | 61.3° | 91.8° |
| C94 | C83 | C84 | H35 | 79.9° | 167.9° |
| C94 | C83 | C84 | H36 | 161.1° | 71.5° |
| C83 | C94 | C92 | H45 | 0.6° | 0.4° |
| C94 | C83 | N82 | H54 | 177.8° | 32.2° |
| C86 | C85 | C84 | C83 | 177.5° | 175.5° |
| C86 | C85 | C84 | H35 | 57.0° | 55.9° |
| C86 | C85 | C84 | H36 | 62.0° | 64.7° |
| C85 | C86 | H37 | H38 | 120.0° | 120.0° |
| C85 | C86 | H37 | H39 | 120.0° | 120.0° |
| C85 | C86 | H38 | H39 | 120.0° | 120.0° |
| C86 | C85 | C87 | H40 | 65.0° | 60.0° |
| C86 | C85 | C87 | H41 | 55.0° | 180.0° |
| C86 | C85 | C87 | H42 | 174.9° | 60.0° |
| C85 | C84 | C83 | H35 | 120.5° | 119.6° |
| C85 | C84 | C83 | H36 | 120.5° | 119.7° |
| C85 | C84 | C83 | N82 | 162.4° | 168.3° |
| C85 | C84 | C83 | H34 | 77.3° | 71.8° |
| C85 | C84 | H35 | H36 | 118.5° | 120.6° |
| C84 | C85 | C86 | H37 | 63.0° | 60.0° |
| C84 | C85 | C86 | H38 | 57.0° | 180.0° |
| C84 | C85 | C86 | H39 | 177.0° | 60.0° |
| C84 | C85 | C87 | H40 | 62.1° | 179.5° |
| C84 | C85 | C87 | H41 | 177.9° | 59.5° |
| C84 | C85 | C87 | H42 | 58.0° | 60.5° |
| C84 | C83 | N82 | H34 | 120.1° | 119.9° |
| C84 | C83 | N82 | C48 | 61.2° | 148.0° |
| C83 | C84 | H35 | H36 | 118.5° | 120.6° |
| C84 | C83 | N82 | H54 | 59.7° | 88.0° |
| C83 | N82 | C48 | H54 | 120.9° | 124.0° |
| C83 | N82 | C48 | C44 | 166.9° | 88.8° |
| C83 | N82 | C48 | H26 | 46.9° | 151.2° |
| C83 | N82 | C48 | H27 | 73.0° | 31.2° |
| N82 | C83 | C84 | H35 | 41.9° | 72.0° |
| N82 | C83 | C84 | H36 | 77.1° | 48.6° |
| N82 | C48 | C44 | H26 | 120.0° | 120.0° |
| N82 | C48 | C44 | H27 | 120.0° | 120.0° |
| N82 | C48 | C44 | O46 | 50.0° | 66.5° |
| N82 | C48 | C44 | C7 | 171.6° | 173.5° |
| N82 | C48 | C44 | H25 | 68.2° | 53.5° |
| N82 | C48 | H26 | H27 | 119.9° | 120.0° |
| C48 | N82 | C83 | H34 | 178.7° | 28.1° |
| C48 | C44 | O46 | C7 | 125.6° | 120.0° |
| C48 | C44 | O46 | H25 | 117.3° | 120.0° |
| C48 | C44 | C7 | H25 | 120.0° | 120.0° |
| C48 | C44 | C7 | C9 | 166.1° | 61.6° |
| C48 | C44 | C7 | N5 | 70.5° | 175.3° |
| C48 | C44 | C7 | H2 | 48.9° | 56.7° |
| C44 | C48 | H26 | H27 | 119.9° | 120.0° |
| C44 | C48 | N82 | H54 | 72.2° | 147.2° |
| C48 | C44 | O46 | H56 | 180.0° | 31.5° |
| O46 | C44 | C7 | H25 | 117.9° | 120.0° |
| O46 | C44 | C7 | C9 | 44.1° | 58.4° |
| O46 | C44 | C7 | N5 | 167.5° | 64.7° |
| O46 | C44 | C7 | H2 | 73.2° | 176.7° |
| O46 | C44 | C48 | H26 | 70.0° | 173.5° |
| O46 | C44 | C48 | H27 | 170.1° | 53.6° |
| O76 | C4 | N5 | C7 | 0.1° | 8.9° |
