XP2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O47 | C39 | doub | 1.21Å | 1.17Å | |
| O75 | C74 | sing | 1.43Å | 1.43Å | |
| C39 | C40 | sing | 1.51Å | 1.57Å | |
| C39 | O38 | sing | 1.34Å | 1.45Å | |
| C41 | C42 | sing | 1.53Å | 1.59Å | |
| C41 | C40 | sing | 1.53Å | 1.54Å | |
| C42 | C43 | sing | 1.53Å | 1.59Å | |
| O62 | P34 | doub | 1.48Å | 1.50Å | |
| O38 | C37 | sing | 1.45Å | 1.39Å | |
| C74 | C73 | sing | 1.53Å | 1.48Å | |
| O68 | C67 | sing | 1.43Å | 1.41Å | |
| C37 | C36 | sing | 1.53Å | 1.54Å | |
| C37 | C48 | sing | 1.53Å | 1.53Å | |
| C36 | O35 | sing | 1.43Å | 1.44Å | |
| O65 | C66 | sing | 1.43Å | 1.43Å | |
| O65 | C64 | sing | 1.43Å | 1.41Å | |
| C66 | C67 | sing | 1.53Å | 1.54Å | |
| C66 | O76 | sing | 1.43Å | 1.45Å | |
| O01 | C02 | sing | 1.43Å | 1.41Å | |
| O35 | P34 | sing | 1.61Å | 1.68Å | |
| C43 | C44 | sing | 1.53Å | 1.57Å | |
| C67 | C69 | sing | 1.53Å | 1.51Å | |
| O76 | C73 | sing | 1.43Å | 1.50Å | |
| P34 | O63 | sing | 1.61Å | 1.49Å | |
| P34 | O33 | sing | 1.61Å | 1.69Å | |
| C44 | C45 | sing | 1.53Å | 1.55Å | |
| O04 | C03 | sing | 1.43Å | 1.41Å | |
| C73 | C71 | sing | 1.53Å | 1.52Å | |
| C64 | C02 | sing | 1.53Å | 1.52Å | |
| C64 | C32 | sing | 1.53Å | 1.55Å | |
| C02 | C03 | sing | 1.53Å | 1.55Å | |
| C48 | O49 | sing | 1.45Å | 1.44Å | |
| C03 | C05 | sing | 1.53Å | 1.55Å | |
| C32 | O33 | sing | 1.43Å | 1.43Å | |
| C32 | C07 | sing | 1.53Å | 1.53Å | |
| O06 | C05 | sing | 1.43Å | 1.41Å | |
| C71 | C69 | sing | 1.53Å | 1.46Å | |
| C71 | O72 | sing | 1.43Å | 1.44Å | |
| C69 | O70 | sing | 1.43Å | 1.47Å | |
| O49 | C50 | sing | 1.34Å | 1.44Å | |
| C45 | C46 | sing | 1.53Å | 1.54Å | |
| C05 | C07 | sing | 1.53Å | 1.51Å | |
| C07 | O08 | sing | 1.43Å | 1.47Å | |
| C51 | C50 | sing | 1.51Å | 1.55Å | |
| C51 | C52 | sing | 1.53Å | 1.55Å | |
| C50 | O61 | doub | 1.21Å | 1.18Å | |
| O08 | C09 | sing | 1.43Å | 1.34Å | |
| C53 | C52 | sing | 1.53Å | 1.57Å | |
| C53 | C54 | sing | 1.53Å | 1.56Å | |
| O10 | C09 | sing | 1.43Å | 1.52Å | |
| O10 | C11 | sing | 1.43Å | 1.47Å | |
| C09 | C30 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C11 | C26 | sing | 1.53Å | 1.55Å | |
| C54 | C55 | sing | 1.53Å | 1.55Å | |
| C12 | O13 | sing | 1.45Å | 1.46Å | |
| C30 | O31 | sing | 1.43Å | 1.44Å | |
| C30 | C28 | sing | 1.53Å | 1.48Å | |
| O27 | C26 | sing | 1.43Å | 1.43Å | |
| C55 | C56 | sing | 1.53Å | 1.53Å | |
| O13 | C14 | sing | 1.34Å | 1.44Å | |
| C26 | C28 | sing | 1.53Å | 1.50Å | |
| C57 | C56 | sing | 1.53Å | 1.57Å | |
| C57 | C58 | sing | 1.53Å | 1.54Å | |
| C28 | O29 | sing | 1.43Å | 1.46Å | |
| C14 | C15 | sing | 1.51Å | 1.54Å | |
| C14 | O25 | doub | 1.21Å | 1.20Å | |
| C15 | C16 | sing | 1.53Å | 1.55Å | |
| C59 | C58 | sing | 1.53Å | 1.60Å | |
| C59 | C60 | sing | 1.53Å | 1.57Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| C19 | C18 | sing | 1.53Å | 1.56Å | |
| C19 | C20 | sing | 1.53Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.59Å | |
| C22 | C21 | sing | 1.53Å | 1.56Å | |
| C22 | C23 | sing | 1.53Å | 1.57Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C02 | H1 | sing | 1.09Å | 1.10Å | |
| C03 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| C07 | H4 | sing | 1.09Å | 1.10Å | |
| C09 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.09Å | 1.10Å | |
| C24 | H28 | sing | 1.09Å | 1.10Å | |
| C24 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| C30 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H33 | sing | 1.09Å | 1.10Å | |
| C36 | H34 | sing | 1.09Å | 1.10Å | |
| C36 | H35 | sing | 1.09Å | 1.10Å | |
| C37 | H36 | sing | 1.09Å | 1.10Å | |
| C40 | H37 | sing | 1.09Å | 1.10Å | |
| C40 | H38 | sing | 1.09Å | 1.10Å | |
| C41 | H39 | sing | 1.09Å | 1.10Å | |
| C41 | H40 | sing | 1.09Å | 1.10Å | |
| C42 | H41 | sing | 1.09Å | 1.10Å | |
| C42 | H42 | sing | 1.09Å | 1.10Å | |
| C43 | H43 | sing | 1.09Å | 1.10Å | |
| C43 | H44 | sing | 1.09Å | 1.10Å | |
| C44 | H45 | sing | 1.09Å | 1.10Å | |
| C44 | H46 | sing | 1.09Å | 1.10Å | |
| C45 | H47 | sing | 1.09Å | 1.10Å | |
| C45 | H48 | sing | 1.09Å | 1.10Å | |
| C46 | H49 | sing | 1.09Å | 1.10Å | |
| C46 | H50 | sing | 1.09Å | 1.10Å | |
| C46 | H51 | sing | 1.09Å | 1.10Å | |
| C48 | H52 | sing | 1.09Å | 1.10Å | |
| C48 | H53 | sing | 1.09Å | 1.10Å | |
| C51 | H54 | sing | 1.09Å | 1.10Å | |
| C51 | H55 | sing | 1.09Å | 1.10Å | |
| C52 | H56 | sing | 1.09Å | 1.10Å | |
| C52 | H57 | sing | 1.09Å | 1.10Å | |
| C53 | H58 | sing | 1.09Å | 1.10Å | |
| C53 | H59 | sing | 1.09Å | 1.10Å | |
| C54 | H60 | sing | 1.09Å | 1.10Å | |
| C54 | H61 | sing | 1.09Å | 1.10Å | |
| C55 | H62 | sing | 1.09Å | 1.10Å | |
| C55 | H63 | sing | 1.09Å | 1.10Å | |
| C56 | H64 | sing | 1.09Å | 1.10Å | |
| C56 | H65 | sing | 1.09Å | 1.10Å | |
| C57 | H66 | sing | 1.09Å | 1.10Å | |
| C57 | H67 | sing | 1.09Å | 1.10Å | |
| C58 | H68 | sing | 1.09Å | 1.10Å | |
| C58 | H69 | sing | 1.09Å | 1.10Å | |
| C59 | H70 | sing | 1.09Å | 1.10Å | |
| C59 | H71 | sing | 1.09Å | 1.10Å | |
| C60 | H72 | sing | 1.09Å | 1.10Å | |
| C60 | H73 | sing | 1.09Å | 1.10Å | |
| C60 | H74 | sing | 1.09Å | 1.10Å | |
| C64 | H75 | sing | 1.09Å | 1.10Å | |
| C66 | H76 | sing | 1.09Å | 1.10Å | |
| C67 | H77 | sing | 1.09Å | 1.10Å | |
| C69 | H78 | sing | 1.09Å | 1.10Å | |
| C71 | H79 | sing | 1.09Å | 1.10Å | |
| C73 | H80 | sing | 1.09Å | 1.10Å | |
| C74 | H81 | sing | 1.09Å | 1.10Å | |
| C74 | H82 | sing | 1.09Å | 1.10Å | |
| O01 | H83 | sing | 0.97Å | 0.95Å | |
| O04 | H84 | sing | 0.97Å | 0.95Å | |
| O06 | H85 | sing | 0.97Å | 0.95Å | |
| O27 | H86 | sing | 0.97Å | 0.95Å | |
| O29 | H87 | sing | 0.97Å | 0.95Å | |
| O31 | H88 | sing | 0.97Å | 0.95Å | |
| O63 | H89 | sing | 0.97Å | 0.95Å | |
| O68 | H90 | sing | 0.97Å | 0.95Å | |
| O70 | H91 | sing | 0.97Å | 0.95Å | |
| O72 | H92 | sing | 0.97Å | 0.95Å | |
| O75 | H93 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O47 | C39 | C40 | 119.3° | 120.0° |
| O47 | C39 | O38 | 119.9° | 120.0° |
