A1LX7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C01 | sing | 1.53Å | 1.52Å | |
| C02 | C03 | sing | 1.53Å | 1.52Å | |
| C03 | C04 | sing | 1.53Å | 1.52Å | |
| C04 | C05 | sing | 1.53Å | 1.52Å | |
| C05 | C06 | sing | 1.53Å | 1.52Å | |
| C19 | C20 | sing | 1.53Å | 1.52Å | |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C06 | C07 | sing | 1.53Å | 1.52Å | |
| C07 | C08 | sing | 1.51Å | 1.52Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| O39 | C08 | doub | 1.21Å | 1.18Å | |
| C08 | O09 | sing | 1.34Å | 1.39Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| O09 | C10 | sing | 1.45Å | 1.40Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C15 | C14 | sing | 1.53Å | 1.52Å | |
| C14 | C13 | sing | 1.51Å | 1.52Å | |
| C11 | O12 | sing | 1.45Å | 1.40Å | |
| C11 | C22 | sing | 1.53Å | 1.52Å | |
| O12 | C13 | sing | 1.34Å | 1.40Å | |
| C13 | O21 | doub | 1.21Å | 1.17Å | |
| C22 | O23 | sing | 1.43Å | 1.39Å | |
| O23 | P24 | sing | 1.61Å | 1.64Å | |
| O38 | P24 | doub | 1.48Å | 1.49Å | |
| P24 | O26 | sing | 1.61Å | 1.63Å | |
| P24 | O25 | sing | 1.61Å | 1.50Å | |
| O26 | C27 | sing | 1.43Å | 1.40Å | |
| O37 | C36 | sing | 1.43Å | 1.40Å | |
| C27 | C36 | sing | 1.53Å | 1.52Å | |
| C27 | C28 | sing | 1.53Å | 1.53Å | |
| C36 | C34 | sing | 1.53Å | 1.53Å | |
| O29 | C28 | sing | 1.43Å | 1.39Å | |
| C28 | C30 | sing | 1.53Å | 1.53Å | |
| C34 | O35 | sing | 1.43Å | 1.40Å | |
| C34 | C32 | sing | 1.53Å | 1.52Å | |
| C30 | C32 | sing | 1.53Å | 1.53Å | |
| C30 | O31 | sing | 1.43Å | 1.40Å | |
| C32 | O33 | sing | 1.43Å | 1.40Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C16 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C18 | H9 | sing | 1.09Å | 1.10Å | |
| C18 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.09Å | 1.10Å | |
| C19 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C28 | H16 | sing | 1.09Å | 1.10Å | |
| C32 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C01 | H21 | sing | 1.09Å | 1.10Å | |
| C01 | H22 | sing | 1.09Å | 1.10Å | |
| C01 | H23 | sing | 1.09Å | 1.10Å | |
| C02 | H24 | sing | 1.09Å | 1.10Å | |
| C02 | H25 | sing | 1.09Å | 1.10Å | |
| C03 | H26 | sing | 1.09Å | 1.10Å | |
| C03 | H27 | sing | 1.09Å | 1.10Å | |
| C04 | H28 | sing | 1.09Å | 1.10Å | |
| C04 | H29 | sing | 1.09Å | 1.10Å | |
| C05 | H30 | sing | 1.09Å | 1.10Å | |
| C05 | H31 | sing | 1.09Å | 1.10Å | |
| C06 | H32 | sing | 1.09Å | 1.10Å | |
| C06 | H33 | sing | 1.09Å | 1.10Å | |
| C07 | H34 | sing | 1.09Å | 1.10Å | |
| C07 | H35 | sing | 1.09Å | 1.10Å | |
| C14 | H36 | sing | 1.09Å | 1.10Å | |
| C14 | H37 | sing | 1.09Å | 1.10Å | |
| O25 | H38 | sing | 0.97Å | 0.95Å | |
| C27 | H39 | sing | 1.09Å | 1.10Å | |
| O29 | H40 | sing | 0.97Å | 0.95Å | |
| C30 | H41 | sing | 1.09Å | 1.10Å | |
| O31 | H42 | sing | 0.97Å | 0.95Å | |
| O33 | H43 | sing | 0.97Å | 0.95Å | |
| C34 | H44 | sing | 1.09Å | 1.10Å | |
| O35 | H45 | sing | 0.97Å | 0.95Å | |