| O76 | C4 | N5 | C2 | 179.8° | 178.5° |
| O76 | C4 | C2 | C77 | 3.2° | 112.8° |
| O76 | C4 | C2 | N1 | 123.6° | 121.3° |
| O76 | C4 | C2 | H1 | 119.9° | 4.4° |
| O76 | C4 | N5 | H53 | 179.9° | 168.4° |
| C44 | C7 | C9 | N5 | 123.7° | 124.9° |
| C44 | C7 | C9 | H2 | 117.3° | 118.4° |
| C44 | C7 | N5 | H2 | 118.9° | 118.7° |
| C44 | C7 | N5 | C4 | 97.2° | 56.6° |
| C44 | C7 | C9 | C12 | 165.1° | 44.3° |
| C44 | C7 | C9 | H3 | 44.2° | 77.3° |
| C44 | C7 | C9 | H4 | 74.0° | 166.1° |
| C7 | C44 | C48 | H26 | 51.6° | 53.5° |
| C7 | C44 | C48 | H27 | 68.4° | 66.5° |
| C44 | C7 | N5 | H53 | 82.7° | 126.1° |
| C7 | C44 | O46 | H56 | 54.4° | 88.5° |
| C9 | C7 | N5 | H2 | 118.5° | 116.8° |
| C7 | C9 | C12 | C40 | 68.5° | 48.2° |
| C9 | C7 | N5 | C4 | 140.2° | 178.9° |
| C7 | C9 | C12 | H3 | 120.9° | 121.7° |
| C7 | C9 | C12 | H4 | 120.9° | 121.9° |
| C7 | C9 | C12 | C14 | 167.1° | 168.1° |
| C7 | C9 | H3 | H4 | 117.3° | 117.7° |
| C7 | C9 | C12 | H5 | 49.6° | 73.7° |
| C9 | C7 | C44 | H25 | 73.9° | 178.4° |
| C9 | C7 | N5 | H53 | 39.9° | 1.6° |
| C7 | N5 | C4 | H53 | 180.0° | 177.3° |
| C7 | N5 | C4 | C2 | 179.8° | 172.6° |
| N5 | C7 | C9 | C12 | 41.5° | 80.6° |
| N5 | C7 | C9 | H3 | 79.4° | 157.8° |
| N5 | C7 | C9 | H4 | 162.3° | 41.2° |
| N5 | C7 | C44 | H25 | 49.5° | 55.3° |
| C40 | C12 | C9 | C14 | 124.3° | 119.9° |
| C40 | C12 | C9 | H5 | 118.1° | 121.9° |
| C40 | C12 | C14 | H5 | 118.1° | 119.2° |
| C40 | C12 | C14 | C17 | 57.6° | 49.2° |
| C40 | C12 | C9 | H3 | 170.6° | 169.9° |
| C40 | C12 | C9 | H4 | 52.3° | 73.7° |
| C40 | C12 | C14 | H6 | 178.5° | 169.9° |
| C40 | C12 | C14 | H7 | 63.3° | 71.6° |
| C12 | C40 | H22 | H23 | 120.0° | 120.0° |
| C12 | C40 | H22 | H24 | 120.0° | 120.0° |
| C12 | C40 | H23 | H24 | 120.0° | 120.1° |
| N5 | C4 | C2 | C77 | 176.5° | 65.8° |
| N5 | C4 | C2 | N1 | 56.6° | 60.1° |
| N5 | C4 | C2 | H1 | 59.9° | 177.1° |
| C4 | N5 | C7 | H2 | 21.6° | 62.1° |
| C4 | C2 | C77 | N1 | 126.2° | 125.0° |
| C4 | C2 | C77 | H1 | 116.5° | 116.9° |
| C4 | C2 | N1 | H1 | 116.0° | 116.8° |
| C4 | C2 | N1 | C81 | 44.5° | 98.7° |
| C4 | C2 | N1 | C38 | 135.6° | 81.1° |
| C4 | C2 | C77 | H28 | 180.0° | 65.1° |
| C4 | C2 | C77 | H29 | 60.0° | 55.0° |
| C4 | C2 | C77 | H30 | 60.0° | 175.0° |
| C2 | C4 | N5 | H53 | 0.1° | 10.1° |
| C9 | C12 | C14 | H5 | 117.6° | 119.3° |
| C9 | C12 | C14 | C17 | 178.1° | 170.6° |
| C12 | C9 | C7 | H2 | 77.6° | 162.7° |
| C12 | C9 | H3 | H4 | 117.3° | 117.4° |