| O75 | C74 | C73 | 108.3° | 109.5° |
| O75 | C74 | H81 | 109.8° | 109.5° |
| O75 | C74 | H82 | 109.7° | 109.5° |
| C74 | O75 | H93 | 109.5° | 114.0° |
| C40 | C39 | O38 | 120.8° | 120.0° |
| C39 | C40 | C41 | 111.2° | 109.5° |
| C39 | C40 | H37 | 109.0° | 109.5° |
| C39 | C40 | H38 | 109.0° | 109.5° |
| C39 | O38 | C37 | 113.5° | 117.0° |
| C42 | C41 | C40 | 113.6° | 109.5° |
| C41 | C42 | C43 | 113.3° | 109.4° |
| C42 | C41 | H39 | 108.5° | 109.5° |
| C42 | C41 | H40 | 108.4° | 109.5° |
| C41 | C42 | H41 | 108.5° | 109.5° |
| C41 | C42 | H42 | 108.5° | 109.5° |
| C41 | C40 | H37 | 109.0° | 109.5° |
| C41 | C40 | H38 | 109.0° | 109.4° |
| C40 | C41 | H39 | 108.4° | 109.5° |
| C40 | C41 | H40 | 108.4° | 109.4° |
| C42 | C43 | C44 | 112.2° | 109.4° |
| C43 | C42 | H41 | 108.5° | 109.5° |
| C43 | C42 | H42 | 108.5° | 109.5° |
| C42 | C43 | H43 | 108.8° | 109.4° |
| C42 | C43 | H44 | 108.8° | 109.5° |
| O62 | P34 | O35 | 109.3° | 109.5° |
| O62 | P34 | O63 | 109.7° | 109.5° |
| O62 | P34 | O33 | 109.7° | 109.5° |
| O38 | C37 | C36 | 110.1° | 109.5° |
| O38 | C37 | C48 | 108.2° | 109.4° |
| O38 | C37 | H36 | 110.7° | 109.5° |
| C74 | C73 | O76 | 109.9° | 109.5° |
| C74 | C73 | C71 | 109.4° | 109.5° |
| C74 | C73 | H80 | 109.7° | 109.5° |
| C73 | C74 | H81 | 109.8° | 109.4° |
| C73 | C74 | H82 | 109.8° | 109.4° |
| O68 | C67 | C66 | 107.9° | 109.5° |
| O68 | C67 | C69 | 107.8° | 109.5° |
| O68 | C67 | H77 | 109.6° | 109.5° |
| C67 | O68 | H90 | 109.5° | 114.0° |
| C36 | C37 | C48 | 110.7° | 109.5° |
| C37 | C36 | O35 | 108.3° | 109.5° |
| C37 | C36 | H34 | 109.8° | 109.5° |
| C37 | C36 | H35 | 109.8° | 109.5° |
| C36 | C37 | H36 | 108.5° | 109.5° |
| C37 | C48 | O49 | 107.8° | 109.5° |
| C48 | C37 | H36 | 108.7° | 109.5° |
| C37 | C48 | H52 | 109.9° | 109.5° |
| C37 | C48 | H53 | 109.9° | 109.5° |
| C36 | O35 | P34 | 119.0° | 123.0° |
| O35 | C36 | H34 | 109.8° | 109.4° |
| O35 | C36 | H35 | 109.8° | 109.5° |
| C66 | O65 | C64 | 113.6° | 114.0° |
| O65 | C66 | C67 | 110.5° | 109.5° |
| O65 | C66 | O76 | 108.8° | 109.4° |
| O65 | C66 | H76 | 108.2° | 109.5° |
| O65 | C64 | C02 | 107.3° | 109.4° |
| O65 | C64 | C32 | 110.6° | 109.4° |
| O65 | C64 | H75 | 110.0° | 109.4° |
| C67 | C66 | O76 | 114.5° | 109.4° |
| C66 | C67 | C69 | 115.0° | 109.2° |
| C67 | C66 | H76 | 106.8° | 109.5° |
| C66 | C67 | H77 | 108.0° | 109.5° |
| C66 | O76 | C73 | 112.5° | 114.1° |
| O76 | C66 | H76 | 107.9° | 109.5° |
| O01 | C02 | C64 | 108.5° | 109.5° |
| O01 | C02 | C03 | 108.7° | 109.5° |
| O01 | C02 | H1 | 110.1° | 109.5° |
| C02 | O01 | H83 | 109.5° | 113.9° |
| O35 | P34 | O63 | 109.2° | 109.5° |
| O35 | P34 | O33 | 109.2° | 109.5° |
| C43 | C44 | C45 | 112.3° | 109.5° |
| C44 | C43 | H43 | 108.8° | 109.5° |
| C44 | C43 | H44 | 108.7° | 109.5° |
| C43 | C44 | H45 | 108.8° | 109.5° |
| C43 | C44 | H46 | 108.8° | 109.4° |
| C67 | C69 | C71 | 112.1° | 109.0° |
| C67 | C69 | O70 | 108.9° | 109.5° |
| C69 | C67 | H77 | 108.4° | 109.5° |
| C67 | C69 | H78 | 108.8° | 109.5° |
| O76 | C73 | C71 | 109.3° | 109.4° |
| O76 | C73 | H80 | 109.3° | 109.4° |
| O63 | P34 | O33 | 109.7° | 109.4° |
| P34 | O63 | H89 | 109.5° | 114.0° |
| P34 | O33 | C32 | 118.3° | 123.0° |
| C44 | C45 | C46 | 112.5° | 109.5° |
| C45 | C44 | H45 | 108.8° | 109.5° |
| C45 | C44 | H46 | 108.8° | 109.5° |
| C44 | C45 | H47 | 108.7° | 109.5° |
| C44 | C45 | H48 | 108.7° | 109.5° |
| O04 | C03 | C02 | 118.8° | 109.5° |
| O04 | C03 | C05 | 118.6° | 109.5° |
| O04 | C03 | H2 | 94.7° | 109.5° |
| C03 | O04 | H84 | 109.5° | 114.0° |
| C73 | C71 | C69 | 119.8° | 109.2° |
| C73 | C71 | O72 | 119.6° | 109.5° |
| C73 | C71 | H79 | 93.5° | 109.6° |
| C71 | C73 | H80 | 109.1° | 109.6° |
| C02 | C64 | C32 | 112.0° | 109.5° |
| C64 | C02 | C03 | 112.7° | 109.4° |
| C64 | C02 | H1 | 108.6° | 109.4° |
| C02 | C64 | H75 | 108.6° | 109.5° |
| C64 | C32 | O33 | 110.3° | 109.5° |
| C64 | C32 | C07 | 109.7° | 109.5° |
| C64 | C32 | H33 | 108.7° | 109.4° |
| C32 | C64 | H75 | 108.2° | 109.5° |
| C02 | C03 | C05 | 120.8° | 109.5° |
| C03 | C02 | H1 | 108.2° | 109.5° |
| C02 | C03 | H2 | 94.3° | 109.4° |
| C48 | O49 | C50 | 113.8° | 117.0° |
| O49 | C48 | H52 | 109.9° | 109.4° |
| O49 | C48 | H53 | 109.9° | 109.5° |
| C03 | C05 | O06 | 109.2° | 109.5° |
| C03 | C05 | C07 | 109.3° | 109.5° |
| C05 | C03 | H2 | 94.3° | 109.5° |
| C03 | C05 | H3 | 108.7° | 109.5° |
| O33 | C32 | C07 | 108.8° | 109.5° |
| O33 | C32 | H33 | 110.4° | 109.5° |
| C32 | C07 | C05 | 109.6° | 109.5° |
| C32 | C07 | O08 | 110.3° | 109.4° |
| C32 | C07 | H4 | 108.5° | 109.4° |
| C07 | C32 | H33 | 108.9° | 109.4° |
| O06 | C05 | C07 | 109.6° | 109.5° |
| O06 | C05 | H3 | 110.7° | 109.5° |
| C05 | O06 | H85 | 109.5° | 114.0° |
| C69 | C71 | O72 | 119.4° | 109.5° |
| C71 | C69 | O70 | 108.3° | 109.5° |
| C71 | C69 | H78 | 109.4° | 109.6° |
| C69 | C71 | H79 | 93.6° | 109.5° |
| O72 | C71 | H79 | 93.7° | 109.5° |
| C71 | O72 | H92 | 109.5° | 114.0° |
| O70 | C69 | H78 | 109.3° | 109.6° |
| C69 | O70 | H91 | 109.5° | 114.0° |
| O49 | C50 | C51 | 120.3° | 120.0° |
| O49 | C50 | O61 | 119.8° | 120.0° |
| C46 | C45 | H47 | 108.7° | 109.5° |
| C46 | C45 | H48 | 108.7° | 109.5° |
| C45 | C46 | H49 | 109.5° | 109.5° |
| C45 | C46 | H50 | 109.4° | 109.5° |
| C45 | C46 | H51 | 109.5° | 109.5° |
| C05 | C07 | O08 | 110.5° | 109.5° |
| C07 | C05 | H3 | 109.2° | 109.4° |
| C05 | C07 | H4 | 108.7° | 109.5° |
| C07 | O08 | C09 | 109.5° | 114.0° |
| O08 | C07 | H4 | 109.2° | 109.5° |
| C50 | C51 | C52 | 112.1° | 109.5° |
| C51 | C50 | O61 | 120.0° | 120.0° |
| C50 | C51 | H54 | 108.8° | 109.5° |
| C50 | C51 | H55 | 108.8° | 109.5° |
| C51 | C52 | C53 | 112.0° | 109.5° |
| C52 | C51 | H54 | 108.8° | 109.4° |
| C52 | C51 | H55 | 108.8° | 109.4° |
| C51 | C52 | H56 | 108.9° | 109.5° |
| C51 | C52 | H57 | 108.8° | 109.4° |
| O08 | C09 | O10 | 119.1° | 109.5° |
| O08 | C09 | C30 | 119.8° | 109.4° |
| O08 | C09 | H5 | 93.0° | 109.4° |