| C36 | H46 | sing | 1.09Å | 1.10Å | |
| O37 | H47 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 111.7° | 109.5° |
| C02 | C01 | H21 | 109.5° | 109.5° |
| C02 | C01 | H22 | 109.5° | 109.5° |
| C02 | C01 | H23 | 109.4° | 109.5° |
| C01 | C02 | H24 | 108.9° | 109.5° |
| C01 | C02 | H25 | 108.9° | 109.5° |
| C02 | C03 | C04 | 111.0° | 109.5° |
| C03 | C02 | H24 | 108.9° | 109.5° |
| C03 | C02 | H25 | 108.9° | 109.5° |
| C02 | C03 | H26 | 109.1° | 109.5° |
| C02 | C03 | H27 | 109.1° | 109.4° |
| C03 | C04 | C05 | 111.7° | 109.5° |
| C04 | C03 | H26 | 109.1° | 109.5° |
| C04 | C03 | H27 | 109.1° | 109.4° |
| C03 | C04 | H28 | 108.9° | 109.5° |
| C03 | C04 | H29 | 108.9° | 109.5° |
| C04 | C05 | C06 | 112.1° | 109.5° |
| C05 | C04 | H28 | 108.9° | 109.5° |
| C05 | C04 | H29 | 108.9° | 109.4° |
| C04 | C05 | H30 | 108.8° | 109.5° |
| C04 | C05 | H31 | 108.8° | 109.5° |
| C05 | C06 | C07 | 112.3° | 109.5° |
| C06 | C05 | H30 | 108.8° | 109.5° |
| C06 | C05 | H31 | 108.8° | 109.4° |
| C05 | C06 | H32 | 108.7° | 109.5° |
| C05 | C06 | H33 | 108.7° | 109.5° |
| C20 | C19 | C18 | 111.9° | 109.5° |
| C20 | C19 | H11 | 108.8° | 109.5° |
| C20 | C19 | H12 | 108.8° | 109.5° |
| C19 | C20 | H13 | 109.5° | 109.4° |
| C19 | C20 | H14 | 109.5° | 109.5° |
| C19 | C20 | H15 | 109.5° | 109.5° |
| C19 | C18 | C17 | 110.8° | 109.5° |
| C19 | C18 | H9 | 109.1° | 109.4° |
| C19 | C18 | H10 | 109.2° | 109.5° |
| C18 | C19 | H11 | 108.9° | 109.4° |
| C18 | C19 | H12 | 108.9° | 109.5° |
| C06 | C07 | C08 | 111.7° | 109.5° |
| C07 | C06 | H32 | 108.8° | 109.5° |
| C07 | C06 | H33 | 108.7° | 109.5° |
| C06 | C07 | H34 | 108.9° | 109.4° |
| C06 | C07 | H35 | 108.9° | 109.4° |
| C07 | C08 | O39 | 119.1° | 119.9° |
| C07 | C08 | O09 | 121.5° | 120.0° |
| C08 | C07 | H34 | 108.9° | 109.5° |
| C08 | C07 | H35 | 108.9° | 109.5° |
| C18 | C17 | C16 | 111.0° | 109.5° |
| C18 | C17 | H7 | 109.1° | 109.5° |
| C18 | C17 | H8 | 109.1° | 109.5° |
| C17 | C18 | H9 | 109.1° | 109.5° |
| C17 | C18 | H10 | 109.1° | 109.5° |
| O39 | C08 | O09 | 119.4° | 120.1° |
| C08 | O09 | C10 | 112.1° | 117.0° |
| C17 | C16 | C15 | 114.7° | 109.5° |
| C17 | C16 | H5 | 108.1° | 109.4° |
| C17 | C16 | H6 | 108.2° | 109.5° |
| C16 | C17 | H7 | 109.1° | 109.4° |
| C16 | C17 | H8 | 109.1° | 109.5° |
| O09 | C10 | C11 | 110.1° | 109.4° |
| O09 | C10 | H1 | 109.3° | 109.4° |
| O09 | C10 | H2 | 109.3° | 109.5° |
| C16 | C15 | C14 | 111.4° | 109.5° |
| C16 | C15 | H3 | 109.0° | 109.5° |
| C16 | C15 | H4 | 109.0° | 109.5° |
| C15 | C16 | H5 | 108.1° | 109.5° |
| C15 | C16 | H6 | 108.2° | 109.5° |
| C10 | C11 | O12 | 109.5° | 109.5° |
| C10 | C11 | C22 | 106.2° | 109.5° |
| C11 | C10 | H1 | 109.3° | 109.5° |
| C11 | C10 | H2 | 109.3° | 109.5° |
| C10 | C11 | H20 | 110.0° | 109.4° |
| C15 | C14 | C13 | 110.7° | 109.5° |
| C14 | C15 | H3 | 109.0° | 109.5° |
| C14 | C15 | H4 | 109.0° | 109.5° |