| C9 | C12 | C14 | H6 | 57.2° | 68.6° |
| C9 | C12 | C14 | H7 | 61.1° | 49.9° |
| C9 | C12 | C40 | H22 | 180.0° | 37.2° |
| C9 | C12 | C40 | H23 | 60.0° | 157.1° |
| C9 | C12 | C40 | H24 | 60.0° | 82.8° |
| C77 | C2 | N1 | H1 | 116.8° | 118.1° |
| C77 | C2 | N1 | C81 | 82.8° | 136.2° |
| C77 | C2 | N1 | C38 | 97.1° | 44.0° |
| C2 | C77 | H28 | H29 | 120.0° | 120.0° |
| C2 | C77 | H28 | H30 | 120.0° | 120.0° |
| C2 | C77 | H29 | H30 | 120.0° | 120.0° |
| C12 | C14 | C17 | H6 | 120.9° | 120.4° |
| C12 | C14 | C17 | H7 | 120.9° | 120.4° |
| C12 | C14 | C17 | C20 | 64.8° | 107.3° |
| C14 | C12 | C9 | H3 | 46.2° | 70.3° |
| C14 | C12 | C9 | H4 | 72.0° | 46.1° |
| C12 | C14 | H6 | H7 | 117.2° | 118.5° |
| C12 | C14 | C17 | H14 | 174.4° | 16.1° |
| C12 | C14 | C17 | H15 | 55.9° | 134.6° |
| C14 | C12 | C40 | H22 | 56.1° | 156.7° |
| C14 | C12 | C40 | H23 | 63.9° | 83.4° |
| C14 | C12 | C40 | H24 | 176.1° | 36.7° |
| C2 | N1 | C81 | C38 | 179.9° | 179.8° |
| C2 | N1 | C38 | O39 | 0.6° | 9.4° |
| C2 | N1 | C38 | C35 | 177.6° | 170.2° |
| N1 | C2 | C77 | H28 | 53.8° | 60.0° |
| N1 | C2 | C77 | H29 | 66.3° | 180.0° |
| N1 | C2 | C77 | H30 | 173.8° | 60.0° |
| C2 | N1 | C81 | H31 | 180.0° | 95.2° |
| C2 | N1 | C81 | H32 | 60.0° | 144.8° |
| C2 | N1 | C81 | H33 | 60.0° | 24.8° |
| C81 | N1 | C38 | O39 | 179.5° | 170.4° |
| C81 | N1 | C38 | C35 | 2.5° | 10.0° |
| C81 | N1 | C2 | H1 | 160.4° | 18.1° |
| N1 | C81 | H31 | H32 | 120.0° | 120.0° |
| N1 | C81 | H31 | H33 | 120.0° | 119.9° |
| N1 | C81 | H32 | H33 | 120.0° | 120.0° |
| C14 | C17 | C20 | H14 | 120.8° | 123.9° |
| C14 | C17 | C20 | H15 | 120.8° | 118.2° |
| C14 | C17 | C20 | C23 | 62.0° | 122.3° |
| C17 | C14 | C12 | H5 | 60.5° | 70.1° |
| C17 | C14 | H6 | H7 | 117.2° | 119.7° |
| C14 | C17 | C20 | H8 | 177.2° | 117.4° |
| C14 | C17 | C20 | H9 | 58.8° | 1.7° |
| C14 | C17 | H14 | H15 | 117.6° | 118.8° |
| N1 | C38 | O39 | C35 | 177.0° | 179.6° |
| N1 | C38 | C35 | C32 | 93.6° | 177.2° |
| C38 | N1 | C2 | H1 | 19.7° | 162.1° |
| N1 | C38 | C35 | H12 | 26.5° | 62.7° |
| N1 | C38 | C35 | H13 | 146.3° | 57.8° |
| C38 | N1 | C81 | H31 | 0.1° | 84.7° |
| C38 | N1 | C81 | H32 | 120.1° | 35.4° |
| C38 | N1 | C81 | H33 | 119.9° | 155.4° |
| C17 | C20 | C23 | H8 | 120.8° | 120.2° |
| C17 | C20 | C23 | H9 | 120.8° | 120.6° |
| C17 | C20 | C23 | C26 | 163.0° | 132.9° |
| C20 | C17 | C14 | H6 | 56.0° | 132.3° |
| C20 | C17 | C14 | H7 | 174.3° | 13.1° |
| C17 | C20 | H8 | H9 | 117.4° | 119.5° |
