A1CDL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C91 | C90 | sing | 1.53Å | 1.55Å | |
| C91 | C92 | sing | 1.53Å | 1.55Å | |
| C90 | C89 | sing | 1.53Å | 1.55Å | |
| C93 | C92 | sing | 1.53Å | 1.54Å | |
| C93 | C94 | sing | 1.53Å | 1.55Å | |
| CA1 | CA0 | sing | 1.53Å | 1.54Å | |
| C89 | C88 | sing | 1.51Å | 1.54Å | |
| C94 | C95 | sing | 1.53Å | 1.55Å | |
| CA0 | C99 | sing | 1.53Å | 1.54Å | |
| C88 | C87 | doub | 1.31Å | 1.33Å | |
| C98 | C97 | sing | 1.53Å | 1.54Å | |
| C98 | C99 | sing | 1.53Å | 1.54Å | |
| C95 | C96 | sing | 1.53Å | 1.54Å | |
| C97 | C96 | sing | 1.53Å | 1.54Å | |
| C87 | C86 | sing | 1.51Å | 1.54Å | |
| OA2 | C86 | sing | 1.43Å | 1.41Å | |
| C86 | C21 | sing | 1.53Å | 1.57Å | |
| O23 | C24 | sing | 1.43Å | 1.44Å | |
| O23 | C22 | sing | 1.43Å | 1.44Å | |
| C21 | N20 | sing | 1.46Å | 1.50Å | |
| C21 | C22 | sing | 1.53Å | 1.57Å | |
| C24 | O29 | sing | 1.43Å | 1.52Å | |
| C24 | C25 | sing | 1.53Å | 1.56Å | |
| N20 | C18 | sing | 1.35Å | 1.49Å | |
| O85 | C25 | sing | 1.43Å | 1.41Å | |
| O29 | C28 | sing | 1.43Å | 1.47Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| C16 | C15 | sing | 1.53Å | 1.55Å | |
| C18 | C17 | sing | 1.51Å | 1.55Å | |
| C18 | O19 | doub | 1.21Å | 1.19Å | |
| C25 | C26 | sing | 1.53Å | 1.46Å | |
| C13 | C14 | sing | 1.53Å | 1.55Å | |
| C13 | C12 | sing | 1.53Å | 1.55Å | |
| C28 | C30 | sing | 1.53Å | 1.53Å | |
| C28 | C27 | sing | 1.53Å | 1.48Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C26 | C27 | sing | 1.53Å | 1.48Å | |
| C26 | O84 | sing | 1.43Å | 1.41Å | |
| C30 | O31 | sing | 1.43Å | 1.41Å | |
| C12 | C11 | sing | 1.53Å | 1.56Å | |
| C27 | O32 | sing | 1.43Å | 1.49Å | |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| O32 | C33 | sing | 1.43Å | 1.45Å | |
| C10 | C09 | sing | 1.53Å | 1.55Å | |
| C33 | O38 | sing | 1.43Å | 1.46Å | |
| C33 | C34 | sing | 1.53Å | 1.54Å | |
| O38 | C37 | sing | 1.43Å | 1.48Å | |
| C09 | C08 | sing | 1.53Å | 1.55Å | |
| O83 | C34 | sing | 1.43Å | 1.41Å | |
| C34 | C35 | sing | 1.53Å | 1.48Å | |
| O40 | C39 | sing | 1.43Å | 1.41Å | |
| C37 | C39 | sing | 1.53Å | 1.55Å | |
| C37 | C36 | sing | 1.53Å | 1.55Å | |
| C08 | C07 | sing | 1.53Å | 1.55Å | |
| C35 | C36 | sing | 1.53Å | 1.48Å | |
| C35 | O42 | sing | 1.43Å | 1.47Å | |
| C36 | O41 | sing | 1.43Å | 1.41Å | |
| C07 | C06 | sing | 1.53Å | 1.54Å | |
| C06 | C05 | sing | 1.53Å | 1.54Å | |
| C05 | C04 | sing | 1.53Å | 1.54Å | |
| C04 | C03 | sing | 1.53Å | 1.54Å | |
| C02 | C03 | sing | 1.53Å | 1.54Å | |
| C02 | C01 | sing | 1.53Å | 1.54Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C02 | H5 | sing | 1.09Å | 1.10Å | |
| C03 | H6 | sing | 1.09Å | 1.10Å | |
| C03 | H7 | sing | 1.09Å | 1.10Å | |
| C04 | H8 | sing | 1.09Å | 1.10Å | |
| C04 | H9 | sing | 1.09Å | 1.10Å | |
| C05 | H10 | sing | 1.09Å | 1.10Å | |
| C05 | H11 | sing | 1.09Å | 1.10Å | |
| C06 | H12 | sing | 1.09Å | 1.10Å | |
| C06 | H13 | sing | 1.09Å | 1.10Å | |
| C07 | H14 | sing | 1.09Å | 1.10Å | |
| C07 | H15 | sing | 1.09Å | 1.10Å | |
| C08 | H16 | sing | 1.09Å | 1.10Å | |
| C08 | H17 | sing | 1.09Å | 1.10Å | |
| C09 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C10 | H20 | sing | 1.09Å | 1.10Å | |
| C10 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C12 | H24 | sing | 1.09Å | 1.10Å | |
| C12 | H25 | sing | 1.09Å | 1.10Å | |
| C13 | H26 | sing | 1.09Å | 1.10Å | |
| C13 | H27 | sing | 1.09Å | 1.10Å | |
| C14 | H28 | sing | 1.09Å | 1.10Å | |
| C14 | H29 | sing | 1.09Å | 1.10Å | |
| C15 | H30 | sing | 1.09Å | 1.10Å | |
| C15 | H31 | sing | 1.09Å | 1.10Å | |
| C16 | H32 | sing | 1.09Å | 1.10Å | |
| C16 | H33 | sing | 1.09Å | 1.10Å | |
| C17 | H34 | sing | 1.09Å | 1.10Å | |
| C17 | H35 | sing | 1.09Å | 1.10Å | |
| C21 | H36 | sing | 1.09Å | 1.10Å | |
| C22 | H37 | sing | 1.09Å | 1.10Å | |
| C22 | H38 | sing | 1.09Å | 1.10Å | |
| C24 | H39 | sing | 1.09Å | 1.10Å | |
| C25 | H40 | sing | 1.09Å | 1.10Å | |
| C26 | H41 | sing | 1.09Å | 1.10Å | |
| C27 | H42 | sing | 1.09Å | 1.10Å | |
| C28 | H43 | sing | 1.09Å | 1.10Å | |
| C30 | H44 | sing | 1.09Å | 1.10Å | |
| C30 | H45 | sing | 1.09Å | 1.10Å | |
| C33 | H46 | sing | 1.09Å | 1.10Å | |
| C34 | H47 | sing | 1.09Å | 1.10Å | |
| C35 | H48 | sing | 1.09Å | 1.10Å | |
| C36 | H49 | sing | 1.09Å | 1.10Å | |
| C37 | H50 | sing | 1.09Å | 1.10Å | |
| C39 | H51 | sing | 1.09Å | 1.10Å | |
| C39 | H52 | sing | 1.09Å | 1.10Å | |
| C86 | H53 | sing | 1.09Å | 1.10Å | |
| C87 | H54 | sing | 1.08Å | 1.08Å | |
| C88 | H55 | sing | 1.08Å | 1.08Å | |
| C89 | H56 | sing | 1.09Å | 1.10Å | |
| C89 | H57 | sing | 1.09Å | 1.10Å | |
| C90 | H58 | sing | 1.09Å | 1.10Å | |
| C90 | H59 | sing | 1.09Å | 1.10Å | |
| C91 | H60 | sing | 1.09Å | 1.10Å | |
| C91 | H61 | sing | 1.09Å | 1.10Å | |
| C92 | H62 | sing | 1.09Å | 1.10Å | |
| C92 | H63 | sing | 1.09Å | 1.10Å | |
| C93 | H64 | sing | 1.09Å | 1.10Å | |
| C93 | H65 | sing | 1.09Å | 1.10Å | |
| C94 | H66 | sing | 1.09Å | 1.10Å | |
| C94 | H67 | sing | 1.09Å | 1.10Å | |
| C95 | H68 | sing | 1.09Å | 1.10Å | |
| C95 | H69 | sing | 1.09Å | 1.10Å | |
| C96 | H70 | sing | 1.09Å | 1.10Å | |
| C96 | H71 | sing | 1.09Å | 1.10Å | |
| C97 | H72 | sing | 1.09Å | 1.10Å | |
| C97 | H73 | sing | 1.09Å | 1.10Å | |
| C98 | H74 | sing | 1.09Å | 1.10Å | |
| C98 | H75 | sing | 1.09Å | 1.10Å | |
| C99 | H76 | sing | 1.09Å | 1.10Å | |
| C99 | H77 | sing | 1.09Å | 1.10Å | |
| CA0 | H78 | sing | 1.09Å | 1.10Å | |
| CA0 | H79 | sing | 1.09Å | 1.10Å | |
| CA1 | H80 | sing | 1.09Å | 1.10Å | |
| CA1 | H81 | sing | 1.09Å | 1.10Å | |