| C15 | C14 | H36 | 109.1° | 109.5° |
| C15 | C14 | H37 | 109.2° | 109.5° |
| C14 | C13 | O12 | 120.5° | 120.0° |
| C14 | C13 | O21 | 118.6° | 120.0° |
| C13 | C14 | H36 | 109.1° | 109.4° |
| C13 | C14 | H37 | 109.2° | 109.4° |
| O12 | C11 | C22 | 108.8° | 109.5° |
| C11 | O12 | C13 | 119.2° | 117.0° |
| O12 | C11 | H20 | 112.0° | 109.4° |
| C11 | C22 | O23 | 108.8° | 109.5° |
| C11 | C22 | H18 | 109.6° | 109.5° |
| C11 | C22 | H19 | 109.6° | 109.5° |
| C22 | C11 | H20 | 110.2° | 109.5° |
| O12 | C13 | O21 | 120.9° | 120.0° |
| C22 | O23 | P24 | 117.1° | 123.0° |
| O23 | C22 | H18 | 109.6° | 109.4° |
| O23 | C22 | H19 | 109.7° | 109.5° |
| O23 | P24 | O38 | 110.8° | 109.4° |
| O23 | P24 | O26 | 113.4° | 109.5° |
| O23 | P24 | O25 | 108.6° | 109.5° |
| O38 | P24 | O26 | 108.4° | 109.5° |
| O38 | P24 | O25 | 106.7° | 109.4° |
| O26 | P24 | O25 | 108.7° | 109.5° |
| P24 | O26 | C27 | 113.8° | 123.0° |
| P24 | O25 | H38 | 109.5° | 113.9° |
| O26 | C27 | C36 | 108.5° | 109.4° |
| O26 | C27 | C28 | 109.6° | 109.5° |
| O26 | C27 | H39 | 110.1° | 109.5° |
| O37 | C36 | C27 | 106.8° | 109.5° |
| O37 | C36 | C34 | 109.9° | 109.4° |
| O37 | C36 | H46 | 111.4° | 109.5° |
| C36 | O37 | H47 | 109.5° | 114.0° |
| C36 | C27 | C28 | 112.0° | 109.5° |
| C27 | C36 | C34 | 109.7° | 109.5° |
| C36 | C27 | H39 | 108.3° | 109.4° |
| C27 | C36 | H46 | 109.5° | 109.5° |
| C27 | C28 | O29 | 108.4° | 109.5° |
| C27 | C28 | C30 | 112.2° | 109.4° |
| C27 | C28 | H16 | 109.0° | 109.4° |
| C28 | C27 | H39 | 108.3° | 109.5° |
| C36 | C34 | O35 | 111.9° | 109.5° |
| C36 | C34 | C32 | 109.1° | 109.4° |
| C36 | C34 | H44 | 108.3° | 109.4° |
| C34 | C36 | H46 | 109.5° | 109.4° |
| O29 | C28 | C30 | 107.4° | 109.5° |
| O29 | C28 | H16 | 110.8° | 109.5° |
| C28 | O29 | H40 | 109.5° | 114.0° |
| C28 | C30 | C32 | 112.5° | 109.5° |
| C28 | C30 | O31 | 106.7° | 109.4° |
| C30 | C28 | H16 | 109.0° | 109.5° |
| C28 | C30 | H41 | 109.0° | 109.5° |
| O35 | C34 | C32 | 108.9° | 109.5° |
| O35 | C34 | H44 | 110.1° | 109.5° |
| C34 | O35 | H45 | 109.5° | 114.0° |
| C34 | C32 | C30 | 111.0° | 109.5° |
| C34 | C32 | O33 | 107.4° | 109.5° |
| C34 | C32 | H17 | 108.8° | 109.5° |
| C32 | C34 | H44 | 108.4° | 109.4° |
| C32 | C30 | O31 | 108.9° | 109.5° |
| C30 | C32 | O33 | 110.4° | 109.5° |
| C30 | C32 | H17 | 108.7° | 109.5° |
| C32 | C30 | H41 | 108.9° | 109.5° |
| O31 | C30 | H41 | 110.8° | 109.5° |
| C30 | O31 | H42 | 109.5° | 114.0° |
| O33 | C32 | H17 | 110.5° | 109.4° |
| C32 | O33 | H43 | 109.5° | 114.0° |
| H1 | C10 | H2 | 109.4° | 109.5° |
| H3 | C15 | H4 | 109.5° | 109.5° |
| H5 | C16 | H6 | 109.5° | 109.5° |
| H7 | C17 | H8 | 109.4° | 109.5° |
| H9 | C18 | H10 | 109.5° | 109.5° |
| H11 | C19 | H12 | 109.5° | 109.5° |
| H13 | C20 | H14 | 109.4° | 109.5° |
| H13 | C20 | H15 | 109.4° | 109.5° |
| H14 | C20 | H15 | 109.5° | 109.5° |
| H18 | C22 | H19 | 109.5° | 109.5° |
| H21 | C01 | H22 | 109.4° | 109.4° |