| C52 | C53 | C54 | 112.8° | 109.5° |
| C53 | C52 | H56 | 108.8° | 109.5° |
| C53 | C52 | H57 | 108.9° | 109.5° |
| C52 | C53 | H58 | 108.6° | 109.5° |
| C52 | C53 | H59 | 108.7° | 109.5° |
| C53 | C54 | C55 | 112.6° | 109.4° |
| C54 | C53 | H58 | 108.7° | 109.5° |
| C54 | C53 | H59 | 108.6° | 109.5° |
| C53 | C54 | H60 | 108.7° | 109.5° |
| C53 | C54 | H61 | 108.7° | 109.5° |
| C09 | O10 | C11 | 112.9° | 114.1° |
| O10 | C09 | C30 | 120.5° | 109.5° |
| O10 | C09 | H5 | 92.6° | 109.5° |
| O10 | C11 | C12 | 107.8° | 109.5° |
| O10 | C11 | C26 | 114.2° | 109.4° |
| O10 | C11 | H6 | 109.1° | 109.5° |
| C09 | C30 | O31 | 109.6° | 109.5° |
| C09 | C30 | C28 | 108.9° | 109.1° |
| C30 | C09 | H5 | 92.6° | 109.5° |
| C09 | C30 | H32 | 108.8° | 109.5° |
| C12 | C11 | C26 | 108.9° | 109.5° |
| C11 | C12 | O13 | 107.5° | 109.4° |
| C12 | C11 | H6 | 108.6° | 109.5° |
| C11 | C12 | H7 | 110.0° | 109.5° |
| C11 | C12 | H8 | 109.9° | 109.5° |
| C11 | C26 | O27 | 108.8° | 109.5° |
| C11 | C26 | C28 | 113.3° | 109.2° |
| C26 | C11 | H6 | 108.2° | 109.4° |
| C11 | C26 | H30 | 108.1° | 109.5° |
| C54 | C55 | C56 | 112.9° | 109.5° |
| C55 | C54 | H60 | 108.7° | 109.5° |
| C55 | C54 | H61 | 108.7° | 109.5° |
| C54 | C55 | H62 | 108.6° | 109.5° |
| C54 | C55 | H63 | 108.6° | 109.5° |
| C12 | O13 | C14 | 115.7° | 116.9° |
| O13 | C12 | H7 | 110.0° | 109.5° |
| O13 | C12 | H8 | 110.0° | 109.5° |
| O31 | C30 | C28 | 110.0° | 109.5° |
| O31 | C30 | H32 | 110.0° | 109.6° |
| C30 | O31 | H88 | 109.5° | 114.0° |
| C30 | C28 | C26 | 110.7° | 109.1° |
| C30 | C28 | O29 | 109.0° | 109.5° |
| C30 | C28 | H31 | 109.5° | 109.6° |
| C28 | C30 | H32 | 109.4° | 109.6° |
| O27 | C26 | C28 | 108.2° | 109.5° |
| O27 | C26 | H30 | 109.6° | 109.5° |
| C26 | O27 | H86 | 109.5° | 114.0° |
| C55 | C56 | C57 | 112.1° | 109.5° |
| C56 | C55 | H62 | 108.6° | 109.4° |
| C56 | C55 | H63 | 108.6° | 109.4° |
| C55 | C56 | H64 | 108.8° | 109.5° |
| C55 | C56 | H65 | 108.8° | 109.4° |
| O13 | C14 | C15 | 120.9° | 120.0° |
| O13 | C14 | O25 | 118.9° | 120.0° |
| C26 | C28 | O29 | 108.5° | 109.6° |
| C28 | C26 | H30 | 108.8° | 109.6° |
| C26 | C28 | H31 | 109.3° | 109.6° |
| C56 | C57 | C58 | 111.7° | 109.5° |
| C57 | C56 | H64 | 108.8° | 109.5° |
| C57 | C56 | H65 | 108.8° | 109.5° |
| C56 | C57 | H66 | 108.9° | 109.4° |
| C56 | C57 | H67 | 108.9° | 109.5° |
| C57 | C58 | C59 | 113.0° | 109.5° |
| C58 | C57 | H66 | 108.9° | 109.4° |
| C58 | C57 | H67 | 108.9° | 109.5° |
| C57 | C58 | H68 | 108.6° | 109.4° |
| C57 | C58 | H69 | 108.6° | 109.5° |
| O29 | C28 | H31 | 109.8° | 109.5° |
| C28 | O29 | H87 | 109.5° | 114.0° |
| C15 | C14 | O25 | 120.2° | 120.0° |
| C14 | C15 | C16 | 113.0° | 109.5° |
| C14 | C15 | H9 | 108.6° | 109.5° |
| C14 | C15 | H10 | 108.6° | 109.5° |
| C15 | C16 | C17 | 112.9° | 109.5° |
| C16 | C15 | H9 | 108.6° | 109.5° |
| C16 | C15 | H10 | 108.6° | 109.4° |
| C15 | C16 | H11 | 108.6° | 109.5° |
| C15 | C16 | H12 | 108.6° | 109.5° |
| C58 | C59 | C60 | 111.6° | 109.4° |
| C59 | C58 | H68 | 108.6° | 109.4° |
| C59 | C58 | H69 | 108.6° | 109.5° |
| C58 | C59 | H70 | 108.9° | 109.4° |
| C58 | C59 | H71 | 108.9° | 109.5° |
| C60 | C59 | H70 | 108.9° | 109.5° |
| C60 | C59 | H71 | 108.9° | 109.5° |
| C59 | C60 | H72 | 109.5° | 109.4° |
| C59 | C60 | H73 | 109.5° | 109.5° |
| C59 | C60 | H74 | 109.5° | 109.4° |
| C16 | C17 | C18 | 112.9° | 109.5° |
| C17 | C16 | H11 | 108.6° | 109.4° |
| C17 | C16 | H12 | 108.6° | 109.5° |
| C16 | C17 | H13 | 108.6° | 109.4° |
| C16 | C17 | H14 | 108.6° | 109.5° |
| C17 | C18 | C19 | 113.5° | 109.5° |
| C18 | C17 | H13 | 108.6° | 109.5° |
| C18 | C17 | H14 | 108.6° | 109.5° |
| C17 | C18 | H15 | 108.5° | 109.4° |
| C17 | C18 | H16 | 108.5° | 109.5° |
| C18 | C19 | C20 | 111.2° | 109.5° |
| C19 | C18 | H15 | 108.4° | 109.5° |
| C19 | C18 | H16 | 108.4° | 109.5° |
| C18 | C19 | H17 | 109.1° | 109.5° |
| C18 | C19 | H18 | 109.1° | 109.5° |
| C19 | C20 | C21 | 112.9° | 109.5° |
| C20 | C19 | H17 | 109.0° | 109.4° |
| C20 | C19 | H18 | 109.0° | 109.5° |
| C19 | C20 | H19 | 108.6° | 109.4° |
| C19 | C20 | H20 | 108.6° | 109.5° |
| C20 | C21 | C22 | 112.6° | 109.5° |
| C21 | C20 | H19 | 108.6° | 109.5° |
| C21 | C20 | H20 | 108.6° | 109.5° |
| C20 | C21 | H21 | 108.7° | 109.5° |
| C20 | C21 | H22 | 108.7° | 109.5° |
| C21 | C22 | C23 | 113.5° | 109.4° |
| C22 | C21 | H21 | 108.7° | 109.4° |
| C22 | C21 | H22 | 108.7° | 109.5° |
| C21 | C22 | H23 | 108.5° | 109.4° |
| C21 | C22 | H24 | 108.4° | 109.4° |
| C22 | C23 | C24 | 112.4° | 109.4° |
| C23 | C22 | H23 | 108.5° | 109.5° |
| C23 | C22 | H24 | 108.5° | 109.5° |
| C22 | C23 | H25 | 108.7° | 109.5° |
| C22 | C23 | H26 | 108.7° | 109.4° |
| C24 | C23 | H25 | 108.7° | 109.5° |
| C24 | C23 | H26 | 108.7° | 109.5° |
| C23 | C24 | H27 | 109.5° | 109.4° |
| C23 | C24 | H28 | 109.5° | 109.5° |
| C23 | C24 | H29 | 109.5° | 109.5° |
| H7 | C12 | H8 | 109.5° | 109.5° |
| H9 | C15 | H10 | 109.5° | 109.5° |
| H11 | C16 | H12 | 109.5° | 109.4° |
| H13 | C17 | H14 | 109.5° | 109.4° |
| H15 | C18 | H16 | 109.5° | 109.5° |
| H17 | C19 | H18 | 109.5° | 109.5° |
| H19 | C20 | H20 | 109.4° | 109.5° |
| H21 | C21 | H22 | 109.5° | 109.5° |
| H23 | C22 | H24 | 109.5° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.5° |
| H27 | C24 | H28 | 109.5° | 109.5° |
| H27 | C24 | H29 | 109.5° | 109.5° |
| H28 | C24 | H29 | 109.5° | 109.5° |
| H34 | C36 | H35 | 109.5° | 109.5° |
| H37 | C40 | H38 | 109.5° | 109.5° |
| H39 | C41 | H40 | 109.4° | 109.5° |
| H41 | C42 | H42 | 109.5° | 109.5° |
| H43 | C43 | H44 | 109.5° | 109.6° |
| H45 | C44 | H46 | 109.5° | 109.5° |
| H47 | C45 | H48 | 109.5° | 109.5° |
| H49 | C46 | H50 | 109.5° | 109.5° |
| H49 | C46 | H51 | 109.5° | 109.5° |
| H50 | C46 | H51 | 109.5° | 109.5° |
| H52 | C48 | H53 | 109.5° | 109.4° |
| H54 | C51 | H55 | 109.5° | 109.5° |
| H56 | C52 | H57 | 109.5° | 109.4° |
| H58 | C53 | H59 | 109.5° | 109.4° |
| H60 | C54 | H61 | 109.5° | 109.5° |