| CA1 | H82 | sing | 1.09Å | 1.10Å | |
| N20 | H83 | sing | 0.97Å | 1.00Å | |
| O31 | H84 | sing | 0.97Å | 0.95Å | |
| O40 | H85 | sing | 0.97Å | 0.95Å | |
| O41 | H86 | sing | 0.97Å | 0.95Å | |
| O42 | H87 | sing | 0.97Å | 0.95Å | |
| O83 | H88 | sing | 0.97Å | 0.95Å | |
| O84 | H89 | sing | 0.97Å | 0.95Å | |
| O85 | H90 | sing | 0.97Å | 0.95Å | |
| OA2 | H91 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C90 | C91 | C92 | 107.7° | 109.5° |
| C91 | C90 | C89 | 108.2° | 109.5° |
| C91 | C90 | H58 | 109.8° | 109.5° |
| C91 | C90 | H59 | 109.8° | 109.5° |
| C90 | C91 | H60 | 109.9° | 109.5° |
| C90 | C91 | H61 | 109.9° | 109.5° |
| C91 | C92 | C93 | 112.4° | 109.5° |
| C92 | C91 | H60 | 109.9° | 109.5° |
| C92 | C91 | H61 | 109.9° | 109.4° |
| C91 | C92 | H62 | 108.7° | 109.5° |
| C91 | C92 | H63 | 108.8° | 109.4° |
| C90 | C89 | C88 | 111.6° | 109.5° |
| C90 | C89 | H56 | 108.9° | 109.5° |
| C90 | C89 | H57 | 108.9° | 109.4° |
| C89 | C90 | H58 | 109.8° | 109.5° |
| C89 | C90 | H59 | 109.8° | 109.5° |
| C92 | C93 | C94 | 111.0° | 109.5° |
| C93 | C92 | H62 | 108.7° | 109.5° |
| C93 | C92 | H63 | 108.7° | 109.5° |
| C92 | C93 | H64 | 109.1° | 109.5° |
| C92 | C93 | H65 | 109.1° | 109.5° |
| C93 | C94 | C95 | 110.8° | 109.5° |
| C94 | C93 | H64 | 109.1° | 109.5° |
| C94 | C93 | H65 | 109.1° | 109.5° |
| C93 | C94 | H66 | 109.1° | 109.5° |
| C93 | C94 | H67 | 109.1° | 109.4° |
| CA1 | CA0 | C99 | 109.7° | 109.4° |
| CA1 | CA0 | H78 | 109.4° | 109.5° |
| CA1 | CA0 | H79 | 109.4° | 109.5° |
| CA0 | CA1 | H80 | 109.5° | 109.5° |
| CA0 | CA1 | H81 | 109.5° | 109.5° |
| CA0 | CA1 | H82 | 109.5° | 109.5° |
| C89 | C88 | C87 | 117.8° | 120.0° |
| C89 | C88 | H55 | 121.1° | 120.0° |
| C88 | C89 | H56 | 108.9° | 109.5° |
| C88 | C89 | H57 | 108.9° | 109.5° |
| C94 | C95 | C96 | 110.9° | 109.5° |
| C95 | C94 | H66 | 109.1° | 109.5° |
| C95 | C94 | H67 | 109.1° | 109.5° |
| C94 | C95 | H68 | 109.1° | 109.5° |
| C94 | C95 | H69 | 109.1° | 109.4° |
| CA0 | C99 | C98 | 109.3° | 109.5° |
| CA0 | C99 | H76 | 109.5° | 109.4° |
| CA0 | C99 | H77 | 109.5° | 109.5° |
| C99 | CA0 | H78 | 109.4° | 109.4° |
| C99 | CA0 | H79 | 109.4° | 109.5° |
| C88 | C87 | C86 | 116.6° | 120.0° |
| C88 | C87 | H54 | 121.7° | 120.0° |
| C87 | C88 | H55 | 121.1° | 119.9° |
| C97 | C98 | C99 | 111.0° | 109.5° |
| C98 | C97 | C96 | 112.3° | 109.5° |
| C98 | C97 | H72 | 108.8° | 109.4° |
| C98 | C97 | H73 | 108.7° | 109.5° |
| C97 | C98 | H74 | 109.1° | 109.5° |
| C97 | C98 | H75 | 109.1° | 109.5° |
| C99 | C98 | H74 | 109.1° | 109.4° |
| C99 | C98 | H75 | 109.1° | 109.5° |
| C98 | C99 | H76 | 109.5° | 109.4° |
| C98 | C99 | H77 | 109.5° | 109.5° |
| C95 | C96 | C97 | 109.2° | 109.5° |
| C96 | C95 | H68 | 109.1° | 109.5° |
| C96 | C95 | H69 | 109.1° | 109.5° |
| C95 | C96 | H70 | 109.5° | 109.5° |
| C95 | C96 | H71 | 109.5° | 109.5° |
| C97 | C96 | H70 | 109.5° | 109.4° |
| C97 | C96 | H71 | 109.6° | 109.5° |
| C96 | C97 | H72 | 108.8° | 109.4° |
| C96 | C97 | H73 | 108.8° | 109.5° |
| C87 | C86 | OA2 | 108.0° | 109.5° |
| C87 | C86 | C21 | 115.6° | 109.4° |
| C87 | C86 | H53 | 107.2° | 109.5° |
| C86 | C87 | H54 | 121.7° | 120.0° |
| OA2 | C86 | C21 | 110.1° | 109.5° |
| OA2 | C86 | H53 | 108.9° | 109.5° |
| C86 | OA2 | H91 | 109.5° | 114.0° |
| C86 | C21 | N20 | 112.2° | 109.5° |
| C86 | C21 | C22 | 106.4° | 109.5° |
| C86 | C21 | H36 | 106.6° | 109.5° |
| C21 | C86 | H53 | 106.9° | 109.5° |
| C24 | O23 | C22 | 112.0° | 114.0° |
| O23 | C24 | O29 | 106.0° | 109.5° |
| O23 | C24 | C25 | 104.1° | 109.5° |
| O23 | C24 | H39 | 111.9° | 109.5° |
| O23 | C22 | C21 | 108.9° | 109.5° |
| O23 | C22 | H37 | 109.6° | 109.5° |
| O23 | C22 | H38 | 109.6° | 109.5° |
| N20 | C21 | C22 | 116.9° | 109.4° |
| C21 | N20 | C18 | 130.3° | 120.0° |
| N20 | C21 | H36 | 107.4° | 109.5° |
| C21 | N20 | H83 | 114.8° | 120.0° |
| C22 | C21 | H36 | 106.7° | 109.5° |
| C21 | C22 | H37 | 109.6° | 109.5° |
| C21 | C22 | H38 | 109.6° | 109.5° |
| O29 | C24 | C25 | 113.9° | 109.4° |
| C24 | O29 | C28 | 114.1° | 114.1° |
| O29 | C24 | H39 | 110.6° | 109.5° |
| C24 | C25 | O85 | 109.8° | 109.5° |
| C24 | C25 | C26 | 114.8° | 109.2° |
| C25 | C24 | H39 | 110.1° | 109.5° |
| C24 | C25 | H40 | 106.7° | 109.5° |
| N20 | C18 | C17 | 119.6° | 120.0° |
| N20 | C18 | O19 | 124.3° | 120.0° |
| C18 | N20 | H83 | 114.9° | 120.0° |
| O85 | C25 | C26 | 108.8° | 109.5° |
| O85 | C25 | H40 | 108.6° | 109.6° |
| C25 | O85 | H90 | 109.5° | 114.0° |
| O29 | C28 | C30 | 108.4° | 109.5° |
| O29 | C28 | C27 | 116.2° | 109.4° |
| O29 | C28 | H43 | 107.9° | 109.5° |
| C17 | C16 | C15 | 111.8° | 109.5° |
| C16 | C17 | C18 | 114.6° | 109.5° |
| C17 | C16 | H32 | 108.9° | 109.5° |
| C17 | C16 | H33 | 108.9° | 109.5° |
| C16 | C17 | H34 | 108.2° | 109.5° |
| C16 | C17 | H35 | 108.2° | 109.5° |
| C16 | C15 | C14 | 113.4° | 109.5° |
| C16 | C15 | H30 | 108.5° | 109.5° |
| C16 | C15 | H31 | 108.5° | 109.5° |
| C15 | C16 | H32 | 108.9° | 109.4° |
| C15 | C16 | H33 | 108.9° | 109.4° |
| C17 | C18 | O19 | 116.1° | 120.0° |
| C18 | C17 | H34 | 108.2° | 109.5° |
| C18 | C17 | H35 | 108.2° | 109.4° |
| C25 | C26 | C27 | 115.5° | 109.0° |
| C25 | C26 | O84 | 104.8° | 109.6° |
| C26 | C25 | H40 | 107.9° | 109.5° |
| C25 | C26 | H41 | 108.5° | 109.5° |
| C14 | C13 | C12 | 113.1° | 109.5° |
| C13 | C14 | C15 | 112.5° | 109.5° |
| C14 | C13 | H26 | 108.5° | 109.5° |
| C14 | C13 | H27 | 108.5° | 109.5° |
| C13 | C14 | H28 | 108.7° | 109.4° |
| C13 | C14 | H29 | 108.7° | 109.4° |