| H21 | C01 | H23 | 109.5° | 109.5° |
| H22 | C01 | H23 | 109.5° | 109.5° |
| H24 | C02 | H25 | 109.5° | 109.4° |
| H26 | C03 | H27 | 109.5° | 109.5° |
| H28 | C04 | H29 | 109.5° | 109.4° |
| H30 | C05 | H31 | 109.5° | 109.5° |
| H32 | C06 | H33 | 109.5° | 109.4° |
| H34 | C07 | H35 | 109.5° | 109.4° |
| H36 | C14 | H37 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | H24 | 120.3° | 120.1° |
| C01 | C02 | C03 | H25 | 120.3° | 120.0° |
| C01 | C02 | C03 | C04 | 11.6° | 180.0° |
| C02 | C01 | H21 | H22 | 120.0° | 119.9° |
| C02 | C01 | H21 | H23 | 120.0° | 120.0° |
| C02 | C01 | H22 | H23 | 120.0° | 120.0° |
| C01 | C02 | H24 | H25 | 119.0° | 120.0° |
| C01 | C02 | C03 | H26 | 108.6° | 59.9° |
| C01 | C02 | C03 | H27 | 131.8° | 60.1° |
| C02 | C03 | C04 | H26 | 120.2° | 120.1° |
| C02 | C03 | C04 | H27 | 120.2° | 119.9° |
| C02 | C03 | C04 | C05 | 163.3° | 180.0° |
| C03 | C02 | C01 | H21 | 180.0° | 60.0° |
| C03 | C02 | C01 | H22 | 60.0° | 59.9° |
| C03 | C02 | C01 | H23 | 60.0° | 180.0° |
| C03 | C02 | H24 | H25 | 119.0° | 120.0° |
| C02 | C03 | H26 | H27 | 119.3° | 120.0° |
| C02 | C03 | C04 | H28 | 43.0° | 59.9° |
| C02 | C03 | C04 | H29 | 76.3° | 60.1° |
| C03 | C04 | C05 | H28 | 120.3° | 120.1° |
| C03 | C04 | C05 | H29 | 120.3° | 120.0° |
| C03 | C04 | C05 | C06 | 150.6° | 180.0° |
| C04 | C03 | C02 | H24 | 131.9° | 59.9° |
| C04 | C03 | C02 | H25 | 108.7° | 60.0° |
| C04 | C03 | H26 | H27 | 119.3° | 120.0° |
| C03 | C04 | H28 | H29 | 119.0° | 120.0° |
| C03 | C04 | C05 | H30 | 30.2° | 60.0° |
| C03 | C04 | C05 | H31 | 89.0° | 60.1° |
| C04 | C05 | C06 | H30 | 120.4° | 120.1° |
| C04 | C05 | C06 | H31 | 120.4° | 120.0° |
| C04 | C05 | C06 | C07 | 21.8° | 180.0° |
| C05 | C04 | C03 | H26 | 76.5° | 59.9° |
| C05 | C04 | C03 | H27 | 43.1° | 60.1° |
| C05 | C04 | H28 | H29 | 119.0° | 119.9° |
| C04 | C05 | H30 | H31 | 118.8° | 120.0° |
| C04 | C05 | C06 | H32 | 98.7° | 59.9° |
| C04 | C05 | C06 | H33 | 142.2° | 60.0° |
| C05 | C06 | C07 | H32 | 120.4° | 120.0° |
| C05 | C06 | C07 | H33 | 120.4° | 120.0° |
| C05 | C06 | C07 | C08 | 109.1° | 180.0° |
| C06 | C05 | C04 | H28 | 89.1° | 59.9° |
| C06 | C05 | C04 | H29 | 30.2° | 60.0° |
| C06 | C05 | H30 | H31 | 118.8° | 119.9° |
| C05 | C06 | H32 | H33 | 118.7° | 119.9° |
| C05 | C06 | C07 | H34 | 11.2° | 59.9° |
| C05 | C06 | C07 | H35 | 130.6° | 60.0° |
| C20 | C19 | C18 | H11 | 120.4° | 120.0° |
| C20 | C19 | C18 | H12 | 120.4° | 120.1° |
| C20 | C19 | C18 | C17 | 70.4° | 180.0° |
| C20 | C19 | C18 | H9 | 49.8° | 60.0° |
| C20 | C19 | C18 | H10 | 169.4° | 59.9° |
| C20 | C19 | H11 | H12 | 118.8° | 120.0° |
| C19 | C20 | H13 | H14 | 120.0° | 120.0° |
| C19 | C20 | H13 | H15 | 120.0° | 120.0° |
| C19 | C20 | H14 | H15 | 120.0° | 120.0° |
| C19 | C18 | C17 | H9 | 120.2° | 120.0° |
| C19 | C18 | C17 | H10 | 120.2° | 120.0° |
| C19 | C18 | C17 | C16 | 90.4° | 180.0° |
| C19 | C18 | C17 | H7 | 29.8° | 60.0° |