| H62 | C55 | H63 | 109.5° | 109.5° |
| H64 | C56 | H65 | 109.5° | 109.4° |
| H66 | C57 | H67 | 109.5° | 109.5° |
| H68 | C58 | H69 | 109.5° | 109.5° |
| H70 | C59 | H71 | 109.5° | 109.5° |
| H72 | C60 | H73 | 109.5° | 109.5° |
| H72 | C60 | H74 | 109.5° | 109.5° |
| H73 | C60 | H74 | 109.5° | 109.5° |
| H81 | C74 | H82 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O47 | C39 | C40 | O38 | 179.5° | 179.9° |
| O47 | C39 | C40 | C41 | 17.4° | 0.1° |
| O47 | C39 | O38 | C37 | 44.7° | 0.1° |
| O47 | C39 | C40 | H37 | 137.7° | 120.0° |
| O47 | C39 | C40 | H38 | 102.8° | 120.0° |
| O75 | C74 | C73 | H81 | 119.8° | 120.0° |
| O75 | C74 | C73 | H82 | 119.8° | 120.0° |
| O75 | C74 | C73 | O76 | 32.1° | 65.1° |
| O75 | C74 | C73 | C71 | 152.2° | 175.0° |
| O75 | C74 | C73 | H80 | 88.1° | 54.9° |
| O75 | C74 | H81 | H82 | 120.5° | 120.1° |
| C39 | C40 | C41 | C42 | 165.0° | 180.0° |
| C39 | C40 | C41 | H37 | 120.2° | 120.0° |
| C39 | C40 | C41 | H38 | 120.2° | 120.0° |
| C40 | C39 | O38 | C37 | 135.7° | 180.0° |
| C39 | C40 | H37 | H38 | 119.2° | 120.0° |
| C39 | C40 | C41 | H39 | 74.4° | 60.0° |
| C39 | C40 | C41 | H40 | 44.4° | 60.0° |
| O38 | C39 | C40 | C41 | 163.0° | 180.0° |
| C39 | O38 | C37 | C36 | 156.1° | 150.0° |
| C39 | O38 | C37 | C48 | 82.8° | 90.0° |
| C39 | O38 | C37 | H36 | 36.1° | 30.0° |
| O38 | C39 | C40 | H37 | 42.8° | 60.0° |
| O38 | C39 | C40 | H38 | 76.7° | 60.0° |
| C42 | C41 | C40 | H39 | 120.6° | 120.0° |
| C42 | C41 | C40 | H40 | 120.6° | 120.0° |
| C41 | C42 | C43 | H41 | 120.6° | 120.0° |
| C41 | C42 | C43 | H42 | 120.6° | 120.0° |
| C41 | C42 | C43 | C44 | 154.2° | 180.0° |
| C42 | C41 | C40 | H37 | 74.8° | 60.0° |
| C42 | C41 | C40 | H38 | 44.7° | 60.0° |
| C42 | C41 | H39 | H40 | 118.1° | 120.0° |
| C41 | C42 | H41 | H42 | 118.2° | 120.0° |
| C41 | C42 | C43 | H43 | 33.8° | 60.1° |
| C41 | C42 | C43 | H44 | 85.4° | 60.0° |
| C40 | C41 | C42 | C43 | 58.6° | 180.0° |
| C41 | C40 | H37 | H38 | 119.2° | 120.0° |
| C40 | C41 | H39 | H40 | 118.1° | 120.0° |
| C40 | C41 | C42 | H41 | 62.0° | 60.0° |
| C40 | C41 | C42 | H42 | 179.1° | 60.0° |
| C42 | C43 | C44 | H43 | 120.4° | 119.9° |
| C42 | C43 | C44 | H44 | 120.4° | 120.0° |
| C42 | C43 | C44 | C45 | 125.6° | 180.0° |
| C43 | C42 | C41 | H39 | 62.1° | 60.0° |
| C43 | C42 | C41 | H40 | 179.2° | 60.0° |
| C43 | C42 | H41 | H42 | 118.2° | 120.1° |
| C42 | C43 | H43 | H44 | 118.8° | 120.0° |
| C42 | C43 | C44 | H45 | 113.9° | 60.0° |
| C42 | C43 | C44 | H46 | 5.2° | 60.0° |
| O62 | P34 | O35 | C36 | 69.1° | 55.0° |
| O62 | P34 | O35 | O63 | 120.0° | 120.0° |
| O62 | P34 | O35 | O33 | 119.9° | 120.0° |
| O62 | P34 | O63 | O33 | 120.5° | 120.0° |
| O62 | P34 | O33 | C32 | 79.9° | 54.9° |
| O62 | P34 | O63 | H89 | 0.0° | 180.0° |
| O38 | C37 | C36 | C48 | 119.5° | 120.0° |
| O38 | C37 | C36 | H36 | 121.3° | 120.0° |
| O38 | C37 | C48 | H36 | 120.2° | 120.0° |
| O38 | C37 | C36 | O35 | 167.8° | 65.0° |
| O38 | C37 | C48 | O49 | 25.0° | 65.0° |
| O38 | C37 | C36 | H34 | 72.3° | 55.0° |
| O38 | C37 | C36 | H35 | 48.0° | 175.0° |
| O38 | C37 | C48 | H52 | 94.8° | 175.0° |
| O38 | C37 | C48 | H53 | 144.7° | 55.1° |
| C74 | C73 | O76 | C66 | 62.0° | 178.8° |
| C74 | C73 | O76 | C71 | 120.2° | 120.0° |
| C74 | C73 | O76 | H80 | 120.5° | 120.0° |
| C74 | C73 | C71 | H80 | 120.0° | 120.1° |
| C74 | C73 | C71 | C69 | 101.8° | 177.6° |
| C74 | C73 | C71 | O72 | 90.6° | 62.5° |
| C74 | C73 | C71 | H79 | 5.6° | 57.6° |
| C73 | C74 | H81 | H82 | 120.6° | 119.9° |
| C73 | C74 | O75 | H93 | 180.0° | 180.0° |
| O68 | C67 | C66 | O65 | 122.7° | 177.7° |
| O68 | C67 | C66 | C69 | 120.4° | 119.9° |
| O68 | C67 | C66 | H77 | 118.4° | 120.2° |
| O68 | C67 | C66 | O76 | 114.1° | 62.3° |
| O68 | C67 | C69 | H77 | 118.6° | 120.1° |
| O68 | C67 | C69 | C71 | 76.5° | 63.0° |
| O68 | C67 | C69 | O70 | 43.3° | 56.9° |
| O68 | C67 | C66 | H76 | 5.3° | 57.7° |
| O68 | C67 | C69 | H78 | 162.4° | 177.1° |
| C36 | C37 | C48 | H36 | 119.1° | 120.0° |
| C37 | C36 | O35 | H34 | 119.8° | 120.0° |
| C37 | C36 | O35 | H35 | 119.8° | 120.0° |
| C37 | C36 | O35 | P34 | 174.2° | 180.0° |
| C36 | C37 | C48 | O49 | 95.7° | 175.0° |
| C37 | C36 | H34 | H35 | 120.5° | 120.0° |
| C36 | C37 | C48 | H52 | 144.6° | 55.0° |
| C36 | C37 | C48 | H53 | 24.0° | 65.0° |
| C48 | C37 | C36 | O35 | 48.3° | 175.0° |
| C37 | C48 | O49 | H52 | 119.7° | 120.0° |
| C37 | C48 | O49 | H53 | 119.8° | 120.1° |
| C37 | C48 | O49 | C50 | 158.9° | 180.0° |
| C48 | C37 | C36 | H34 | 168.1° | 65.0° |
| C48 | C37 | C36 | H35 | 71.5° | 55.0° |
| C37 | C48 | H52 | H53 | 120.8° | 120.0° |
| C36 | O35 | P34 | O63 | 50.9° | 65.0° |
| C36 | O35 | P34 | O33 | 170.9° | 175.1° |
| O35 | C36 | H34 | H35 | 120.5° | 120.0° |
| O35 | C36 | C37 | H36 | 70.9° | 55.0° |
| O65 | C66 | C67 | O76 | 123.3° | 119.9° |
| O65 | C66 | C67 | H76 | 117.4° | 120.0° |
| O65 | C66 | O76 | H76 | 117.1° | 120.0° |
| O65 | C66 | C67 | C69 | 116.9° | 62.3° |
| O65 | C66 | O76 | C73 | 169.8° | 58.9° |
| C66 | O65 | C64 | C02 | 134.4° | 90.0° |
| C66 | O65 | C64 | C32 | 103.1° | 150.0° |
| C66 | O65 | C64 | H75 | 16.4° | 30.0° |
| O65 | C66 | C67 | H77 | 4.2° | 57.6° |
| C64 | O65 | C66 | C67 | 66.8° | 170.0° |
| C64 | O65 | C66 | O76 | 59.7° | 70.1° |
| O65 | C64 | C02 | O01 | 5.3° | 60.0° |
| O65 | C64 | C02 | C32 | 121.6° | 120.0° |
| O65 | C64 | C02 | H75 | 119.0° | 120.0° |
| O65 | C64 | C32 | H75 | 120.6° | 119.9° |
| O65 | C64 | C02 | C03 | 115.0° | 180.0° |
| O65 | C64 | C32 | O33 | 72.6° | 60.0° |
| O65 | C64 | C32 | C07 | 167.6° | 180.0° |
| O65 | C64 | C02 | H1 | 125.0° | 60.0° |
| O65 | C64 | C32 | H33 | 48.6° | 60.0° |
| C64 | O65 | C66 | H76 | 176.6° | 49.9° |
| C67 | C66 | O76 | H76 | 118.7° | 120.0° |
| C66 | C67 | C69 | H77 | 120.9° | 119.9° |
| C67 | C66 | O76 | C73 | 45.6° | 61.1° |
| C66 | C67 | C69 | C71 | 43.9° | 57.0° |
| C66 | C67 | C69 | O70 | 163.8° | 176.8° |
| C66 | C67 | C69 | H78 | 77.2° | 63.0° |