| C13 | C12 | C11 | 113.4° | 109.5° |
| C13 | C12 | H24 | 108.5° | 109.5° |
| C13 | C12 | H25 | 108.5° | 109.5° |
| C12 | C13 | H26 | 108.6° | 109.5° |
| C12 | C13 | H27 | 108.6° | 109.5° |
| C30 | C28 | C27 | 108.8° | 109.5° |
| C28 | C30 | O31 | 108.1° | 109.4° |
| C30 | C28 | H43 | 107.3° | 109.5° |
| C28 | C30 | H44 | 109.8° | 109.5° |
| C28 | C30 | H45 | 109.8° | 109.5° |
| C28 | C27 | C26 | 109.5° | 109.2° |
| C28 | C27 | O32 | 105.7° | 109.5° |
| C28 | C27 | H42 | 111.1° | 109.5° |
| C27 | C28 | H43 | 107.9° | 109.4° |
| C15 | C14 | H28 | 108.7° | 109.5° |
| C15 | C14 | H29 | 108.7° | 109.5° |
| C14 | C15 | H30 | 108.5° | 109.5° |
| C14 | C15 | H31 | 108.5° | 109.5° |
| C27 | C26 | O84 | 110.7° | 109.5° |
| C26 | C27 | O32 | 108.3° | 109.5° |
| C27 | C26 | H41 | 108.2° | 109.5° |
| C26 | C27 | H42 | 111.1° | 109.5° |
| O84 | C26 | H41 | 109.1° | 109.6° |
| C26 | O84 | H89 | 109.5° | 114.0° |
| O31 | C30 | H44 | 109.8° | 109.5° |
| O31 | C30 | H45 | 109.8° | 109.4° |
| C30 | O31 | H84 | 109.5° | 114.0° |
| C12 | C11 | C10 | 111.6° | 109.5° |
| C12 | C11 | H22 | 108.9° | 109.5° |
| C12 | C11 | H23 | 108.9° | 109.5° |
| C11 | C12 | H24 | 108.5° | 109.4° |
| C11 | C12 | H25 | 108.5° | 109.4° |
| C27 | O32 | C33 | 110.6° | 114.0° |
| O32 | C27 | H42 | 111.0° | 109.6° |
| C11 | C10 | C09 | 112.0° | 109.5° |
| C11 | C10 | H20 | 108.8° | 109.5° |
| C11 | C10 | H21 | 108.8° | 109.4° |
| C10 | C11 | H22 | 109.0° | 109.5° |
| C10 | C11 | H23 | 109.0° | 109.4° |
| O32 | C33 | O38 | 107.3° | 109.5° |
| O32 | C33 | C34 | 111.6° | 109.5° |
| O32 | C33 | H46 | 109.8° | 109.5° |
| C10 | C09 | C08 | 137.0° | 109.5° |
| C10 | C09 | H18 | 102.2° | 109.5° |
| C10 | C09 | H19 | 102.2° | 109.5° |
| C09 | C10 | H20 | 108.8° | 109.5° |
| C09 | C10 | H21 | 108.9° | 109.5° |
| O38 | C33 | C34 | 109.9° | 109.4° |
| C33 | O38 | C37 | 110.7° | 114.1° |
| O38 | C33 | H46 | 109.6° | 109.5° |
| C33 | C34 | O83 | 108.6° | 109.6° |
| C33 | C34 | C35 | 109.2° | 109.2° |
| C34 | C33 | H46 | 108.6° | 109.5° |
| C33 | C34 | H47 | 109.1° | 109.6° |
| O38 | C37 | C39 | 107.7° | 109.5° |
| O38 | C37 | C36 | 113.0° | 109.4° |
| O38 | C37 | H50 | 109.7° | 109.5° |
| C09 | C08 | C07 | 112.0° | 109.5° |
| C09 | C08 | H16 | 108.8° | 109.5° |
| C09 | C08 | H17 | 108.8° | 109.5° |
| C08 | C09 | H18 | 102.2° | 109.5° |
| C08 | C09 | H19 | 102.2° | 109.5° |
| O83 | C34 | C35 | 109.0° | 109.5° |
| O83 | C34 | H47 | 111.0° | 109.5° |
| C34 | O83 | H88 | 109.5° | 114.0° |
| C34 | C35 | C36 | 113.6° | 109.0° |
| C34 | C35 | O42 | 108.9° | 109.6° |
| C35 | C34 | H47 | 109.9° | 109.5° |
| C34 | C35 | H48 | 108.1° | 109.5° |
| O40 | C39 | C37 | 107.9° | 109.5° |
| O40 | C39 | H51 | 109.8° | 109.5° |
| O40 | C39 | H52 | 109.8° | 109.4° |
| C39 | O40 | H85 | 109.5° | 114.1° |
| C39 | C37 | C36 | 108.9° | 109.5° |
| C39 | C37 | H50 | 108.7° | 109.5° |
| C37 | C39 | H51 | 109.9° | 109.5° |
| C37 | C39 | H52 | 109.8° | 109.5° |
| C37 | C36 | C35 | 114.0° | 109.2° |
| C37 | C36 | O41 | 109.0° | 109.5° |
| C37 | C36 | H49 | 107.1° | 109.5° |
| C36 | C37 | H50 | 108.8° | 109.5° |
| C08 | C07 | C06 | 112.5° | 109.5° |
| C08 | C07 | H14 | 108.7° | 109.5° |
| C08 | C07 | H15 | 108.7° | 109.5° |
| C07 | C08 | H16 | 108.9° | 109.5° |
| C07 | C08 | H17 | 108.8° | 109.4° |
| C36 | C35 | O42 | 109.7° | 109.5° |
| C35 | C36 | O41 | 110.0° | 109.5° |
| C36 | C35 | H48 | 108.1° | 109.5° |
| C35 | C36 | H49 | 107.9° | 109.6° |
| O42 | C35 | H48 | 108.3° | 109.6° |
| C35 | O42 | H87 | 109.5° | 114.0° |
| O41 | C36 | H49 | 108.8° | 109.5° |
| C36 | O41 | H86 | 109.5° | 114.1° |
| C07 | C06 | C05 | 113.3° | 109.5° |
| C07 | C06 | H12 | 108.5° | 109.5° |
| C07 | C06 | H13 | 108.5° | 109.5° |
| C06 | C07 | H14 | 108.7° | 109.5° |
| C06 | C07 | H15 | 108.7° | 109.5° |
| C06 | C05 | C04 | 112.7° | 109.5° |
| C06 | C05 | H10 | 108.6° | 109.5° |
| C06 | C05 | H11 | 108.7° | 109.5° |
| C05 | C06 | H12 | 108.5° | 109.5° |
| C05 | C06 | H13 | 108.5° | 109.4° |
| C05 | C04 | C03 | 113.6° | 109.5° |
| C05 | C04 | H8 | 108.4° | 109.5° |
| C05 | C04 | H9 | 108.4° | 109.4° |
| C04 | C05 | H10 | 108.7° | 109.5° |
| C04 | C05 | H11 | 108.7° | 109.4° |
| C04 | C03 | C02 | 112.8° | 109.5° |
| C04 | C03 | H6 | 108.6° | 109.5° |
| C04 | C03 | H7 | 108.6° | 109.5° |
| C03 | C04 | H8 | 108.4° | 109.5° |
| C03 | C04 | H9 | 108.5° | 109.5° |
| C03 | C02 | C01 | 112.9° | 109.5° |
| C03 | C02 | H4 | 108.6° | 109.4° |
| C03 | C02 | H5 | 108.6° | 109.4° |
| C02 | C03 | H6 | 108.7° | 109.5° |
| C02 | C03 | H7 | 108.6° | 109.5° |
| C02 | C01 | H1 | 109.5° | 109.5° |
| C02 | C01 | H2 | 109.5° | 109.5° |
| C02 | C01 | H3 | 109.5° | 109.5° |
| C01 | C02 | H4 | 108.6° | 109.5° |
| C01 | C02 | H5 | 108.6° | 109.5° |
| H1 | C01 | H2 | 109.4° | 109.4° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.4° |
| H4 | C02 | H5 | 109.5° | 109.5° |
| H6 | C03 | H7 | 109.5° | 109.4° |
| H8 | C04 | H9 | 109.5° | 109.5° |
| H10 | C05 | H11 | 109.5° | 109.4° |
| H12 | C06 | H13 | 109.5° | 109.4° |
| H14 | C07 | H15 | 109.5° | 109.4° |
| H16 | C08 | H17 | 109.4° | 109.4° |
| H18 | C09 | H19 | 109.5° | 109.4° |
| H20 | C10 | H21 | 109.5° | 109.5° |
| H22 | C11 | H23 | 109.4° | 109.4° |
| H24 | C12 | H25 | 109.5° | 109.5° |
| H26 | C13 | H27 | 109.5° | 109.4° |
| H28 | C14 | H29 | 109.5° | 109.5° |
| H30 | C15 | H31 | 109.5° | 109.4° |
| H32 | C16 | H33 | 109.4° | 109.5° |
| H34 | C17 | H35 | 109.5° | 109.4° |
| H37 | C22 | H38 | 109.5° | 109.5° |
| H44 | C30 | H45 | 109.5° | 109.5° |
| H51 | C39 | H52 | 109.5° | 109.5° |