| C19 | C18 | C17 | H8 | 149.3° | 60.0° |
| C19 | C18 | H9 | H10 | 119.4° | 120.0° |
| C18 | C19 | H11 | H12 | 118.9° | 120.0° |
| C18 | C19 | C20 | H13 | 180.0° | 180.0° |
| C18 | C19 | C20 | H14 | 60.0° | 60.0° |
| C18 | C19 | C20 | H15 | 60.0° | 60.0° |
| C06 | C07 | C08 | H34 | 120.3° | 120.0° |
| C06 | C07 | C08 | H35 | 120.3° | 120.0° |
| C06 | C07 | C08 | O39 | 47.3° | 0.0° |
| C06 | C07 | C08 | O09 | 132.8° | 180.0° |
| C07 | C06 | C05 | H30 | 142.1° | 60.0° |
| C07 | C06 | C05 | H31 | 98.6° | 60.0° |
| C07 | C06 | H32 | H33 | 118.7° | 120.0° |
| C06 | C07 | H34 | H35 | 119.0° | 119.9° |
| C07 | C08 | O39 | O09 | 179.9° | 180.0° |
| C07 | C08 | O09 | C10 | 174.7° | 180.0° |
| C08 | C07 | C06 | H32 | 130.5° | 60.0° |
| C08 | C07 | C06 | H33 | 11.3° | 60.0° |
| C08 | C07 | H34 | H35 | 119.0° | 120.0° |
| C18 | C17 | C16 | H7 | 120.2° | 120.0° |
| C18 | C17 | C16 | H8 | 120.2° | 120.1° |
| C18 | C17 | C16 | C15 | 145.8° | 180.0° |
| C18 | C17 | C16 | H5 | 93.4° | 60.0° |
| C18 | C17 | C16 | H6 | 25.0° | 59.9° |
| C18 | C17 | H7 | H8 | 119.3° | 120.0° |
| C17 | C18 | H9 | H10 | 119.4° | 120.0° |
| C17 | C18 | C19 | H11 | 169.3° | 60.0° |
| C17 | C18 | C19 | H12 | 50.0° | 59.9° |
| O39 | C08 | O09 | C10 | 5.5° | 0.0° |
| O39 | C08 | C07 | H34 | 73.0° | 120.0° |
| O39 | C08 | C07 | H35 | 167.6° | 120.0° |
| C08 | O09 | C10 | C11 | 104.7° | 180.0° |
| C08 | O09 | C10 | H1 | 15.4° | 60.0° |
| C08 | O09 | C10 | H2 | 135.2° | 60.0° |
| O09 | C08 | C07 | H34 | 106.9° | 60.0° |
| O09 | C08 | C07 | H35 | 12.5° | 60.0° |
| C17 | C16 | C15 | H5 | 120.7° | 120.0° |
| C17 | C16 | C15 | H6 | 120.8° | 120.0° |
| C17 | C16 | C15 | C14 | 172.9° | 180.0° |
| C17 | C16 | C15 | H3 | 52.6° | 60.0° |
| C17 | C16 | C15 | H4 | 66.8° | 60.0° |
| C17 | C16 | H5 | H6 | 117.6° | 120.0° |
| C16 | C17 | H7 | H8 | 119.3° | 120.0° |
| C16 | C17 | C18 | H9 | 149.4° | 60.0° |
| C16 | C17 | C18 | H10 | 29.8° | 60.0° |
| O09 | C10 | C11 | H1 | 120.1° | 119.9° |
| O09 | C10 | C11 | H2 | 120.1° | 120.0° |
| O09 | C10 | C11 | O12 | 95.7° | 65.0° |
| O09 | C10 | C11 | C22 | 147.0° | 55.0° |
| O09 | C10 | H1 | H2 | 119.7° | 120.1° |
| O09 | C10 | C11 | H20 | 27.8° | 175.1° |
| C16 | C15 | C14 | H3 | 120.3° | 120.0° |
| C16 | C15 | C14 | H4 | 120.3° | 120.0° |
| C16 | C15 | C14 | C13 | 85.7° | 180.0° |
| C16 | C15 | H3 | H4 | 119.1° | 120.0° |
| C15 | C16 | H5 | H6 | 117.6° | 120.0° |
| C15 | C16 | C17 | H7 | 25.6° | 60.0° |
| C15 | C16 | C17 | H8 | 93.9° | 59.9° |
| C16 | C15 | C14 | H36 | 34.5° | 60.0° |
| C16 | C15 | C14 | H37 | 154.1° | 60.0° |
| C10 | C11 | O12 | C22 | 115.6° | 120.0° |
| C10 | C11 | O12 | H20 | 122.3° | 119.9° |
| C10 | C11 | C22 | H20 | 119.1° | 120.0° |
| C10 | C11 | O12 | C13 | 137.3° | 150.0° |
| C10 | C11 | C22 | O23 | 113.6° | 55.0° |
| C11 | C10 | H1 | H2 | 119.7° | 120.0° |
| C10 | C11 | C22 | H18 | 126.5° | 65.0° |
| C10 | C11 | C22 | H19 | 6.3° | 175.0° |