| C66 | C67 | O68 | H90 | 180.0° | 60.0° |
| O76 | C66 | C67 | C69 | 6.4° | 57.6° |
| C66 | O76 | C73 | C71 | 58.1° | 61.2° |
| O76 | C66 | C67 | H77 | 127.5° | 177.5° |
| C66 | O76 | C73 | H80 | 177.5° | 58.9° |
| O01 | C02 | C03 | O04 | 32.4° | 180.0° |
| O01 | C02 | C64 | C03 | 120.4° | 120.0° |
| O01 | C02 | C64 | H1 | 119.7° | 120.0° |
| O01 | C02 | C64 | C32 | 126.9° | 60.0° |
| O01 | C02 | C03 | H1 | 119.6° | 120.0° |
| O01 | C02 | C03 | C05 | 163.0° | 60.0° |
| O01 | C02 | C03 | H2 | 65.4° | 60.0° |
| O01 | C02 | C64 | H75 | 113.6° | 180.0° |
| O35 | P34 | O63 | O33 | 119.7° | 120.0° |
| O35 | P34 | O33 | C32 | 39.8° | 175.0° |
| P34 | O35 | C36 | H34 | 66.0° | 60.0° |
| P34 | O35 | C36 | H35 | 54.3° | 60.0° |
| O35 | P34 | O63 | H89 | 119.7° | 60.0° |
| C43 | C44 | C45 | H45 | 120.4° | 120.0° |
| C43 | C44 | C45 | H46 | 120.4° | 120.0° |
| C43 | C44 | C45 | C46 | 173.4° | 180.0° |
| C44 | C43 | C42 | H41 | 85.2° | 60.0° |
| C44 | C43 | C42 | H42 | 33.7° | 60.0° |
| C44 | C43 | H43 | H44 | 118.7° | 120.0° |
| C43 | C44 | H45 | H46 | 118.7° | 120.0° |
| C43 | C44 | C45 | H47 | 53.0° | 60.0° |
| C43 | C44 | C45 | H48 | 66.2° | 60.0° |
| C67 | C69 | C71 | C73 | 30.7° | 57.0° |
| C67 | C69 | C71 | O70 | 120.2° | 119.8° |
| C67 | C69 | C71 | H78 | 120.7° | 119.9° |
| C67 | C69 | C71 | O72 | 161.7° | 176.9° |
| C67 | C69 | O70 | H78 | 118.7° | 120.2° |
| C69 | C67 | C66 | H76 | 125.7° | 177.6° |
| C67 | C69 | C71 | H79 | 65.5° | 63.0° |
| C69 | C67 | O68 | H90 | 55.2° | 179.7° |
| C67 | C69 | O70 | H91 | 180.0° | 60.1° |
| O76 | C73 | C71 | H80 | 119.5° | 120.0° |
| O76 | C73 | C71 | C69 | 18.7° | 57.7° |
| O76 | C73 | C71 | O72 | 148.9° | 177.5° |
| C73 | O76 | C66 | H76 | 73.1° | 178.8° |
| O76 | C73 | C71 | H79 | 114.9° | 62.3° |
| O76 | C73 | C74 | H81 | 87.7° | 175.0° |
| O76 | C73 | C74 | H82 | 151.9° | 55.0° |
| O63 | P34 | O33 | C32 | 159.5° | 65.1° |
| P34 | O33 | C32 | C64 | 123.2° | 120.1° |
| P34 | O33 | C32 | C07 | 116.4° | 119.9° |
| P34 | O33 | C32 | H33 | 3.1° | 0.1° |
| O33 | P34 | O63 | H89 | 120.6° | 60.0° |
| C44 | C45 | C46 | H47 | 120.4° | 120.0° |
| C44 | C45 | C46 | H48 | 120.4° | 120.0° |
| C45 | C44 | C43 | H43 | 5.2° | 60.0° |
| C45 | C44 | C43 | H44 | 114.0° | 60.1° |
| C45 | C44 | H45 | H46 | 118.7° | 120.0° |
| C44 | C45 | H47 | H48 | 118.6° | 120.0° |
| C44 | C45 | C46 | H49 | 180.0° | 180.0° |
| C44 | C45 | C46 | H50 | 60.0° | 60.0° |
| C44 | C45 | C46 | H51 | 60.0° | 60.0° |
| O04 | C03 | C02 | C64 | 152.7° | 60.0° |
| O04 | C03 | C02 | C05 | 164.6° | 120.0° |
| O04 | C03 | C02 | H2 | 97.8° | 120.0° |
| O04 | C03 | C05 | H2 | 97.8° | 120.0° |
| O04 | C03 | C05 | O06 | 56.5° | 180.0° |
| O04 | C03 | C05 | C07 | 176.4° | 60.0° |
| O04 | C03 | C02 | H1 | 87.2° | 60.0° |
| O04 | C03 | C05 | H3 | 64.5° | 60.0° |
| C73 | C71 | C69 | O72 | 167.6° | 119.9° |
| C73 | C71 | C69 | H79 | 96.1° | 120.0° |
| C73 | C71 | O72 | H79 | 96.1° | 120.2° |
| C73 | C71 | C69 | O70 | 150.9° | 176.8° |
| C73 | C71 | C69 | H78 | 90.0° | 62.9° |
| C71 | C73 | C74 | H81 | 32.4° | 55.0° |
| C71 | C73 | C74 | H82 | 88.0° | 65.0° |
| C73 | C71 | O72 | H92 | 180.0° | 179.7° |
| C02 | C64 | C32 | H75 | 119.7° | 120.1° |
| C64 | C02 | C03 | H1 | 120.2° | 119.9° |
| C64 | C02 | C03 | C05 | 42.7° | 60.0° |
| C02 | C64 | C32 | O33 | 167.7° | 179.9° |
| C02 | C64 | C32 | C07 | 47.9° | 60.0° |
| C64 | C02 | C03 | H2 | 54.9° | 180.0° |
| C02 | C64 | C32 | H33 | 71.1° | 59.9° |
| C64 | C02 | O01 | H83 | 180.0° | 180.0° |
| C32 | C64 | C02 | C03 | 6.6° | 60.0° |
| C64 | C32 | O33 | C07 | 120.4° | 120.0° |
| C64 | C32 | O33 | H33 | 120.1° | 120.0° |
| C64 | C32 | C07 | H33 | 118.9° | 119.9° |
| C64 | C32 | C07 | C05 | 73.7° | 60.0° |
| C64 | C32 | C07 | O08 | 164.5° | 180.0° |
| C32 | C64 | C02 | H1 | 113.4° | 180.0° |
| C64 | C32 | C07 | H4 | 44.9° | 60.0° |
| C02 | C03 | C05 | H2 | 97.6° | 120.0° |
| C02 | C03 | C05 | O06 | 138.9° | 60.0° |
| C02 | C03 | C05 | C07 | 19.0° | 60.0° |
| C02 | C03 | C05 | H3 | 100.2° | 180.0° |
| C03 | C02 | C64 | H75 | 126.0° | 60.0° |
| C03 | C02 | O01 | H83 | 57.2° | 60.0° |
| C02 | C03 | O04 | H84 | 180.0° | 60.0° |
| C48 | O49 | C50 | C51 | 61.9° | 180.0° |
| C48 | O49 | C50 | O61 | 118.2° | 0.1° |
| O49 | C48 | C37 | H36 | 145.2° | 55.0° |
| O49 | C48 | H52 | H53 | 120.7° | 120.0° |
| C03 | C05 | C07 | C32 | 37.1° | 60.0° |
| C03 | C05 | O06 | C07 | 119.7° | 120.0° |
| C03 | C05 | O06 | H3 | 119.7° | 120.0° |
| C03 | C05 | C07 | H3 | 118.9° | 120.0° |
| C03 | C05 | C07 | O08 | 158.8° | 180.0° |
| C05 | C03 | C02 | H1 | 77.4° | 180.0° |
| C03 | C05 | C07 | H4 | 81.3° | 60.0° |
| C05 | C03 | O04 | H84 | 15.1° | 180.0° |
| C03 | C05 | O06 | H85 | 180.0° | 60.0° |
| O33 | C32 | C07 | H33 | 120.4° | 120.0° |
| O33 | C32 | C07 | C05 | 165.6° | 180.0° |
| O33 | C32 | C07 | O08 | 43.7° | 60.0° |
| O33 | C32 | C07 | H4 | 75.9° | 60.0° |
| O33 | C32 | C64 | H75 | 48.0° | 60.0° |
| C32 | C07 | C05 | O06 | 82.6° | 60.0° |
| C32 | C07 | C05 | O08 | 121.7° | 120.0° |
| C32 | C07 | C05 | H4 | 118.4° | 119.9° |
| C32 | C07 | O08 | H4 | 119.1° | 120.0° |
| C32 | C07 | O08 | C09 | 175.5° | 150.0° |
| C32 | C07 | C05 | H3 | 155.9° | 180.0° |
| C07 | C32 | C64 | H75 | 71.8° | 60.1° |
| O06 | C05 | C07 | H3 | 121.5° | 120.0° |
| O06 | C05 | C07 | O08 | 39.1° | 60.0° |
| O06 | C05 | C03 | H2 | 41.3° | 60.0° |
| O06 | C05 | C07 | H4 | 159.0° | 180.0° |
| C69 | C71 | O72 | H79 | 96.3° | 120.1° |
| C71 | C69 | O70 | H78 | 119.1° | 120.3° |
| C71 | C69 | C67 | H77 | 164.9° | 176.9° |
| C69 | C71 | C73 | H80 | 138.1° | 62.3° |
| C71 | C69 | O70 | H91 | 57.8° | 179.5° |
| C69 | C71 | O72 | H92 | 12.4° | 60.0° |
| O72 | C71 | C69 | O70 | 41.5° | 63.3° |
| O72 | C71 | C69 | H78 | 77.5° | 57.0° |
| O72 | C71 | C73 | H80 | 29.4° | 57.5° |
| O70 | C69 | C67 | H77 | 75.3° | 63.3° |
| O70 | C69 | C71 | H79 | 54.8° | 56.8° |
| O49 | C50 | C51 | O61 | 179.9° | 179.9° |
| O49 | C50 | C51 | C52 | 163.6° | 180.0° |