| H56 | C89 | H57 | 109.5° | 109.4° |
| H58 | C90 | H59 | 109.5° | 109.4° |
| H60 | C91 | H61 | 109.5° | 109.5° |
| H62 | C92 | H63 | 109.5° | 109.4° |
| H64 | C93 | H65 | 109.5° | 109.4° |
| H66 | C94 | H67 | 109.5° | 109.5° |
| H68 | C95 | H69 | 109.5° | 109.5° |
| H70 | C96 | H71 | 109.5° | 109.5° |
| H72 | C97 | H73 | 109.5° | 109.6° |
| H74 | C98 | H75 | 109.5° | 109.4° |
| H76 | C99 | H77 | 109.4° | 109.5° |
| H78 | CA0 | H79 | 109.5° | 109.5° |
| H80 | CA1 | H81 | 109.4° | 109.4° |
| H80 | CA1 | H82 | 109.5° | 109.5° |
| H81 | CA1 | H82 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C90 | C91 | C92 | H60 | 119.7° | 120.0° |
| C90 | C91 | C92 | H61 | 119.7° | 120.0° |
| C91 | C90 | C89 | H58 | 119.8° | 120.0° |
| C91 | C90 | C89 | H59 | 119.8° | 120.0° |
| C90 | C91 | C92 | C93 | 149.4° | 180.0° |
| C91 | C90 | C89 | C88 | 155.2° | 180.0° |
| C91 | C90 | C89 | H56 | 84.5° | 60.0° |
| C91 | C90 | C89 | H57 | 34.9° | 60.0° |
| C91 | C90 | H58 | H59 | 120.6° | 120.0° |
| C90 | C91 | H60 | H61 | 120.8° | 120.0° |
| C90 | C91 | C92 | H62 | 90.2° | 60.0° |
| C90 | C91 | C92 | H63 | 28.9° | 60.0° |
| C92 | C91 | C90 | C89 | 28.9° | 180.0° |
| C91 | C92 | C93 | H62 | 120.4° | 120.1° |
| C91 | C92 | C93 | H63 | 120.5° | 120.0° |
| C91 | C92 | C93 | C94 | 177.3° | NaN° |
| C92 | C91 | C90 | H58 | 90.9° | 60.0° |
| C92 | C91 | C90 | H59 | 148.6° | 60.0° |
| C92 | C91 | H60 | H61 | 120.8° | 120.0° |
| C91 | C92 | H62 | H63 | 118.7° | 120.0° |
| C91 | C92 | C93 | H64 | 62.5° | 59.9° |
| C91 | C92 | C93 | H65 | 57.0° | 60.0° |
| C90 | C89 | C88 | H56 | 120.3° | 120.1° |
| C90 | C89 | C88 | H57 | 120.3° | 120.0° |
| C90 | C89 | C88 | C87 | 99.6° | 125.0° |
| C90 | C89 | C88 | H55 | 80.4° | 55.1° |
| C90 | C89 | H56 | H57 | 119.0° | 120.0° |
| C89 | C90 | H58 | H59 | 120.6° | 120.0° |
| C89 | C90 | C91 | H60 | 90.8° | 60.0° |
| C89 | C90 | C91 | H61 | 148.6° | 60.1° |
| C92 | C93 | C94 | H64 | 120.3° | 120.0° |
| C92 | C93 | C94 | H65 | 120.2° | 120.0° |
| C92 | C93 | C94 | C95 | 16.1° | 180.0° |
| C93 | C92 | C91 | H60 | 29.7° | 60.0° |
| C93 | C92 | C91 | H61 | 90.9° | 60.0° |
| C93 | C92 | H62 | H63 | 118.6° | 120.0° |
| C92 | C93 | H64 | H65 | 119.3° | 119.9° |
| C92 | C93 | C94 | H66 | 104.2° | 60.0° |
| C92 | C93 | C94 | H67 | 136.3° | 60.0° |
| C93 | C94 | C95 | H66 | 120.2° | 120.0° |
| C93 | C94 | C95 | H67 | 120.2° | 119.9° |
| C93 | C94 | C95 | C96 | 151.2° | 180.0° |
| C94 | C93 | C92 | H62 | 56.8° | 59.9° |
| C94 | C93 | C92 | H63 | 62.3° | 60.0° |
| C94 | C93 | H64 | H65 | 119.3° | 120.0° |
| C93 | C94 | H66 | H67 | 119.3° | 120.0° |
| C93 | C94 | C95 | H68 | 31.0° | 60.0° |
| C93 | C94 | C95 | H69 | 88.6° | 60.0° |
| CA1 | CA0 | C99 | H78 | 120.0° | 120.0° |
| CA1 | CA0 | C99 | H79 | 120.0° | 120.0° |
| CA1 | CA0 | C99 | C98 | 11.9° | 180.0° |
| CA1 | CA0 | C99 | H76 | 131.9° | 60.1° |
| CA1 | CA0 | C99 | H77 | 108.1° | 60.0° |
| CA1 | CA0 | H78 | H79 | 119.8° | 120.1° |
| CA0 | CA1 | H80 | H81 | 120.0° | 120.0° |
| CA0 | CA1 | H80 | H82 | 120.0° | 120.1° |
| CA0 | CA1 | H81 | H82 | 120.0° | 120.1° |
| C89 | C88 | C87 | H55 | 180.0° | 179.9° |
| C89 | C88 | C87 | C86 | 180.0° | 180.0° |
| C89 | C88 | C87 | H54 | 0.0° | 0.0° |
| C88 | C89 | H56 | H57 | 119.0° | 120.0° |
| C88 | C89 | C90 | H58 | 35.4° | 59.9° |
| C88 | C89 | C90 | H59 | 85.0° | 60.0° |
| C94 | C95 | C96 | H68 | 120.2° | 120.0° |
| C94 | C95 | C96 | H69 | 120.2° | 120.0° |
| C94 | C95 | C96 | C97 | 16.3° | 180.0° |
| C95 | C94 | C93 | H64 | 136.3° | 60.0° |
| C95 | C94 | C93 | H65 | 104.2° | 60.0° |
| C95 | C94 | H66 | H67 | 119.4° | 120.0° |
| C94 | C95 | H68 | H69 | 119.3° | 120.0° |
| C94 | C95 | C96 | H70 | 103.6° | 60.0° |
| C94 | C95 | C96 | H71 | 136.3° | 60.0° |
| CA0 | C99 | C98 | C97 | 145.8° | 180.0° |
| CA0 | C99 | C98 | H76 | 120.0° | 119.9° |
| CA0 | C99 | C98 | H77 | 120.0° | 120.1° |
| CA0 | C99 | C98 | H74 | 94.0° | 60.0° |
| CA0 | C99 | C98 | H75 | 25.6° | 59.9° |
| CA0 | C99 | H76 | H77 | 120.1° | 120.0° |
| C99 | CA0 | H78 | H79 | 119.9° | 120.0° |
| C99 | CA0 | CA1 | H80 | 180.0° | 180.0° |
| C99 | CA0 | CA1 | H81 | 60.0° | 60.1° |
| C99 | CA0 | CA1 | H82 | 60.0° | 60.0° |
| C88 | C87 | C86 | H54 | 180.0° | 180.0° |
| C88 | C87 | C86 | OA2 | 13.7° | 5.0° |
| C88 | C87 | C86 | C21 | 137.5° | 125.0° |
| C88 | C87 | C86 | H53 | 103.4° | 115.0° |
| C87 | C88 | C89 | H56 | 140.0° | 114.9° |
| C87 | C88 | C89 | H57 | 20.7° | 5.0° |
| C97 | C98 | C99 | H74 | 120.2° | 120.0° |
| C97 | C98 | C99 | H75 | 120.2° | 120.1° |
| C98 | C97 | C96 | C95 | 122.8° | 180.0° |
| C98 | C97 | C96 | H72 | 120.4° | 119.9° |
| C98 | C97 | C96 | H73 | 120.4° | 120.0° |
| C98 | C97 | C96 | H70 | 2.9° | 60.0° |
| C98 | C97 | C96 | H71 | 117.2° | 60.0° |
| C98 | C97 | H72 | H73 | 118.7° | 120.0° |
| C97 | C98 | H74 | H75 | 119.3° | 120.0° |
| C97 | C98 | C99 | H76 | 94.2° | 60.0° |
| C97 | C98 | C99 | H77 | 25.8° | 59.9° |
| C99 | C98 | C97 | C96 | 30.0° | 180.0° |
| C99 | C98 | C97 | H72 | 150.4° | 60.1° |
| C99 | C98 | C97 | H73 | 90.4° | 60.0° |
| C99 | C98 | H74 | H75 | 119.3° | 120.0° |
| C98 | C99 | H76 | H77 | 120.1° | 120.0° |
| C98 | C99 | CA0 | H78 | 108.1° | 60.0° |
| C98 | C99 | CA0 | H79 | 132.0° | 60.0° |
| C95 | C96 | C97 | H70 | 119.9° | 120.0° |
| C95 | C96 | C97 | H71 | 120.0° | 120.0° |
| C96 | C95 | C94 | H66 | 88.5° | 60.0° |
| C96 | C95 | C94 | H67 | 31.0° | 60.0° |
| C96 | C95 | H68 | H69 | 119.3° | 120.0° |
| C95 | C96 | H70 | H71 | 120.1° | 120.1° |
| C95 | C96 | C97 | H72 | 2.4° | 60.1° |