| C15 | C14 | C13 | H36 | 120.2° | 120.1° |
| C15 | C14 | C13 | H37 | 120.2° | 120.1° |
| C15 | C14 | C13 | O12 | 78.0° | 180.0° |
| C15 | C14 | C13 | O21 | 99.4° | 0.0° |
| C14 | C15 | H3 | H4 | 119.1° | 120.0° |
| C14 | C15 | C16 | H5 | 66.4° | 60.0° |
| C14 | C15 | C16 | H6 | 52.1° | 60.0° |
| C15 | C14 | H36 | H37 | 119.4° | 120.0° |
| C14 | C13 | O12 | C11 | 109.9° | 180.0° |
| C14 | C13 | O12 | O21 | 177.3° | 180.0° |
| C13 | C14 | C15 | H3 | 154.0° | 60.0° |
| C13 | C14 | C15 | H4 | 34.6° | 60.0° |
| C13 | C14 | H36 | H37 | 119.4° | 119.9° |
| O12 | C11 | C22 | H20 | 123.1° | 120.0° |
| C11 | O12 | C13 | O21 | 72.8° | 0.1° |
| O12 | C11 | C22 | O23 | 128.6° | 65.0° |
| O12 | C11 | C10 | H1 | 24.4° | 54.9° |
| O12 | C11 | C10 | H2 | 144.2° | 174.9° |
| O12 | C11 | C22 | H18 | 8.8° | 175.0° |
| O12 | C11 | C22 | H19 | 111.5° | 55.0° |
| C22 | C11 | O12 | C13 | 107.1° | 90.0° |
| C11 | C22 | O23 | H18 | 119.9° | 120.0° |
| C11 | C22 | O23 | H19 | 119.9° | 120.0° |
| C11 | C22 | O23 | P24 | 95.8° | 180.0° |
| C22 | C11 | C10 | H1 | 92.9° | 174.9° |
| C22 | C11 | C10 | H2 | 26.9° | 65.0° |
| C11 | C22 | H18 | H19 | 120.3° | 120.0° |
| C13 | O12 | C11 | H20 | 15.0° | 30.1° |
| O12 | C13 | C14 | H36 | 42.2° | 60.0° |
| O12 | C13 | C14 | H37 | 161.8° | 59.9° |
| O21 | C13 | C14 | H36 | 140.5° | 120.0° |
| O21 | C13 | C14 | H37 | 20.9° | 120.1° |
| C22 | O23 | P24 | O38 | 85.7° | 55.0° |
| C22 | O23 | P24 | O26 | 36.5° | 175.0° |
| C22 | O23 | P24 | O25 | 157.5° | 65.0° |
| O23 | C22 | H18 | H19 | 120.4° | 120.0° |
| O23 | C22 | C11 | H20 | 5.5° | 175.0° |
| O23 | P24 | O38 | O26 | 125.0° | 120.0° |
| O23 | P24 | O38 | O25 | 118.0° | 120.0° |
| O23 | P24 | O26 | O25 | 120.9° | 120.1° |
| O23 | P24 | O26 | C27 | 167.2° | 175.0° |
| P24 | O23 | C22 | H18 | 24.1° | 60.0° |
| P24 | O23 | C22 | H19 | 144.3° | 60.0° |
| O23 | P24 | O25 | H38 | 119.5° | 60.0° |
| O38 | P24 | O26 | O25 | 115.6° | 120.0° |
| O38 | P24 | O26 | C27 | 69.3° | 55.1° |
| O38 | P24 | O25 | H38 | 0.0° | 180.0° |
| P24 | O26 | C27 | C36 | 115.8° | 120.1° |
| P24 | O26 | C27 | C28 | 121.6° | 120.0° |
| O26 | P24 | O25 | H38 | 116.7° | 60.0° |
| P24 | O26 | C27 | H39 | 2.6° | 0.1° |
| O25 | P24 | O26 | C27 | 46.3° | 64.9° |
| O26 | C27 | C36 | O37 | 61.9° | 60.0° |
| O26 | C27 | C36 | C28 | 121.1° | 120.0° |
| O26 | C27 | C36 | H39 | 119.5° | 120.0° |
| O26 | C27 | C28 | H39 | 120.1° | 120.1° |
| O26 | C27 | C36 | C34 | 179.0° | 180.0° |
| O26 | C27 | C28 | O29 | 53.3° | 60.0° |
| O26 | C27 | C28 | C30 | 171.8° | 180.0° |
| O26 | C27 | C28 | H16 | 67.4° | 60.0° |
| O26 | C27 | C36 | H46 | 58.8° | 60.0° |
| O37 | C36 | C27 | C34 | 119.1° | 120.0° |
| O37 | C36 | C27 | H46 | 120.7° | 120.0° |
| O37 | C36 | C27 | C28 | 177.0° | 180.0° |
| O37 | C36 | C34 | H46 | 122.6° | 120.0° |
| O37 | C36 | C34 | O35 | 60.7° | 60.0° |
| O37 | C36 | C34 | C32 | 178.7° | 179.9° |