| C50 | O49 | C48 | H52 | 39.2° | 60.0° |
| C50 | O49 | C48 | H53 | 81.4° | 60.0° |
| O49 | C50 | C51 | H54 | 43.3° | 60.0° |
| O49 | C50 | C51 | H55 | 76.0° | 60.1° |
| C46 | C45 | C44 | H45 | 66.1° | 60.0° |
| C46 | C45 | C44 | H46 | 53.0° | 60.0° |
| C46 | C45 | H47 | H48 | 118.7° | 120.0° |
| C45 | C46 | H49 | H50 | 120.0° | 120.0° |
| C45 | C46 | H49 | H51 | 120.0° | 120.0° |
| C45 | C46 | H50 | H51 | 120.0° | 120.0° |
| C05 | C07 | O08 | H4 | 119.5° | 120.0° |
| C05 | C07 | O08 | C09 | 54.1° | 90.0° |
| C07 | C05 | C03 | H2 | 78.6° | 180.0° |
| C05 | C07 | C32 | H33 | 45.2° | 60.0° |
| C07 | C05 | O06 | H85 | 60.3° | 179.9° |
| C07 | O08 | C09 | O10 | 126.8° | 65.0° |
| C07 | O08 | C09 | C30 | 62.5° | 175.0° |
| O08 | C07 | C05 | H3 | 82.3° | 60.0° |
| C07 | O08 | C09 | H5 | 32.2° | 55.0° |
| O08 | C07 | C32 | H33 | 76.7° | 60.1° |
| C50 | C51 | C52 | H54 | 120.4° | 120.0° |
| C50 | C51 | C52 | H55 | 120.4° | 119.9° |
| C50 | C51 | C52 | C53 | 88.5° | 180.0° |
| C50 | C51 | H54 | H55 | 118.8° | 120.0° |
| C50 | C51 | C52 | H56 | 151.2° | 59.9° |
| C50 | C51 | C52 | H57 | 31.9° | 60.0° |
| C52 | C51 | C50 | O61 | 16.3° | 0.1° |
| C51 | C52 | C53 | H56 | 120.4° | 120.0° |
| C51 | C52 | C53 | H57 | 120.3° | 120.0° |
| C51 | C52 | C53 | C54 | 150.5° | 180.0° |
| C52 | C51 | H54 | H55 | 118.8° | 119.9° |
| C51 | C52 | H56 | H57 | 118.8° | 119.9° |
| C51 | C52 | C53 | H58 | 30.0° | 60.0° |
| C51 | C52 | C53 | H59 | 89.0° | 60.0° |
| O61 | C50 | C51 | H54 | 136.7° | 119.9° |
| O61 | C50 | C51 | H55 | 104.1° | 120.0° |
| O08 | C09 | O10 | C30 | 170.6° | 120.0° |
| O08 | C09 | O10 | H5 | 94.9° | 120.0° |
| O08 | C09 | O10 | C11 | 148.3° | 178.9° |
| O08 | C09 | C30 | H5 | 94.9° | 120.0° |
| O08 | C09 | C30 | O31 | 48.6° | 57.8° |
| O08 | C09 | C30 | C28 | 169.0° | 177.6° |
| C09 | O08 | C07 | H4 | 65.5° | 30.0° |
| O08 | C09 | C30 | H32 | 71.8° | 62.4° |
| C52 | C53 | C54 | H58 | 120.5° | 120.0° |
| C52 | C53 | C54 | H59 | 120.5° | 120.0° |
| C52 | C53 | C54 | C55 | 92.7° | 180.0° |
| C53 | C52 | C51 | H54 | 31.9° | 60.0° |
| C53 | C52 | C51 | H55 | 151.2° | 60.0° |
| C53 | C52 | H56 | H57 | 118.9° | 120.0° |
| C52 | C53 | H58 | H59 | 118.5° | 120.0° |
| C52 | C53 | C54 | H60 | 27.8° | 60.0° |
| C52 | C53 | C54 | H61 | 146.9° | 60.0° |
| C53 | C54 | C55 | H60 | 120.5° | 120.0° |
| C53 | C54 | C55 | H61 | 120.5° | 120.0° |
| C53 | C54 | C55 | C56 | 146.3° | 180.0° |
| C54 | C53 | C52 | H56 | 89.1° | 60.0° |
| C54 | C53 | C52 | H57 | 30.1° | 60.0° |
| C54 | C53 | H58 | H59 | 118.5° | 120.0° |
| C53 | C54 | H60 | H61 | 118.6° | 120.0° |
| C53 | C54 | C55 | H62 | 25.8° | 60.0° |
| C53 | C54 | C55 | H63 | 93.2° | 60.0° |
| O10 | C09 | C30 | H5 | 94.6° | 120.0° |
| C09 | O10 | C11 | C12 | 151.8° | 178.9° |
| C09 | O10 | C11 | C26 | 30.7° | 61.1° |
| O10 | C09 | C30 | O31 | 122.0° | 62.3° |
| O10 | C09 | C30 | C28 | 1.6° | 57.6° |
| C09 | O10 | C11 | H6 | 90.4° | 58.8° |
| O10 | C09 | C30 | H32 | 117.6° | 177.6° |
| C11 | O10 | C09 | C30 | 41.1° | 61.2° |
| O10 | C11 | C12 | C26 | 124.3° | 119.9° |
| O10 | C11 | C12 | H6 | 118.1° | 120.1° |
| O10 | C11 | C26 | H6 | 121.6° | 120.0° |
| O10 | C11 | C12 | O13 | 34.2° | 65.0° |
| O10 | C11 | C26 | O27 | 102.6° | 177.5° |
| O10 | C11 | C26 | C28 | 17.8° | 57.6° |
| C11 | O10 | C09 | H5 | 53.5° | 58.9° |
| O10 | C11 | C12 | H7 | 85.5° | 174.9° |
| O10 | C11 | C12 | H8 | 153.9° | 54.9° |
| O10 | C11 | C26 | H30 | 138.4° | 62.4° |
| C09 | C30 | O31 | C28 | 119.7° | 119.6° |
| C09 | C30 | O31 | H32 | 119.7° | 120.1° |
| C09 | C30 | C28 | H32 | 118.8° | 119.9° |
| C09 | C30 | C28 | C26 | 51.9° | 57.0° |
| C09 | C30 | C28 | O29 | 67.4° | 176.9° |
| C09 | C30 | C28 | H31 | 172.5° | 63.0° |
| C09 | C30 | O31 | H88 | 180.0° | 60.1° |
| C12 | C11 | C26 | H6 | 117.9° | 120.1° |
| C11 | C12 | O13 | H7 | 119.7° | 120.0° |
| C11 | C12 | O13 | H8 | 119.7° | 120.0° |
| C12 | C11 | C26 | O27 | 136.9° | 62.5° |
| C11 | C12 | O13 | C14 | 134.9° | 180.0° |
| C12 | C11 | C26 | C28 | 102.7° | 177.6° |
| C11 | C12 | H7 | H8 | 120.9° | 120.0° |
| C12 | C11 | C26 | H30 | 17.9° | 57.6° |
| C26 | C11 | C12 | O13 | 90.2° | 175.0° |
| C11 | C26 | C28 | C30 | 62.8° | 57.0° |
| C11 | C26 | O27 | C28 | 123.5° | 119.7° |
| C11 | C26 | O27 | H30 | 118.0° | 120.1° |
| C11 | C26 | C28 | H30 | 120.3° | 119.9° |
| C11 | C26 | C28 | O29 | 56.8° | 176.8° |
| C26 | C11 | C12 | H7 | 150.1° | 55.0° |
| C26 | C11 | C12 | H8 | 29.5° | 65.0° |
| C11 | C26 | C28 | H31 | 176.5° | 63.0° |
| C11 | C26 | O27 | H86 | 180.0° | 180.0° |
| C54 | C55 | C56 | H62 | 120.5° | 120.0° |
| C54 | C55 | C56 | H63 | 120.5° | 120.0° |
| C54 | C55 | C56 | C57 | 153.0° | 180.0° |
| C55 | C54 | C53 | H58 | 146.8° | 60.0° |
| C55 | C54 | C53 | H59 | 27.8° | 60.0° |
| C55 | C54 | H60 | H61 | 118.5° | 120.0° |
| C54 | C55 | H62 | H63 | 118.4° | 120.1° |
| C54 | C55 | C56 | H64 | 86.6° | 60.0° |
| C54 | C55 | C56 | H65 | 32.6° | 60.0° |
| C12 | O13 | C14 | C15 | 49.3° | 180.0° |
| C12 | O13 | C14 | O25 | 131.0° | 0.0° |
| O13 | C12 | C11 | H6 | 152.2° | 55.0° |
| O13 | C12 | H7 | H8 | 120.9° | 120.1° |
| O31 | C30 | C28 | H32 | 121.0° | 120.2° |
| O31 | C30 | C28 | C26 | 172.1° | 62.9° |
| O31 | C30 | C28 | O29 | 52.8° | 57.0° |
| O31 | C30 | C09 | H5 | 143.5° | 177.7° |
| O31 | C30 | C28 | H31 | 67.4° | 177.1° |
| C30 | C28 | C26 | O27 | 57.9° | 176.9° |
| C30 | C28 | C26 | O29 | 119.6° | 119.9° |
| C30 | C28 | C26 | H31 | 120.7° | 120.0° |
| C30 | C28 | O29 | H31 | 120.0° | 120.2° |
| C28 | C30 | C09 | H5 | 96.1° | 62.4° |
| C30 | C28 | C26 | H30 | 176.9° | 62.9° |
| C30 | C28 | O29 | H87 | 147.5° | 60.5° |
| C28 | C30 | O31 | H88 | 60.3° | 179.7° |
| O27 | C26 | C28 | H30 | 119.0° | 120.2° |
| O27 | C26 | C28 | O29 | 177.5° | 63.2° |
| O27 | C26 | C11 | H6 | 19.0° | 57.6° |
| O27 | C26 | C28 | H31 | 62.8° | 56.9° |
| C55 | C56 | C57 | H64 | 120.4° | 120.0° |
| C55 | C56 | C57 | H65 | 120.4° | 120.0° |
| C55 | C56 | C57 | C58 | 131.3° | 180.0° |