| C20 | C17 | H14 | H15 | 117.6° | 118.1° |
| C17 | C20 | C23 | H16 | 76.5° | 11.9° |
| C17 | C20 | C23 | H17 | 42.5° | 107.7° |
| O39 | C38 | C35 | C32 | 83.5° | 2.4° |
| O39 | C38 | C35 | H12 | 156.4° | 117.7° |
| O39 | C38 | C35 | H13 | 36.7° | 121.8° |
| C38 | C35 | C32 | H12 | 120.1° | 120.4° |
| C38 | C35 | C32 | H13 | 120.1° | 119.7° |
| C38 | C35 | C32 | C29 | 166.0° | 105.1° |
| C38 | C35 | C32 | H10 | 73.1° | 15.8° |
| C38 | C35 | C32 | H11 | 45.1° | 135.5° |
| C38 | C35 | H12 | H13 | 119.6° | 120.1° |
| C20 | C23 | C26 | H16 | 120.5° | 121.1° |
| C20 | C23 | C26 | H17 | 120.5° | 119.5° |
| C20 | C23 | C26 | C29 | 51.6° | 141.9° |
| C23 | C20 | H8 | H9 | 117.4° | 119.5° |
| C23 | C20 | C17 | H14 | 58.8° | 1.5° |
| C23 | C20 | C17 | H15 | 177.2° | 119.4° |
| C20 | C23 | H16 | H17 | 118.6° | 119.7° |
| C20 | C23 | C26 | H18 | 172.2° | 98.1° |
| C20 | C23 | C26 | H19 | 69.0° | 21.6° |
| C35 | C32 | C29 | H10 | 120.9° | 121.1° |
| C35 | C32 | C29 | H11 | 120.9° | 119.5° |
| C35 | C32 | C29 | C26 | 168.1° | 138.0° |
| C35 | C32 | H10 | H11 | 117.3° | 119.7° |
| C32 | C35 | H12 | H13 | 119.6° | 119.4° |
| C35 | C32 | C29 | H20 | 47.5° | 102.3° |
| C35 | C32 | C29 | H21 | 71.4° | 17.3° |
| C23 | C26 | C29 | C32 | 51.7° | 155.4° |
| C23 | C26 | C29 | H18 | 120.6° | 120.0° |
| C23 | C26 | C29 | H19 | 120.6° | 120.4° |
| C26 | C23 | C20 | H8 | 42.2° | 106.9° |
| C26 | C23 | C20 | H9 | 76.2° | 12.2° |
| C26 | C23 | H16 | H17 | 118.5° | 119.5° |
| C23 | C26 | H18 | H19 | 118.0° | 119.9° |
| C23 | C26 | C29 | H20 | 68.8° | 85.0° |
| C23 | C26 | C29 | H21 | 172.3° | 35.0° |
| C32 | C29 | C26 | H20 | 120.6° | 119.6° |
| C32 | C29 | C26 | H21 | 120.6° | 120.5° |
| C29 | C32 | H10 | H11 | 117.3° | 119.4° |
| C29 | C32 | C35 | H12 | 45.9° | 15.3° |
| C29 | C32 | C35 | H13 | 73.9° | 135.2° |
| C32 | C29 | C26 | H18 | 68.9° | 84.6° |
| C32 | C29 | C26 | H19 | 172.3° | 35.1° |
| C32 | C29 | H20 | H21 | 118.3° | 119.9° |
| C26 | C29 | C32 | H10 | 71.1° | 16.9° |
| C26 | C29 | C32 | H11 | 47.2° | 102.5° |
| C29 | C26 | C23 | H16 | 68.9° | 20.8° |
| C29 | C26 | C23 | H17 | 172.1° | 98.6° |
| C29 | C26 | H18 | H19 | 118.0° | 119.8° |
| C26 | C29 | H20 | H21 | 118.3° | 120.3° |
| H1 | C2 | C77 | H28 | 63.5° | 178.0° |
| H1 | C2 | C77 | H29 | 176.5° | 61.9° |
| H1 | C2 | C77 | H30 | 56.5° | 58.0° |
| H2 | C7 | C9 | H3 | 161.5° | 41.1° |
| H2 | C7 | C9 | H4 | 43.2° | 75.5° |
| H2 | C7 | C44 | H25 | 168.9° | 63.3° |