| O37 | C36 | C27 | H39 | 57.6° | 60.0° |
| O37 | C36 | C34 | H44 | 60.9° | 60.0° |
| C36 | C27 | C28 | H39 | 119.5° | 120.0° |
| C27 | C36 | C34 | H46 | 120.2° | 120.0° |
| C36 | C27 | C28 | O29 | 67.1° | 60.0° |
| C36 | C27 | C28 | C30 | 51.4° | 60.0° |
| C27 | C36 | C34 | O35 | 177.9° | 180.0° |
| C27 | C36 | C34 | C32 | 61.5° | 60.0° |
| C36 | C27 | C28 | H16 | 172.2° | 180.0° |
| C27 | C36 | C34 | H44 | 56.3° | 60.0° |
| C27 | C36 | O37 | H47 | 74.5° | 179.9° |
| C28 | C27 | C36 | C34 | 57.9° | 60.0° |
| C27 | C28 | O29 | C30 | 121.5° | 120.0° |
| C27 | C28 | O29 | H16 | 119.5° | 120.0° |
| C27 | C28 | C30 | H16 | 120.8° | 119.9° |
| C27 | C28 | C30 | C32 | 48.8° | 60.0° |
| C27 | C28 | C30 | O31 | 168.1° | 180.0° |
| C27 | C28 | O29 | H40 | 180.0° | 180.0° |
| C27 | C28 | C30 | H41 | 72.2° | 60.0° |
| C28 | C27 | C36 | H46 | 62.3° | 60.0° |
| C36 | C34 | O35 | C32 | 120.7° | 120.0° |
| C36 | C34 | O35 | H44 | 120.5° | 120.0° |
| C36 | C34 | C32 | H44 | 117.8° | 119.9° |
| C36 | C34 | C32 | C30 | 59.3° | 60.0° |
| C36 | C34 | C32 | O33 | 179.9° | 180.0° |
| C36 | C34 | C32 | H17 | 60.3° | 60.0° |
| C34 | C36 | C27 | H39 | 61.5° | 60.0° |
| C36 | C34 | O35 | H45 | 180.0° | 180.0° |
| C34 | C36 | O37 | H47 | 166.5° | 60.1° |
| O29 | C28 | C30 | H16 | 120.1° | 120.1° |
| O29 | C28 | C30 | C32 | 70.3° | 60.0° |
| O29 | C28 | C30 | O31 | 49.0° | 60.0° |
| O29 | C28 | C27 | H39 | 173.5° | 180.0° |
| O29 | C28 | C30 | H41 | 168.7° | 180.0° |
| C28 | C30 | C32 | C34 | 53.3° | 60.0° |
| C28 | C30 | C32 | O31 | 118.0° | 119.9° |
| C28 | C30 | C32 | H41 | 121.0° | 120.0° |
| C28 | C30 | O31 | H41 | 118.5° | 120.0° |
| C28 | C30 | C32 | O33 | 172.3° | 179.9° |
| C28 | C30 | C32 | H17 | 66.4° | 60.0° |
| C30 | C28 | C27 | H39 | 68.0° | 59.9° |
| C30 | C28 | O29 | H40 | 58.5° | 60.0° |
| C28 | C30 | O31 | H42 | 180.0° | 180.0° |
| O35 | C34 | C32 | H44 | 119.8° | 120.0° |
| O35 | C34 | C32 | C30 | 178.3° | 180.0° |
| O35 | C34 | C32 | O33 | 57.5° | 60.0° |
| O35 | C34 | C32 | H17 | 62.1° | 60.0° |
| O35 | C34 | C36 | H46 | 61.9° | 59.9° |
| C34 | C32 | C30 | O33 | 119.0° | 120.0° |
| C34 | C32 | C30 | H17 | 119.7° | 120.0° |
| C34 | C32 | C30 | O31 | 171.3° | 180.0° |
| C34 | C32 | O33 | H17 | 118.5° | 120.0° |
| C34 | C32 | C30 | H41 | 67.7° | 60.0° |
| C34 | C32 | O33 | H43 | 180.0° | 60.0° |
| C32 | C34 | O35 | H45 | 59.3° | 60.0° |
| C32 | C34 | C36 | H46 | 58.7° | 60.1° |
| C32 | C30 | O31 | H41 | 119.8° | 120.0° |
| C30 | C32 | O33 | H17 | 120.3° | 119.9° |
| C32 | C30 | C28 | H16 | 169.6° | 180.0° |
| C32 | C30 | O31 | H42 | 58.3° | 60.1° |
| C30 | C32 | O33 | H43 | 58.8° | 180.0° |
| C30 | C32 | C34 | H44 | 58.5° | 60.0° |
| O31 | C30 | C32 | O33 | 69.7° | 60.0° |
| O31 | C30 | C28 | H16 | 71.1° | 60.1° |
| O31 | C30 | C32 | H17 | 51.6° | 59.9° |
| O33 | C32 | C30 | H41 | 51.2° | 60.0° |
| O33 | C32 | C34 | H44 | 62.3° | 60.1° |
| H1 | C10 | C11 | H20 | 147.9° | 65.0° |