| C56 | C55 | C54 | H60 | 93.3° | 60.0° |
| C56 | C55 | C54 | H61 | 25.8° | 60.0° |
| C56 | C55 | H62 | H63 | 118.4° | 119.9° |
| C55 | C56 | H64 | H65 | 118.8° | 119.9° |
| C55 | C56 | C57 | H66 | 108.3° | 60.0° |
| C55 | C56 | C57 | H67 | 11.0° | 60.0° |
| O13 | C14 | C15 | O25 | 179.7° | 180.0° |
| O13 | C14 | C15 | C16 | 166.9° | 180.0° |
| C14 | O13 | C12 | H7 | 105.4° | 60.0° |
| C14 | O13 | C12 | H8 | 15.2° | 60.0° |
| O13 | C14 | C15 | H9 | 72.5° | 60.0° |
| O13 | C14 | C15 | H10 | 46.4° | 60.0° |
| C26 | C28 | O29 | H31 | 119.4° | 120.2° |
| C28 | C26 | C11 | H6 | 139.4° | 62.4° |
| C26 | C28 | C30 | H32 | 66.9° | 176.9° |
| C28 | C26 | O27 | H86 | 56.5° | 60.3° |
| C26 | C28 | O29 | H87 | 26.8° | 180.0° |
| C56 | C57 | C58 | H66 | 120.3° | 120.0° |
| C56 | C57 | C58 | H67 | 120.3° | 120.0° |
| C56 | C57 | C58 | C59 | 155.0° | 180.0° |
| C57 | C56 | C55 | H62 | 32.5° | 60.0° |
| C57 | C56 | C55 | H63 | 86.4° | 60.0° |
| C57 | C56 | H64 | H65 | 118.8° | 120.0° |
| C56 | C57 | H66 | H67 | 119.0° | 120.0° |
| C56 | C57 | C58 | H68 | 84.5° | 60.0° |
| C56 | C57 | C58 | H69 | 34.4° | 60.0° |
| C57 | C58 | C59 | H68 | 120.5° | 119.9° |
| C57 | C58 | C59 | H69 | 120.5° | 120.1° |
| C57 | C58 | C59 | C60 | 162.5° | 180.0° |
| C58 | C57 | C56 | H64 | 10.9° | 60.0° |
| C58 | C57 | C56 | H65 | 108.3° | 60.0° |
| C58 | C57 | H66 | H67 | 119.0° | 120.0° |
| C57 | C58 | H68 | H69 | 118.4° | 120.0° |
| C57 | C58 | C59 | H70 | 77.2° | 60.1° |
| C57 | C58 | C59 | H71 | 42.2° | 60.0° |
| O29 | C28 | C26 | H30 | 63.5° | 56.9° |
| O29 | C28 | C30 | H32 | 173.8° | 63.2° |
| C14 | C15 | C16 | H9 | 120.5° | 120.0° |
| C14 | C15 | C16 | H10 | 120.5° | 120.0° |
| C14 | C15 | C16 | C17 | 113.4° | 180.0° |
| C14 | C15 | H9 | H10 | 118.4° | 120.0° |
| C14 | C15 | C16 | H11 | 126.1° | 60.0° |
| C14 | C15 | C16 | H12 | 7.1° | 60.0° |
| O25 | C14 | C15 | C16 | 13.4° | 0.0° |
| O25 | C14 | C15 | H9 | 107.2° | 120.0° |
| O25 | C14 | C15 | H10 | 133.9° | 120.0° |
| C15 | C16 | C17 | H11 | 120.5° | 120.0° |
| C15 | C16 | C17 | H12 | 120.5° | 120.1° |
| C15 | C16 | C17 | C18 | 130.4° | 180.0° |
| C16 | C15 | H9 | H10 | 118.4° | 120.0° |
| C15 | C16 | H11 | H12 | 118.4° | 120.1° |
| C15 | C16 | C17 | H13 | 109.1° | 60.0° |
| C15 | C16 | C17 | H14 | 9.9° | 60.0° |
| C58 | C59 | C60 | H70 | 120.3° | 119.9° |
| C58 | C59 | C60 | H71 | 120.3° | 120.0° |
| C59 | C58 | C57 | H66 | 34.6° | 60.1° |
| C59 | C58 | C57 | H67 | 84.7° | 60.0° |
| C59 | C58 | H68 | H69 | 118.4° | 120.0° |
| C58 | C59 | H70 | H71 | 119.0° | 120.0° |
| C58 | C59 | C60 | H72 | 180.0° | 60.0° |
| C58 | C59 | C60 | H73 | 60.0° | 60.0° |
| C58 | C59 | C60 | H74 | 60.0° | 180.0° |
| C60 | C59 | C58 | H68 | 42.0° | 60.0° |
| C60 | C59 | C58 | H69 | 76.9° | 59.9° |
| C60 | C59 | H70 | H71 | 119.0° | 120.0° |
| C59 | C60 | H72 | H73 | 120.0° | 120.0° |
| C59 | C60 | H72 | H74 | 120.0° | 119.9° |
| C59 | C60 | H73 | H74 | 120.0° | 119.9° |
| C16 | C17 | C18 | H13 | 120.5° | 120.0° |
| C16 | C17 | C18 | H14 | 120.5° | 120.0° |
| C16 | C17 | C18 | C19 | 59.2° | 180.0° |
| C17 | C16 | C15 | H9 | 7.1° | 60.0° |
| C17 | C16 | C15 | H10 | 126.1° | 60.0° |
| C17 | C16 | H11 | H12 | 118.4° | 119.9° |
| C16 | C17 | H13 | H14 | 118.5° | 120.0° |
| C16 | C17 | C18 | H15 | 61.3° | 60.0° |
| C16 | C17 | C18 | H16 | 179.8° | 60.0° |
| C17 | C18 | C19 | H15 | 120.6° | 120.0° |
| C17 | C18 | C19 | H16 | 120.6° | 120.0° |
| C17 | C18 | C19 | C20 | 128.3° | 180.0° |
| C18 | C17 | C16 | H11 | 9.9° | 60.0° |
| C18 | C17 | C16 | H12 | 109.1° | 59.9° |
| C18 | C17 | H13 | H14 | 118.4° | 120.0° |
| C17 | C18 | H15 | H16 | 118.2° | 120.0° |
| C17 | C18 | C19 | H17 | 111.4° | 60.0° |
| C17 | C18 | C19 | H18 | 8.1° | 60.0° |
| C18 | C19 | C20 | H17 | 120.3° | 120.0° |
| C18 | C19 | C20 | H18 | 120.3° | 120.0° |
| C18 | C19 | C20 | C21 | 65.2° | 180.0° |
| C19 | C18 | C17 | H13 | 179.7° | 60.0° |
| C19 | C18 | C17 | H14 | 61.3° | 60.0° |
| C19 | C18 | H15 | H16 | 118.1° | 120.0° |
| C18 | C19 | H17 | H18 | 119.3° | 120.0° |
| C18 | C19 | C20 | H19 | 174.3° | 60.0° |
| C18 | C19 | C20 | H20 | 55.4° | 60.0° |
| C19 | C20 | C21 | H19 | 120.5° | 120.0° |
| C19 | C20 | C21 | H20 | 120.5° | 120.0° |
| C19 | C20 | C21 | C22 | 59.6° | 180.0° |
| C20 | C19 | C18 | H15 | 7.7° | 60.0° |
| C20 | C19 | C18 | H16 | 111.1° | 60.0° |
| C20 | C19 | H17 | H18 | 119.2° | 120.0° |
| C19 | C20 | H19 | H20 | 118.4° | 120.0° |
| C19 | C20 | C21 | H21 | 180.0° | 60.0° |
| C19 | C20 | C21 | H22 | 60.9° | 60.0° |
| C20 | C21 | C22 | H21 | 120.4° | 120.0° |
| C20 | C21 | C22 | H22 | 120.5° | 120.0° |
| C20 | C21 | C22 | C23 | 130.5° | 180.0° |
| C21 | C20 | C19 | H17 | 55.1° | 60.0° |
| C21 | C20 | C19 | H18 | 174.5° | 60.0° |
| C21 | C20 | H19 | H20 | 118.4° | 120.0° |
| C20 | C21 | H21 | H22 | 118.6° | 120.0° |
| C20 | C21 | C22 | H23 | 108.9° | 60.0° |
| C20 | C21 | C22 | H24 | 9.8° | 60.0° |
| C21 | C22 | C23 | H23 | 120.6° | 120.0° |
| C21 | C22 | C23 | H24 | 120.6° | 119.9° |
| C21 | C22 | C23 | C24 | 101.0° | 180.0° |
| C22 | C21 | C20 | H19 | 60.9° | 60.0° |
| C22 | C21 | C20 | H20 | 179.9° | 60.0° |
| C22 | C21 | H21 | H22 | 118.6° | 120.0° |
| C21 | C22 | H23 | H24 | 118.1° | 120.0° |
| C21 | C22 | C23 | H25 | 138.5° | 60.0° |
| C21 | C22 | C23 | H26 | 19.4° | 60.1° |
| C22 | C23 | C24 | H25 | 120.4° | 120.0° |
| C22 | C23 | C24 | H26 | 120.4° | 119.9° |
| C23 | C22 | C21 | H21 | 10.0° | 60.0° |
| C23 | C22 | C21 | H22 | 109.1° | 60.0° |
| C23 | C22 | H23 | H24 | 118.2° | 120.0° |
| C22 | C23 | H25 | H26 | 118.6° | 120.0° |
| C22 | C23 | C24 | H27 | 180.0° | 60.0° |
| C22 | C23 | C24 | H28 | 60.0° | 60.0° |
| C22 | C23 | C24 | H29 | 60.0° | 180.0° |
| C24 | C23 | C22 | H23 | 19.6° | 60.0° |
| C24 | C23 | C22 | H24 | 138.4° | 60.1° |
| C24 | C23 | H25 | H26 | 118.7° | 120.0° |
| C23 | C24 | H27 | H28 | 120.0° | 120.0° |
| C23 | C24 | H27 | H29 | 120.0° | 120.0° |
| C23 | C24 | H28 | H29 | 120.0° | 120.0° |