| C95 | C96 | C97 | H73 | 116.8° | 60.0° |
| C97 | C96 | C95 | H68 | 136.5° | 60.0° |
| C97 | C96 | C95 | H69 | 103.9° | 60.0° |
| C97 | C96 | H70 | H71 | 120.2° | 120.0° |
| C96 | C97 | H72 | H73 | 118.7° | 120.0° |
| C96 | C97 | C98 | H74 | 150.2° | 60.0° |
| C96 | C97 | C98 | H75 | 90.2° | 60.0° |
| C87 | C86 | OA2 | C21 | 127.1° | 120.0° |
| C87 | C86 | OA2 | H53 | 116.1° | 120.0° |
| C87 | C86 | C21 | H53 | 119.3° | 120.0° |
| C87 | C86 | C21 | N20 | 19.7° | 60.9° |
| C87 | C86 | C21 | C22 | 148.7° | 179.1° |
| C87 | C86 | C21 | H36 | 97.7° | 59.1° |
| C86 | C87 | C88 | H55 | 0.0° | 0.0° |
| C87 | C86 | OA2 | H91 | 180.0° | 65.9° |
| OA2 | C86 | C21 | H53 | 118.1° | 120.0° |
| OA2 | C86 | C21 | N20 | 142.4° | 179.1° |
| OA2 | C86 | C21 | C22 | 88.6° | 59.1° |
| OA2 | C86 | C21 | H36 | 25.0° | 60.9° |
| OA2 | C86 | C87 | H54 | 166.3° | 175.0° |
| C86 | C21 | C22 | O23 | 0.2° | 55.6° |
| C86 | C21 | N20 | C22 | 123.3° | 120.0° |
| C86 | C21 | N20 | H36 | 116.9° | 120.0° |
| C86 | C21 | C22 | H36 | 113.6° | 120.0° |
| C86 | C21 | N20 | C18 | 128.0° | 155.0° |
| C86 | C21 | C22 | H37 | 120.1° | 64.4° |
| C86 | C21 | C22 | H38 | 119.8° | 175.6° |
| C21 | C86 | C87 | H54 | 42.5° | 55.0° |
| C86 | C21 | N20 | H83 | 51.9° | 24.9° |
| C21 | C86 | OA2 | H91 | 52.9° | 54.1° |
| C24 | O23 | C22 | C21 | 168.8° | 180.0° |
| O23 | C24 | O29 | C25 | 113.9° | 120.0° |
| O23 | C24 | O29 | H39 | 121.5° | 120.1° |
| O23 | C24 | C25 | H39 | 120.1° | 120.0° |
| O23 | C24 | C25 | O85 | 86.4° | 62.5° |
| O23 | C24 | O29 | C28 | 149.2° | 178.8° |
| O23 | C24 | C25 | C26 | 150.7° | 177.6° |
| C24 | O23 | C22 | H37 | 48.9° | 60.0° |
| C24 | O23 | C22 | H38 | 71.2° | 60.0° |
| O23 | C24 | C25 | H40 | 31.2° | 57.7° |
| O23 | C22 | C21 | N20 | 126.1° | 64.4° |
| O23 | C22 | C21 | H37 | 119.9° | 120.0° |
| O23 | C22 | C21 | H38 | 119.9° | 120.0° |
| C22 | O23 | C24 | O29 | 56.6° | 65.0° |
| C22 | O23 | C24 | C25 | 63.9° | 175.1° |
| O23 | C22 | C21 | H36 | 113.8° | 175.6° |
| O23 | C22 | H37 | H38 | 120.3° | 120.0° |
| C22 | O23 | C24 | H39 | 177.2° | 55.0° |
| N20 | C21 | C22 | H36 | 120.2° | 120.0° |
| C21 | N20 | C18 | H83 | 180.0° | 180.0° |
| C21 | N20 | C18 | C17 | 179.4° | 180.0° |
| C21 | N20 | C18 | O19 | 0.5° | 0.0° |
| N20 | C21 | C22 | H37 | 6.2° | 175.6° |
| N20 | C21 | C22 | H38 | 114.0° | 55.6° |
| N20 | C21 | C86 | H53 | 99.5° | 59.1° |
| C22 | C21 | N20 | C18 | 4.7° | 85.0° |
| C21 | C22 | H37 | H38 | 120.2° | 120.0° |
| C22 | C21 | C86 | H53 | 29.5° | 60.9° |
| C22 | C21 | N20 | H83 | 175.3° | 95.1° |
| O29 | C24 | C25 | H39 | 124.9° | 120.0° |
| O29 | C24 | C25 | O85 | 158.6° | 177.5° |
| O29 | C24 | C25 | C26 | 35.7° | 57.6° |
| C24 | O29 | C28 | C30 | 169.8° | 178.8° |
| C24 | O29 | C28 | C27 | 46.9° | 61.2° |
| O29 | C24 | C25 | H40 | 83.8° | 62.3° |
| C24 | O29 | C28 | H43 | 74.3° | 58.7° |
| C24 | C25 | O85 | C26 | 126.4° | 119.7° |
| C24 | C25 | O85 | H40 | 116.4° | 120.1° |
| C25 | C24 | O29 | C28 | 35.4° | 61.2° |
| C24 | C25 | C26 | H40 | 118.9° | 119.9° |
| C24 | C25 | C26 | C27 | 46.5° | 57.0° |
| C24 | C25 | C26 | O84 | 168.5° | 176.8° |
| C24 | C25 | C26 | H41 | 75.0° | 62.9° |
| C24 | C25 | O85 | H90 | 180.0° | 60.0° |
| N20 | C18 | C17 | C16 | 32.9° | 180.0° |
| N20 | C18 | C17 | O19 | 179.0° | 180.0° |
| N20 | C18 | C17 | H34 | 153.7° | 60.0° |
| N20 | C18 | C17 | H35 | 87.8° | 60.0° |
| C18 | N20 | C21 | H36 | 115.0° | 35.0° |
| O85 | C25 | C26 | H40 | 117.6° | 120.2° |
| O85 | C25 | C26 | C27 | 170.0° | 176.9° |
| O85 | C25 | C26 | O84 | 68.0° | 63.2° |
| O85 | C25 | C24 | H39 | 33.7° | 57.6° |
| O85 | C25 | C26 | H41 | 48.4° | 57.0° |
| O29 | C28 | C30 | C27 | 127.3° | 119.9° |
| O29 | C28 | C30 | H43 | 116.3° | 120.1° |
| O29 | C28 | C27 | H43 | 121.3° | 120.0° |
| O29 | C28 | C27 | C26 | 55.0° | 57.6° |
| O29 | C28 | C30 | O31 | 153.2° | 65.0° |
| O29 | C28 | C27 | O32 | 171.5° | 177.5° |
| C28 | O29 | C24 | H39 | 89.3° | 58.8° |
| O29 | C28 | C27 | H42 | 68.1° | 62.3° |
| O29 | C28 | C30 | H44 | 87.0° | 174.9° |
| O29 | C28 | C30 | H45 | 33.4° | 54.9° |
| C17 | C16 | C15 | H32 | 120.4° | 120.0° |
| C17 | C16 | C15 | H33 | 120.4° | 120.0° |
| C16 | C17 | C18 | H34 | 120.8° | 120.0° |
| C16 | C17 | C18 | H35 | 120.8° | 120.0° |
| C16 | C17 | C18 | O19 | 148.1° | 0.0° |
| C17 | C16 | C15 | C14 | 175.2° | 180.0° |
| C17 | C16 | C15 | H30 | 64.3° | 60.0° |
| C17 | C16 | C15 | H31 | 54.6° | 60.0° |
| C17 | C16 | H32 | H33 | 118.9° | 120.0° |
| C16 | C17 | H34 | H35 | 117.6° | 120.0° |
| C15 | C16 | C17 | C18 | 116.7° | 180.0° |
| C16 | C15 | C14 | C13 | 89.7° | 180.0° |
| C16 | C15 | C14 | H30 | 120.6° | 120.0° |
| C16 | C15 | C14 | H31 | 120.6° | 120.0° |
| C16 | C15 | C14 | H28 | 30.8° | 60.0° |
| C16 | C15 | C14 | H29 | 149.9° | 60.0° |
| C16 | C15 | H30 | H31 | 118.2° | 120.0° |
| C15 | C16 | H32 | H33 | 118.9° | 120.0° |
| C15 | C16 | C17 | H34 | 4.1° | 60.0° |
| C15 | C16 | C17 | H35 | 122.6° | 60.0° |
| C18 | C17 | C16 | H32 | 3.7° | 60.0° |
| C18 | C17 | C16 | H33 | 123.0° | 60.0° |
| C18 | C17 | H34 | H35 | 117.7° | 120.0° |
| C17 | C18 | N20 | H83 | 0.5° | 0.0° |
| O19 | C18 | C17 | H34 | 27.3° | 120.0° |
| O19 | C18 | C17 | H35 | 91.2° | 120.0° |
| O19 | C18 | N20 | H83 | 179.4° | 180.0° |
| C25 | C26 | C27 | C28 | 54.6° | 57.0° |
| C25 | C26 | C27 | O84 | 118.8° | 119.9° |
| C25 | C26 | C27 | H41 | 121.7° | 119.8° |
| C25 | C26 | O84 | H41 | 116.0° | 120.2° |
| C25 | C26 | C27 | O32 | 169.4° | 176.8° |
| C26 | C25 | C24 | H39 | 89.2° | 62.4° |