| H2 | C7 | N5 | H53 | 158.4° | 115.2° |
| H3 | C9 | C12 | H5 | 71.3° | 48.0° |
| H4 | C9 | C12 | H5 | 170.4° | 164.4° |
| H5 | C12 | C14 | H6 | 60.4° | 50.7° |
| H5 | C12 | C14 | H7 | 178.6° | 169.2° |
| H5 | C12 | C40 | H22 | 61.9° | 84.9° |
| H5 | C12 | C40 | H23 | 178.1° | 35.1° |
| H5 | C12 | C40 | H24 | 58.1° | 155.1° |
| H6 | C14 | C17 | H14 | 64.8° | 104.3° |
| H6 | C14 | C17 | H15 | 176.8° | 14.2° |
| H7 | C14 | C17 | H14 | 53.5° | 136.5° |
| H7 | C14 | C17 | H15 | 65.0° | 105.1° |
| H8 | C20 | C17 | H14 | 62.0° | 118.7° |
| H8 | C20 | C17 | H15 | 56.4° | 0.9° |
| H8 | C20 | C23 | H16 | 162.7° | 132.2° |
| H8 | C20 | C23 | H17 | 78.3° | 12.6° |
| H9 | C20 | C17 | H14 | 179.6° | 122.2° |
| H9 | C20 | C17 | H15 | 61.9° | 119.9° |
| H9 | C20 | C23 | H16 | 44.3° | 108.7° |
| H9 | C20 | C23 | H17 | 163.4° | 131.7° |
| H10 | C32 | C35 | H12 | 166.7° | 136.2° |
| H10 | C32 | C35 | H13 | 47.0° | 103.9° |
| H10 | C32 | C29 | H20 | 168.4° | 136.6° |
| H10 | C32 | C29 | H21 | 49.5° | 103.7° |
| H11 | C32 | C35 | H12 | 75.0° | 104.2° |
| H11 | C32 | C35 | H13 | 165.3° | 15.8° |
| H11 | C32 | C29 | H20 | 73.4° | 17.2° |
| H11 | C32 | C29 | H21 | 167.7° | 136.8° |
| H16 | C23 | C26 | H18 | 51.8° | 140.8° |
| H16 | C23 | C26 | H19 | 170.5° | 99.5° |
| H17 | C23 | C26 | H18 | 67.3° | 21.4° |
| H17 | C23 | C26 | H19 | 51.5° | 141.1° |
| H18 | C26 | C29 | H20 | 170.6° | 35.0° |
| H18 | C26 | C29 | H21 | 51.7° | 154.9° |
| H19 | C26 | C29 | H20 | 51.8° | 154.7° |
| H19 | C26 | C29 | H21 | 67.1° | 85.4° |
| H22 | C40 | H23 | H24 | 120.0° | 120.0° |
| H25 | C44 | C48 | H26 | 171.7° | 66.5° |
| H25 | C44 | C48 | H27 | 51.8° | 173.5° |
| H25 | C44 | O46 | H56 | 62.7° | 151.5° |
| H26 | C48 | N82 | H54 | 167.7° | 27.2° |
| H27 | C48 | N82 | H54 | 47.8° | 92.8° |
| H28 | C77 | H29 | H30 | 120.0° | 120.0° |
| H31 | C81 | H32 | H33 | 120.0° | 120.0° |
| H34 | C83 | C84 | H35 | 162.2° | 47.9° |
| H34 | C83 | C84 | H36 | 43.2° | 168.5° |
| H34 | C83 | N82 | H54 | 60.4° | 152.0° |
| H37 | C86 | H38 | H39 | 120.0° | 120.0° |
| H40 | C87 | H41 | H42 | 120.0° | 119.9° |
| H43 | C90 | C91 | H44 | 0.6° | 0.1° |
| H46 | C95 | C96 | H47 | 61.3° | 174.9° |
| H46 | C95 | C96 | H48 | 178.7° | 55.0° |
| H46 | C95 | C96 | H49 | 58.7° | 65.1° |
| H46 | C95 | C97 | H50 | 61.3° | 64.8° |
| H46 | C95 | C97 | H51 | 58.7° | 175.2° |
| H46 | C95 | C97 | H52 | 178.7° | 55.2° |
| H47 | C96 | H48 | H49 | 120.0° | 120.0° |
| H50 | C97 | H51 | H52 | 120.0° | 119.9° |