| H1 | C02 | C03 | H2 | 175.0° | 60.0° |
| H1 | C02 | C64 | H75 | 6.1° | 60.0° |
| H1 | C02 | O01 | H83 | 61.2° | 60.1° |
| H2 | C03 | C05 | H3 | 162.2° | 60.0° |
| H2 | C03 | O04 | H84 | 82.4° | 60.0° |
| H3 | C05 | C07 | H4 | 37.5° | 60.1° |
| H3 | C05 | O06 | H85 | 60.3° | 60.0° |
| H4 | C07 | C32 | H33 | 163.7° | 179.9° |
| H5 | C09 | C30 | H32 | 23.1° | 57.6° |
| H6 | C11 | C12 | H7 | 32.5° | 65.0° |
| H6 | C11 | C12 | H8 | 88.1° | 175.0° |
| H6 | C11 | C26 | H30 | 100.0° | 177.7° |
| H9 | C15 | C16 | H11 | 113.4° | 180.0° |
| H9 | C15 | C16 | H12 | 127.7° | 60.0° |
| H10 | C15 | C16 | H11 | 5.6° | 60.0° |
| H10 | C15 | C16 | H12 | 113.4° | 180.0° |
| H11 | C16 | C17 | H13 | 130.4° | 180.0° |
| H11 | C16 | C17 | H14 | 110.6° | 60.0° |
| H12 | C16 | C17 | H13 | 11.4° | 60.1° |
| H12 | C16 | C17 | H14 | 130.4° | 180.0° |
| H13 | C17 | C18 | H15 | 59.2° | 180.0° |
| H13 | C17 | C18 | H16 | 59.7° | 60.0° |
| H14 | C17 | C18 | H15 | 178.1° | 60.0° |
| H14 | C17 | C18 | H16 | 59.3° | 180.0° |
| H15 | C18 | C19 | H17 | 128.0° | 180.0° |
| H15 | C18 | C19 | H18 | 112.5° | 60.0° |
| H16 | C18 | C19 | H17 | 9.2° | 60.0° |
| H16 | C18 | C19 | H18 | 128.7° | NaN° |
| H17 | C19 | C20 | H19 | 65.4° | 180.0° |
| H17 | C19 | C20 | H20 | 175.6° | 60.0° |
| H18 | C19 | C20 | H19 | 54.0° | 60.0° |
| H18 | C19 | C20 | H20 | 64.9° | 180.0° |
| H19 | C20 | C21 | H21 | 59.5° | 180.0° |
| H19 | C20 | C21 | H22 | 178.6° | 60.0° |
| H20 | C20 | C21 | H21 | 59.5° | 60.0° |
| H20 | C20 | C21 | H22 | 59.6° | 180.0° |
| H21 | C21 | C22 | H23 | 130.6° | 180.0° |
| H21 | C21 | C22 | H24 | 110.6° | 60.0° |
| H22 | C21 | C22 | H23 | 11.6° | 60.0° |
| H22 | C21 | C22 | H24 | 130.3° | 180.0° |
| H23 | C22 | C23 | H25 | 100.8° | 180.0° |
| H23 | C22 | C23 | H26 | 140.1° | 59.9° |
| H24 | C22 | C23 | H25 | 18.0° | 59.9° |
| H24 | C22 | C23 | H26 | 101.1° | 180.0° |
| H25 | C23 | C24 | H27 | 59.6° | 180.0° |
| H25 | C23 | C24 | H28 | 179.6° | 60.0° |
| H25 | C23 | C24 | H29 | 60.4° | 60.0° |
| H26 | C23 | C24 | H27 | 59.6° | 59.9° |
| H26 | C23 | C24 | H28 | 60.4° | 179.9° |
| H26 | C23 | C24 | H29 | 179.5° | 60.0° |
| H27 | C24 | H28 | H29 | 120.0° | 120.0° |
| H30 | C26 | C28 | H31 | 56.2° | 177.1° |
| H30 | C26 | O27 | H86 | 62.0° | 59.9° |
| H31 | C28 | C30 | H32 | 53.6° | 56.9° |
| H31 | C28 | O29 | H87 | 92.6° | 59.8° |
| H32 | C30 | O31 | H88 | 60.3° | 60.0° |
| H33 | C32 | C64 | H75 | 169.2° | 180.0° |
| H34 | C36 | C37 | H36 | 48.9° | 175.0° |
| H35 | C36 | C37 | H36 | 169.3° | 65.0° |
| H36 | C37 | C48 | H52 | 25.4° | 65.0° |
| H36 | C37 | C48 | H53 | 95.1° | 175.0° |
| H37 | C40 | C41 | H39 | 45.9° | 180.0° |
| H37 | C40 | C41 | H40 | 164.6° | 60.0° |
| H38 | C40 | C41 | H39 | 165.4° | 60.0° |
| H38 | C40 | C41 | H40 | 75.9° | 180.0° |
| H39 | C41 | C42 | H41 | 177.3° | 180.0° |
| H39 | C41 | C42 | H42 | 58.5° | 60.0° |
| H40 | C41 | C42 | H41 | 58.6° | 60.0° |
| H40 | C41 | C42 | H42 | 60.2° | 180.0° |
| H41 | C42 | C43 | H43 | 154.4° | 180.0° |
| H41 | C42 | C43 | H44 | 35.2° | 60.0° |
| H42 | C42 | C43 | H43 | 86.8° | 59.9° |
| H42 | C42 | C43 | H44 | 154.1° | 180.0° |
| H43 | C43 | C44 | H45 | 125.6° | 180.0° |
| H43 | C43 | C44 | H46 | 115.2° | 60.0° |
| H44 | C43 | C44 | H45 | 6.5° | 60.0° |
| H44 | C43 | C44 | H46 | 125.6° | 180.0° |
| H45 | C44 | C45 | H47 | 173.4° | 180.0° |
| H45 | C44 | C45 | H48 | 54.3° | 60.0° |
| H46 | C44 | C45 | H47 | 67.4° | 60.0° |
| H46 | C44 | C45 | H48 | 173.4° | 180.0° |
| H47 | C45 | C46 | H49 | 59.6° | 60.0° |
| H47 | C45 | C46 | H50 | 179.6° | 180.0° |
| H47 | C45 | C46 | H51 | 60.4° | 60.0° |
| H48 | C45 | C46 | H49 | 59.6° | 60.0° |
| H48 | C45 | C46 | H50 | 60.4° | 60.0° |
| H48 | C45 | C46 | H51 | 179.6° | 180.0° |
| H49 | C46 | H50 | H51 | 120.0° | 120.0° |
| H54 | C51 | C52 | H56 | 88.4° | 180.0° |
| H54 | C51 | C52 | H57 | 152.3° | 60.0° |
| H55 | C51 | C52 | H56 | 30.8° | 60.0° |
| H55 | C51 | C52 | H57 | 88.5° | 180.0° |
| H56 | C52 | C53 | H58 | 150.4° | 180.0° |
| H56 | C52 | C53 | H59 | 31.3° | 60.0° |
| H57 | C52 | C53 | H58 | 90.3° | 60.0° |
| H57 | C52 | C53 | H59 | 150.6° | 180.0° |
| H58 | C53 | C54 | H60 | 92.7° | 180.0° |
| H58 | C53 | C54 | H61 | 26.4° | 60.0° |
| H59 | C53 | C54 | H60 | 148.3° | 60.0° |
| H59 | C53 | C54 | H61 | 92.7° | 180.0° |
| H60 | C54 | C55 | H62 | 146.2° | 180.0° |
| H60 | C54 | C55 | H63 | 27.3° | 60.0° |
| H61 | C54 | C55 | H62 | 94.7° | 60.0° |
| H61 | C54 | C55 | H63 | 146.3° | 179.9° |
| H62 | C55 | C56 | H64 | 152.9° | 180.0° |
| H62 | C55 | C56 | H65 | 87.9° | 60.0° |
| H63 | C55 | C56 | H64 | 34.0° | 60.0° |
| H63 | C55 | C56 | H65 | 153.2° | 180.0° |
| H64 | C56 | C57 | H66 | 131.2° | 180.0° |
| H64 | C56 | C57 | H67 | 109.4° | 60.1° |
| H65 | C56 | C57 | H66 | 12.1° | 60.0° |
| H65 | C56 | C57 | H67 | 131.4° | 180.0° |
| H66 | C57 | C58 | H68 | 155.2° | 180.0° |
| H66 | C57 | C58 | H69 | 85.9° | 60.0° |
| H67 | C57 | C58 | H68 | 35.8° | 60.0° |
| H67 | C57 | C58 | H69 | 154.7° | 180.0° |
| H68 | C58 | C59 | H70 | 162.3° | 180.0° |
| H68 | C58 | C59 | H71 | 78.3° | 60.0° |
| H69 | C58 | C59 | H70 | 43.4° | 60.0° |
| H69 | C58 | C59 | H71 | 162.8° | 179.9° |
| H70 | C59 | C60 | H72 | 59.7° | 180.0° |
| H70 | C59 | C60 | H73 | 179.7° | 60.0° |
| H70 | C59 | C60 | H74 | 60.3° | 60.0° |
| H71 | C59 | C60 | H72 | 59.7° | 60.0° |
| H71 | C59 | C60 | H73 | 60.3° | 180.0° |
| H71 | C59 | C60 | H74 | 179.7° | 60.0° |
| H72 | C60 | H73 | H74 | 120.0° | 120.1° |
| H76 | C66 | C67 | H77 | 113.2° | 62.5° |
| H77 | C67 | C69 | H78 | 43.8° | 57.0° |
| H77 | C67 | O68 | H90 | 62.6° | 60.2° |
| H78 | C69 | C71 | H79 | 173.8° | 177.1° |
| H78 | C69 | O70 | H91 | 61.3° | 60.1° |
| H79 | C71 | C73 | H80 | 125.6° | 177.7° |
| H79 | C71 | O72 | H92 | 83.9° | 60.1° |
| H80 | C73 | C74 | H81 | 152.0° | 65.1° |
| H80 | C73 | C74 | H82 | 31.7° | 174.9° |
| H81 | C74 | O75 | H93 | 60.2° | 60.1° |
| H82 | C74 | O75 | H93 | 60.2° | 60.0° |