| C25 | C26 | C27 | H42 | 68.5° | 63.0° |
| C25 | C26 | O84 | H89 | 180.0° | 60.0° |
| C26 | C25 | O85 | H90 | 53.6° | 179.7° |
| C14 | C13 | C12 | H26 | 120.6° | 120.0° |
| C14 | C13 | C12 | H27 | 120.5° | 120.0° |
| C13 | C14 | C15 | H28 | 120.4° | 120.0° |
| C13 | C14 | C15 | H29 | 120.4° | 120.0° |
| C14 | C13 | C12 | C11 | 101.4° | 180.0° |
| C14 | C13 | C12 | H24 | 138.0° | 60.0° |
| C14 | C13 | C12 | H25 | 19.1° | 60.0° |
| C14 | C13 | H26 | H27 | 118.3° | 120.0° |
| C13 | C14 | H28 | H29 | 118.6° | 120.0° |
| C13 | C14 | C15 | H30 | 30.9° | 60.0° |
| C13 | C14 | C15 | H31 | 149.8° | 60.0° |
| C12 | C13 | C14 | C15 | 58.2° | 180.0° |
| C13 | C12 | C11 | H24 | 120.6° | 120.0° |
| C13 | C12 | C11 | H25 | 120.6° | 120.0° |
| C13 | C12 | C11 | C10 | 166.5° | 180.0° |
| C13 | C12 | C11 | H22 | 46.1° | 60.0° |
| C13 | C12 | C11 | H23 | 73.2° | 60.0° |
| C13 | C12 | H24 | H25 | 118.2° | 120.0° |
| C12 | C13 | H26 | H27 | 118.3° | 120.0° |
| C12 | C13 | C14 | H28 | 178.7° | 60.0° |
| C12 | C13 | C14 | H29 | 62.2° | 60.0° |
| C30 | C28 | C27 | H43 | 116.0° | 120.0° |
| C30 | C28 | C27 | C26 | 177.7° | 177.6° |
| C28 | C30 | O31 | H44 | 119.8° | 120.0° |
| C28 | C30 | O31 | H45 | 119.8° | 119.9° |
| C30 | C28 | C27 | O32 | 65.8° | 62.5° |
| C30 | C28 | C27 | H42 | 54.6° | 57.7° |
| C28 | C30 | H44 | H45 | 120.6° | 120.0° |
| C28 | C30 | O31 | H84 | 180.0° | 180.0° |
| C28 | C27 | C26 | O32 | 114.7° | 119.9° |
| C28 | C27 | C26 | H42 | 123.1° | 119.9° |
| C28 | C27 | C26 | O84 | 173.4° | 176.9° |
| C27 | C28 | C30 | O31 | 79.6° | 175.0° |
| C28 | C27 | O32 | H42 | 120.5° | 120.1° |
| C28 | C27 | O32 | C33 | 151.0° | 150.3° |
| C28 | C27 | C26 | H41 | 67.1° | 62.9° |
| C27 | C28 | C30 | H44 | 40.2° | 55.0° |
| C27 | C28 | C30 | H45 | 160.6° | 65.1° |
| C15 | C14 | C13 | H26 | 178.8° | 60.0° |
| C15 | C14 | C13 | H27 | 62.3° | 60.0° |
| C15 | C14 | H28 | H29 | 118.6° | 120.0° |
| C14 | C15 | H30 | H31 | 118.2° | 120.0° |
| C14 | C15 | C16 | H32 | 54.8° | 60.0° |
| C14 | C15 | C16 | H33 | 64.5° | 60.0° |
| C27 | C26 | O84 | H41 | 118.9° | 120.2° |
| C26 | C27 | O32 | H42 | 122.2° | 120.2° |
| C26 | C27 | O32 | C33 | 91.7° | 90.0° |
| C27 | C26 | C25 | H40 | 72.4° | 62.9° |
| C26 | C27 | C28 | H43 | 66.2° | 62.4° |
| C27 | C26 | O84 | H89 | 54.9° | 179.5° |
| O84 | C26 | C27 | O32 | 71.8° | 63.3° |
| O84 | C26 | C25 | H40 | 49.6° | 56.9° |
| O84 | C26 | C27 | H42 | 50.3° | 56.9° |
| O31 | C30 | C28 | H43 | 36.8° | 55.0° |
| O31 | C30 | H44 | H45 | 120.6° | 120.0° |
| C12 | C11 | C10 | H22 | 120.3° | 120.0° |
| C12 | C11 | C10 | H23 | 120.3° | 120.0° |
| C12 | C11 | C10 | C09 | 157.4° | 180.0° |
| C12 | C11 | C10 | H20 | 82.2° | 59.9° |
| C12 | C11 | C10 | H21 | 37.0° | 60.0° |
| C12 | C11 | H22 | H23 | 119.0° | 120.0° |
| C11 | C12 | H24 | H25 | 118.2° | 120.0° |
| C11 | C12 | C13 | H26 | 19.1° | 60.0° |
| C11 | C12 | C13 | H27 | 138.0° | 60.0° |
| C27 | O32 | C33 | O38 | 102.9° | 65.0° |
| C27 | O32 | C33 | C34 | 136.5° | 175.1° |
| O32 | C27 | C26 | H41 | 47.7° | 57.0° |
| O32 | C27 | C28 | H43 | 50.2° | 57.6° |
| C27 | O32 | C33 | H46 | 16.1° | 55.1° |
| C11 | C10 | C09 | H20 | 120.4° | 120.0° |
| C11 | C10 | C09 | H21 | 120.4° | 119.9° |
| C11 | C10 | C09 | C08 | 150.5° | 180.0° |
| C11 | C10 | C09 | H18 | 86.2° | 59.9° |
| C11 | C10 | C09 | H19 | 27.2° | 60.0° |
| C11 | C10 | H20 | H21 | 118.8° | 119.9° |
| C10 | C11 | H22 | H23 | 119.1° | 119.9° |
| C10 | C11 | C12 | H24 | 73.0° | 60.0° |
| C10 | C11 | C12 | H25 | 45.9° | 60.0° |
| O32 | C33 | O38 | C34 | 121.6° | 120.0° |
| O32 | C33 | O38 | H46 | 119.2° | 120.0° |
| O32 | C33 | C34 | H46 | 121.2° | 120.0° |
| O32 | C33 | O38 | C37 | 176.5° | 178.8° |
| O32 | C33 | C34 | O83 | 59.9° | 62.5° |
| O32 | C33 | C34 | C35 | 178.7° | 177.6° |
| C33 | O32 | C27 | H42 | 30.5° | 30.2° |
| O32 | C33 | C34 | H47 | 61.2° | 57.7° |
| C10 | C09 | C08 | H18 | 123.3° | 120.0° |
| C10 | C09 | C08 | H19 | 123.3° | 120.0° |
| C10 | C09 | C08 | C07 | 170.6° | 180.0° |
| C10 | C09 | C08 | H16 | 69.0° | 60.0° |
| C10 | C09 | C08 | H17 | 50.2° | 60.0° |
| C10 | C09 | H18 | H19 | 107.8° | 120.0° |
| C09 | C10 | H20 | H21 | 118.9° | 120.0° |
| C09 | C10 | C11 | H22 | 37.1° | 59.9° |
| C09 | C10 | C11 | H23 | 82.2° | 60.0° |
| O38 | C33 | C34 | H46 | 119.9° | 120.0° |
| O38 | C33 | C34 | O83 | 178.9° | 177.5° |
| O38 | C33 | C34 | C35 | 62.4° | 57.6° |
| C33 | O38 | C37 | C39 | 172.5° | 178.9° |
| C33 | O38 | C37 | C36 | 52.1° | 61.2° |
| O38 | C33 | C34 | H47 | 57.8° | 62.3° |
| C33 | O38 | C37 | H50 | 69.4° | 58.9° |
| C34 | C33 | O38 | C37 | 61.9° | 61.2° |
| C33 | C34 | O83 | C35 | 118.9° | 119.7° |
| C33 | C34 | O83 | H47 | 119.9° | 120.2° |
| C33 | C34 | C35 | H47 | 119.6° | 120.0° |
| C33 | C34 | C35 | C36 | 53.6° | 57.0° |
| C33 | C34 | C35 | O42 | 176.1° | 176.8° |
| C33 | C34 | C35 | H48 | 66.4° | 62.9° |
| C33 | C34 | O83 | H88 | 180.0° | 60.0° |
| O38 | C37 | C39 | O40 | 30.6° | 65.1° |
| O38 | C37 | C39 | C36 | 122.8° | 119.9° |
| O38 | C37 | C39 | H50 | 118.8° | 120.1° |
| O38 | C37 | C36 | H50 | 122.0° | 120.1° |
| O38 | C37 | C36 | C35 | 43.5° | 57.6° |
| O38 | C37 | C36 | O41 | 79.8° | 62.3° |
| C37 | O38 | C33 | H46 | 57.3° | 58.8° |
| O38 | C37 | C36 | H49 | 162.6° | 177.6° |
| O38 | C37 | C39 | H51 | 150.3° | 174.9° |
| O38 | C37 | C39 | H52 | 89.2° | 54.9° |
| C09 | C08 | C07 | H16 | 120.4° | 120.0° |
| C09 | C08 | C07 | H17 | 120.4° | 120.0° |
| C09 | C08 | C07 | C06 | 54.2° | NaN° |
| C09 | C08 | C07 | H14 | 66.2° | 60.0° |
| C09 | C08 | C07 | H15 | 174.7° | 60.0° |