| H2 | C10 | C11 | H20 | 92.3° | 55.0° |
| H3 | C15 | C16 | H5 | 173.4° | 60.0° |
| H3 | C15 | C16 | H6 | 68.2° | 180.0° |
| H3 | C15 | C14 | H36 | 85.8° | 180.0° |
| H3 | C15 | C14 | H37 | 33.8° | 60.0° |
| H4 | C15 | C16 | H5 | 53.9° | 180.0° |
| H4 | C15 | C16 | H6 | 172.4° | 60.0° |
| H4 | C15 | C14 | H36 | 154.8° | 60.0° |
| H4 | C15 | C14 | H37 | 85.6° | 180.0° |
| H5 | C16 | C17 | H7 | 146.3° | 180.0° |
| H5 | C16 | C17 | H8 | 26.8° | 60.0° |
| H6 | C16 | C17 | H7 | 95.2° | 60.0° |
| H6 | C16 | C17 | H8 | 145.3° | 180.0° |
| H7 | C17 | C18 | H9 | 90.4° | 180.0° |
| H7 | C17 | C18 | H10 | 150.0° | 60.0° |
| H8 | C17 | C18 | H9 | 29.1° | 60.0° |
| H8 | C17 | C18 | H10 | 90.5° | 180.0° |
| H9 | C18 | C19 | H11 | 70.5° | 180.0° |
| H9 | C18 | C19 | H12 | 170.2° | 60.0° |
| H10 | C18 | C19 | H11 | 49.1° | 60.0° |
| H10 | C18 | C19 | H12 | 70.2° | 180.0° |
| H11 | C19 | C20 | H13 | 59.6° | 60.0° |
| H11 | C19 | C20 | H14 | 60.4° | 180.0° |
| H11 | C19 | C20 | H15 | 179.6° | 60.0° |
| H12 | C19 | C20 | H13 | 59.6° | 60.0° |
| H12 | C19 | C20 | H14 | 179.6° | 60.0° |
| H12 | C19 | C20 | H15 | 60.4° | 180.0° |
| H13 | C20 | H14 | H15 | 119.9° | 120.0° |
| H16 | C28 | C27 | H39 | 52.7° | 60.0° |
| H16 | C28 | O29 | H40 | 60.4° | 60.0° |
| H16 | C28 | C30 | H41 | 48.6° | 59.9° |
| H17 | C32 | C30 | H41 | 172.6° | 180.0° |
| H17 | C32 | O33 | H43 | 61.5° | 60.1° |
| H17 | C32 | C34 | H44 | 178.1° | 180.0° |
| H18 | C22 | C11 | H20 | 114.4° | 55.0° |
| H19 | C22 | C11 | H20 | 125.4° | 65.0° |
| H21 | C01 | H22 | H23 | 120.0° | 120.0° |
| H21 | C01 | C02 | H24 | 59.7° | 60.1° |
| H21 | C01 | C02 | H25 | 59.7° | 180.0° |
| H22 | C01 | C02 | H24 | 60.3° | 180.0° |
| H22 | C01 | C02 | H25 | 179.6° | 60.1° |
| H23 | C01 | C02 | H24 | 179.7° | 59.9° |
| H23 | C01 | C02 | H25 | 60.4° | 60.0° |
| H24 | C02 | C03 | H26 | 11.7° | 180.0° |
| H24 | C02 | C03 | H27 | 107.9° | 60.0° |
| H25 | C02 | C03 | H26 | 131.1° | 60.1° |
| H25 | C02 | C03 | H27 | 11.5° | 180.0° |
| H26 | C03 | C04 | H28 | 163.2° | 180.0° |
| H26 | C03 | C04 | H29 | 43.9° | 60.0° |
| H27 | C03 | C04 | H28 | 77.2° | 60.0° |
| H27 | C03 | C04 | H29 | 163.5° | 180.0° |
| H28 | C04 | C05 | H30 | 150.5° | 180.0° |
| H28 | C04 | C05 | H31 | 31.3° | 60.0° |
| H29 | C04 | C05 | H30 | 90.2° | 60.0° |
| H29 | C04 | C05 | H31 | 150.6° | 179.9° |
| H30 | C05 | C06 | H32 | 21.7° | 180.0° |
| H30 | C05 | C06 | H33 | 97.4° | 60.1° |
| H31 | C05 | C06 | H32 | 141.0° | 60.0° |
| H31 | C05 | C06 | H33 | 21.8° | 180.0° |
| H32 | C06 | C07 | H34 | 109.2° | 180.0° |
| H32 | C06 | C07 | H35 | 10.1° | 60.0° |
| H33 | C06 | C07 | H34 | 131.6° | 60.1° |
| H33 | C06 | C07 | H35 | 109.0° | 180.0° |
| H39 | C27 | C36 | H46 | 178.3° | 180.0° |
| H41 | C30 | O31 | H42 | 61.5° | 59.9° |
| H44 | C34 | O35 | H45 | 59.5° | 60.0° |
| H44 | C34 | C36 | H46 | 176.5° | 180.0° |
| H46 | C36 | O37 | H47 | 45.0° | 59.9° |