| C09 | C08 | H16 | H17 | 118.8° | 120.0° |
| C08 | C09 | H18 | H19 | 107.9° | 120.0° |
| C08 | C09 | C10 | H20 | 30.1° | 60.0° |
| C08 | C09 | C10 | H21 | 89.1° | 60.0° |
| O83 | C34 | C35 | H47 | 121.8° | 120.1° |
| O83 | C34 | C35 | C36 | 172.1° | 176.9° |
| O83 | C34 | C35 | O42 | 65.3° | 63.2° |
| O83 | C34 | C33 | H46 | 61.2° | 57.5° |
| O83 | C34 | C35 | H48 | 52.1° | 57.0° |
| C34 | C35 | C36 | C37 | 45.1° | 57.0° |
| C34 | C35 | C36 | O42 | 122.1° | 119.9° |
| C34 | C35 | C36 | H48 | 120.0° | 119.9° |
| C34 | C35 | O42 | H48 | 117.4° | 120.2° |
| C34 | C35 | C36 | O41 | 77.6° | 63.0° |
| C35 | C34 | C33 | H46 | 57.5° | 62.4° |
| C34 | C35 | C36 | H49 | 163.8° | 176.9° |
| C34 | C35 | O42 | H87 | 180.0° | 60.0° |
| C35 | C34 | O83 | H88 | 61.1° | 179.7° |
| O40 | C39 | C37 | H51 | 119.7° | 120.0° |
| O40 | C39 | C37 | H52 | 119.7° | 120.0° |
| O40 | C39 | C37 | C36 | 92.3° | 175.0° |
| O40 | C39 | C37 | H50 | 149.3° | 55.0° |
| O40 | C39 | H51 | H52 | 120.7° | 120.0° |
| C39 | C37 | C36 | H50 | 118.4° | 120.0° |
| C39 | C37 | C36 | C35 | 163.1° | 177.6° |
| C39 | C37 | C36 | O41 | 39.8° | 57.7° |
| C39 | C37 | C36 | H49 | 77.8° | 62.5° |
| C37 | C39 | H51 | H52 | 120.7° | 120.0° |
| C37 | C39 | O40 | H85 | 180.0° | 180.0° |
| C37 | C36 | C35 | O41 | 122.7° | 119.9° |
| C37 | C36 | C35 | H49 | 118.7° | 120.0° |
| C37 | C36 | C35 | O42 | 167.2° | 176.9° |
| C37 | C36 | O41 | H49 | 116.4° | 120.2° |
| C37 | C36 | C35 | H48 | 74.9° | 62.9° |
| C36 | C37 | C39 | H51 | 27.5° | 55.0° |
| C36 | C37 | C39 | H52 | 148.0° | 65.0° |
| C37 | C36 | O41 | H86 | 180.0° | 179.7° |
| C08 | C07 | C06 | H14 | 120.5° | 120.0° |
| C08 | C07 | C06 | H15 | 120.4° | 120.0° |
| C08 | C07 | C06 | C05 | 116.7° | NaN° |
| C08 | C07 | C06 | H12 | 3.9° | 60.0° |
| C08 | C07 | C06 | H13 | 122.7° | 60.0° |
| C08 | C07 | H14 | H15 | 118.6° | 120.0° |
| C07 | C08 | H16 | H17 | 118.9° | 119.9° |
| C07 | C08 | C09 | H18 | 47.3° | 60.0° |
| C07 | C08 | C09 | H19 | 66.1° | 60.0° |
| C36 | C35 | O42 | H48 | 117.8° | 120.2° |
| C35 | C36 | O41 | H49 | 118.0° | 120.1° |
| C36 | C35 | C34 | H47 | 66.0° | 63.0° |
| C35 | C36 | C37 | H50 | 78.5° | 62.4° |
| C35 | C36 | O41 | H86 | 54.4° | 60.0° |
| C36 | C35 | O42 | H87 | 55.2° | 179.6° |
| O42 | C35 | C36 | O41 | 44.5° | 56.9° |
| O42 | C35 | C34 | H47 | 56.5° | 56.9° |
| O42 | C35 | C36 | H49 | 74.1° | 63.2° |
| O41 | C36 | C35 | H48 | 162.3° | 177.2° |
| O41 | C36 | C37 | H50 | 158.2° | 177.7° |
| C07 | C06 | C05 | H12 | 120.6° | 120.0° |
| C07 | C06 | C05 | H13 | 120.6° | 120.0° |
| C07 | C06 | C05 | C04 | 84.7° | 180.0° |
| C07 | C06 | C05 | H10 | 35.8° | 60.0° |
| C07 | C06 | C05 | H11 | 154.8° | 60.0° |
| C07 | C06 | H12 | H13 | 118.3° | 120.0° |
| C06 | C07 | H14 | H15 | 118.6° | 120.0° |
| C06 | C07 | C08 | H16 | 174.6° | 60.0° |
| C06 | C07 | C08 | H17 | 66.1° | 60.0° |
| C06 | C05 | C04 | H10 | 120.5° | 120.0° |
| C06 | C05 | C04 | H11 | 120.5° | 120.0° |
| C06 | C05 | C04 | C03 | 87.1° | 180.0° |
| C06 | C05 | C04 | H8 | 33.5° | 59.9° |
| C06 | C05 | C04 | H9 | 152.3° | 60.0° |
| C06 | C05 | H10 | H11 | 118.5° | 120.0° |
| C05 | C06 | H12 | H13 | 118.3° | 119.9° |
| C05 | C06 | C07 | H14 | 122.8° | 60.0° |
| C05 | C06 | C07 | H15 | 3.7° | 60.0° |
| C05 | C04 | C03 | H8 | 120.6° | 120.0° |
| C05 | C04 | C03 | H9 | 120.6° | 119.9° |
| C05 | C04 | C03 | C02 | 137.2° | 180.0° |
| C05 | C04 | C03 | H6 | 102.3° | 59.9° |
| C05 | C04 | C03 | H7 | 16.7° | 60.0° |
| C05 | C04 | H8 | H9 | 118.1° | 119.9° |
| C04 | C05 | H10 | H11 | 118.5° | 119.9° |
| C04 | C05 | C06 | H12 | 154.7° | 59.9° |
| C04 | C05 | C06 | H13 | 35.8° | 60.0° |
| C04 | C03 | C02 | H6 | 120.5° | 120.0° |
| C04 | C03 | C02 | H7 | 120.5° | 120.0° |
| C04 | C03 | C02 | C01 | 146.1° | 180.0° |
| C04 | C03 | C02 | H4 | 93.4° | 60.0° |
| C04 | C03 | C02 | H5 | 25.6° | 60.1° |
| C04 | C03 | H6 | H7 | 118.5° | 120.0° |
| C03 | C04 | H8 | H9 | 118.1° | 120.0° |
| C03 | C04 | C05 | H10 | 152.5° | 59.9° |
| C03 | C04 | C05 | H11 | 33.4° | 60.0° |
| C03 | C02 | C01 | H4 | 120.5° | 120.0° |
| C03 | C02 | C01 | H5 | 120.5° | 119.9° |
| C03 | C02 | C01 | H1 | 180.0° | 60.0° |
| C03 | C02 | C01 | H2 | 60.0° | 60.0° |
| C03 | C02 | C01 | H3 | 60.0° | 180.0° |
| C03 | C02 | H4 | H5 | 118.4° | 119.9° |
| C02 | C03 | H6 | H7 | 118.5° | 120.0° |
| C02 | C03 | C04 | H8 | 16.6° | 60.0° |
| C02 | C03 | C04 | H9 | 102.2° | 60.0° |
| C02 | C01 | H1 | H2 | 120.0° | 120.0° |
| C02 | C01 | H1 | H3 | 120.0° | 120.1° |
| C02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | C02 | H4 | H5 | 118.4° | 120.1° |
| C01 | C02 | C03 | H6 | 25.6° | 60.0° |
| C01 | C02 | C03 | H7 | 93.4° | 60.0° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H1 | C01 | C02 | H4 | 59.5° | 60.0° |
| H1 | C01 | C02 | H5 | 59.5° | 179.9° |
| H2 | C01 | C02 | H4 | 179.5° | 179.9° |
| H2 | C01 | C02 | H5 | 60.5° | 59.9° |
| H3 | C01 | C02 | H4 | 60.5° | 60.1° |
| H3 | C01 | C02 | H5 | 179.5° | 60.0° |
| H4 | C02 | C03 | H6 | 146.2° | 180.0° |
| H4 | C02 | C03 | H7 | 27.1° | 60.1° |
| H5 | C02 | C03 | H6 | 94.9° | 60.0° |
| H5 | C02 | C03 | H7 | 146.1° | 179.9° |
| H6 | C03 | C04 | H8 | 137.1° | 180.0° |
| H6 | C03 | C04 | H9 | 18.3° | 60.0° |
| H7 | C03 | C04 | H8 | 103.9° | 60.0° |
| H7 | C03 | C04 | H9 | 137.3° | 179.9° |
| H8 | C04 | C05 | H10 | 86.9° | 180.0° |
| H8 | C04 | C05 | H11 | 154.0° | 60.1° |
| H9 | C04 | C05 | H10 | 31.8° | 60.0° |
| H9 | C04 | C05 | H11 | 87.2° | 180.0° |
| H10 | C05 | C06 | H12 | 84.8° | 180.0° |
| H10 | C05 | C06 | H13 | 156.3° | 60.1° |
| H11 | C05 | C06 | H12 | 34.2° | 60.1° |
| H11 | C05 | C06 | H13 | 84.6° | 180.0° |
| H12 | C06 | C07 | H14 | 116.6° | 180.0° |
| H12 | C06 | C07 | H15 | 124.3° | 60.1° |
| H13 | C06 | C07 | H14 | 2.3° | 60.0° |
| H13 | C06 | C07 | H15 | 116.8° | 180.0° |
| H14 | C07 | C08 | H16 | 54.2° | 180.0° |
| H14 | C07 | C08 | H17 | 173.4° | 60.1° |
| H15 | C07 | C08 | H16 | 64.9° | 60.1° |
| H15 | C07 | C08 | H17 | 54.3° | 180.0° |
| H16 | C08 | C09 | H18 | 167.7° | 180.0° |
| H16 | C08 | C09 | H19 | 54.3° | 60.1° |
| H17 | C08 | C09 | H18 | 73.1° | 60.0° |
| H17 | C08 | C09 | H19 | 173.5° | 180.0° |
| H18 | C09 | C10 | H20 | 153.5° | 180.0° |
| H18 | C09 | C10 | H21 | 34.2° | 60.0° |
| H19 | C09 | C10 | H20 | 93.2° | 60.0° |
| H19 | C09 | C10 | H21 | 147.5° | 179.9° |
| H20 | C10 | C11 | H22 | 157.5° | 180.0° |
| H20 | C10 | C11 | H23 | 38.1° | 60.1° |
| H21 | C10 | C11 | H22 | 83.3° | 60.0° |
| H21 | C10 | C11 | H23 | 157.4° | 180.0° |
| H22 | C11 | C12 | H24 | 166.7° | 180.0° |
| H22 | C11 | C12 | H25 | 74.4° | 60.0° |
| H23 | C11 | C12 | H24 | 47.4° | 60.0° |
| H23 | C11 | C12 | H25 | 166.2° | 180.0° |
| H24 | C12 | C13 | H26 | 101.5° | 180.0° |
| H24 | C12 | C13 | H27 | 17.5° | 60.0° |
| H25 | C12 | C13 | H26 | 139.7° | 60.0° |
| H25 | C12 | C13 | H27 | 101.4° | 180.0° |
| H26 | C13 | C14 | H28 | 60.8° | 180.0° |
| H26 | C13 | C14 | H29 | 58.3° | 60.0° |
| H27 | C13 | C14 | H28 | 58.1° | 60.0° |
| H27 | C13 | C14 | H29 | 177.2° | 180.0° |
| H28 | C14 | C15 | H30 | 151.4° | 180.0° |
| H28 | C14 | C15 | H31 | 89.8° | 60.0° |
| H29 | C14 | C15 | H30 | 89.5° | 60.0° |
| H29 | C14 | C15 | H31 | 29.3° | 180.0° |
| H30 | C15 | C16 | H32 | 175.4° | 180.0° |
| H30 | C15 | C16 | H33 | 56.1° | 60.0° |
| H31 | C15 | C16 | H32 | 65.8° | 60.0° |
| H31 | C15 | C16 | H33 | 174.9° | 180.0° |
| H32 | C16 | C17 | H34 | 124.5° | 180.0° |
| H32 | C16 | C17 | H35 | 117.1° | 60.0° |
| H33 | C16 | C17 | H34 | 116.3° | 60.0° |
| H33 | C16 | C17 | H35 | 2.2° | 180.0° |
| H36 | C21 | C22 | H37 | 126.3° | 55.6° |
| H36 | C21 | C22 | H38 | 6.2° | 64.4° |
| H36 | C21 | C86 | H53 | 143.1° | 179.1° |
| H36 | C21 | N20 | H83 | 65.0° | 145.0° |
| H39 | C24 | C25 | H40 | 151.2° | 177.7° |
| H40 | C25 | C26 | H41 | 166.1° | 177.2° |
| H40 | C25 | O85 | H90 | 63.6° | 60.1° |
| H41 | C26 | C27 | H42 | 169.8° | 177.2° |
| H41 | C26 | O84 | H89 | 64.1° | 60.2° |
| H42 | C27 | C28 | H43 | 170.6° | 177.7° |
| H43 | C28 | C30 | H44 | 156.6° | 65.0° |
| H43 | C28 | C30 | H45 | 83.0° | 175.0° |
| H44 | C30 | O31 | H84 | 60.2° | 60.0° |
| H45 | C30 | O31 | H84 | 60.2° | 60.1° |
| H46 | C33 | C34 | H47 | 177.7° | 177.7° |
| H47 | C34 | C35 | H48 | 174.0° | 177.1° |
| H47 | C34 | O83 | H88 | 60.1° | 60.2° |
| H48 | C35 | C36 | H49 | 43.8° | 57.1° |
| H48 | C35 | O42 | H87 | 62.6° | 60.2° |
| H49 | C36 | C37 | H50 | 40.6° | 57.6° |
| H49 | C36 | O41 | H86 | 63.6° | 60.1° |
| H50 | C37 | C39 | H51 | 90.9° | 65.0° |
| H50 | C37 | C39 | H52 | 29.6° | 174.9° |
| H51 | C39 | O40 | H85 | 60.2° | 60.0° |
| H52 | C39 | O40 | H85 | 60.3° | 60.0° |
| H53 | C86 | C87 | H54 | 76.6° | 65.0° |
| H53 | C86 | OA2 | H91 | 63.9° | 174.1° |
| H54 | C87 | C88 | H55 | 180.0° | 180.0° |
| H55 | C88 | C89 | H56 | 39.9° | 65.0° |
| H55 | C88 | C89 | H57 | 159.3° | 175.0° |
| H56 | C89 | C90 | H58 | 155.7° | 180.0° |
| H56 | C89 | C90 | H59 | 35.3° | 60.0° |
| H57 | C89 | C90 | H58 | 84.9° | 60.1° |
| H57 | C89 | C90 | H59 | 154.7° | 180.0° |
| H58 | C90 | C91 | H60 | 149.4° | 180.0° |
| H58 | C90 | C91 | H61 | 28.8° | 60.0° |
| H59 | C90 | C91 | H60 | 28.9° | 60.0° |
| H59 | C90 | C91 | H61 | 91.6° | 179.9° |
| H60 | C91 | C92 | H62 | 150.1° | 180.0° |
| H60 | C91 | C92 | H63 | 90.8° | 60.0° |
| H61 | C91 | C92 | H62 | 29.5° | 60.0° |
| H61 | C91 | C92 | H63 | 148.7° | 180.0° |
| H62 | C92 | C93 | H64 | 177.0° | 180.0° |
| H62 | C92 | C93 | H65 | 63.4° | 60.1° |
| H63 | C92 | C93 | H64 | 58.0° | 60.0° |
| H63 | C92 | C93 | H65 | 177.5° | 180.0° |
| H64 | C93 | C94 | H66 | 16.1° | 180.0° |
| H64 | C93 | C94 | H67 | 103.5° | 60.0° |
| H65 | C93 | C94 | H66 | 135.6° | 60.0° |
| H65 | C93 | C94 | H67 | 16.1° | 180.0° |
| H66 | C94 | C95 | H68 | 151.2° | 180.0° |
| H66 | C94 | C95 | H69 | 31.6° | 60.0° |
| H67 | C94 | C95 | H68 | 89.2° | 60.0° |
| H67 | C94 | C95 | H69 | 151.2° | 180.0° |
| H68 | C95 | C96 | H70 | 16.6° | 180.0° |
| H68 | C95 | C96 | H71 | 103.5° | 60.0° |
| H69 | C95 | C96 | H70 | 136.2° | 59.9° |
| H69 | C95 | C96 | H71 | 16.1° | 180.0° |
| H70 | C96 | C97 | H72 | 117.5° | 179.9° |
| H70 | C96 | C97 | H73 | 123.3° | 60.0° |
| H71 | C96 | C97 | H72 | 122.4° | 60.0° |
| H71 | C96 | C97 | H73 | 3.2° | 180.0° |
| H72 | C97 | C98 | H74 | 89.3° | 179.9° |
| H72 | C97 | C98 | H75 | 30.2° | 60.0° |
| H73 | C97 | C98 | H74 | 29.8° | 60.0° |
| H73 | C97 | C98 | H75 | 149.4° | 180.0° |
| H74 | C98 | C99 | H76 | 26.0° | 179.9° |
| H74 | C98 | C99 | H77 | 146.1° | 60.1° |
| H75 | C98 | C99 | H76 | 145.5° | 60.0° |
| H75 | C98 | C99 | H77 | 94.4° | NaN° |
| H76 | C99 | CA0 | H78 | 11.9° | 180.0° |
| H76 | C99 | CA0 | H79 | 108.1° | 60.0° |
| H77 | C99 | CA0 | H78 | 131.9° | 60.0° |
| H77 | C99 | CA0 | H79 | 12.0° | 180.0° |
| H78 | CA0 | CA1 | H80 | 60.0° | 60.1° |
| H78 | CA0 | CA1 | H81 | 60.0° | 180.0° |
| H78 | CA0 | CA1 | H82 | 179.9° | 59.9° |
| H79 | CA0 | CA1 | H80 | 59.9° | 60.0° |
| H79 | CA0 | CA1 | H81 | 179.9° | 60.0° |
| H79 | CA0 | CA1 | H82 | 60.1° | 180.0° |
| H80 | CA1 | H81 | H82 | 120.0° | 120.0° |
