A1EFM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O34 | C33 | sing | 1.43Å | 1.40Å | |
| C33 | C31 | sing | 1.53Å | 1.53Å | |
| C31 | O32 | sing | 1.43Å | 1.40Å | |
| C31 | C30 | sing | 1.53Å | 1.52Å | |
| C30 | O29 | sing | 1.43Å | 1.40Å | |
| O29 | P27 | sing | 1.61Å | 1.64Å | |
| O35 | P27 | doub | 1.48Å | 1.51Å | |
| P27 | O28 | sing | 1.61Å | 1.51Å | |
| P27 | O26 | sing | 1.61Å | 1.64Å | |
| O26 | C25 | sing | 1.43Å | 1.40Å | |
| C25 | C12 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C11 | O10 | sing | 1.45Å | 1.40Å | |
| C12 | O13 | sing | 1.45Å | 1.40Å | |
| O13 | C14 | sing | 1.34Å | 1.40Å | |
| O36 | C09 | doub | 1.21Å | 1.18Å | |
| C14 | O24 | doub | 1.21Å | 1.18Å | |
| C14 | C15 | sing | 1.51Å | 1.52Å | |
| O10 | C09 | sing | 1.34Å | 1.40Å | |
| C09 | C08 | sing | 1.51Å | 1.52Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C08 | C07 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C07 | C06 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C06 | C05 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C05 | C04 | sing | 1.53Å | 1.53Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C04 | C03 | sing | 1.53Å | 1.53Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C03 | C02 | sing | 1.53Å | 1.53Å | |
| C21 | C22 | sing | 1.53Å | 1.53Å | |
| C02 | C01 | sing | 1.53Å | 1.53Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C15 | H1 | sing | 1.09Å | 1.10Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C22 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C01 | H13 | sing | 1.09Å | 1.10Å | |
| C02 | H14 | sing | 1.09Å | 1.10Å | |
| C02 | H15 | sing | 1.09Å | 1.10Å | |
| C03 | H16 | sing | 1.09Å | 1.10Å | |
| C03 | H17 | sing | 1.09Å | 1.10Å | |
| C04 | H18 | sing | 1.09Å | 1.10Å | |
| C04 | H19 | sing | 1.09Å | 1.10Å | |
| C05 | H20 | sing | 1.09Å | 1.10Å | |
| C05 | H21 | sing | 1.09Å | 1.10Å | |
| C06 | H22 | sing | 1.09Å | 1.10Å | |
| C06 | H23 | sing | 1.09Å | 1.10Å | |
| C07 | H24 | sing | 1.09Å | 1.10Å | |
| C07 | H25 | sing | 1.09Å | 1.10Å | |
| C08 | H26 | sing | 1.09Å | 1.10Å | |
| C08 | H27 | sing | 1.09Å | 1.10Å | |
| C11 | H28 | sing | 1.09Å | 1.10Å | |
| C11 | H29 | sing | 1.09Å | 1.10Å | |
| C12 | H30 | sing | 1.09Å | 1.10Å | |
| C16 | H31 | sing | 1.09Å | 1.10Å | |
| C16 | H32 | sing | 1.09Å | 1.10Å | |
| C18 | H33 | sing | 1.09Å | 1.10Å | |
| C18 | H34 | sing | 1.09Å | 1.10Å | |
| C19 | H35 | sing | 1.09Å | 1.10Å | |
| C19 | H36 | sing | 1.09Å | 1.10Å | |
| C23 | H37 | sing | 1.09Å | 1.10Å | |
| C23 | H38 | sing | 1.09Å | 1.10Å | |
| C23 | H39 | sing | 1.09Å | 1.10Å | |
| C25 | H40 | sing | 1.09Å | 1.10Å | |
| C25 | H41 | sing | 1.09Å | 1.10Å | |
| O28 | H42 | sing | 0.97Å | 0.95Å | |
| C30 | H43 | sing | 1.09Å | 1.10Å | |
| C30 | H44 | sing | 1.09Å | 1.10Å | |
| C31 | H45 | sing | 1.09Å | 1.10Å | |
| O32 | H46 | sing | 0.97Å | 0.95Å | |
| C33 | H47 | sing | 1.09Å | 1.10Å | |
| C33 | H48 | sing | 1.09Å | 1.10Å | |
| O34 | H49 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O34 | C33 | C31 | 109.0° | 109.4° |
| O34 | C33 | H47 | 109.6° | 109.5° |
| O34 | C33 | H48 | 109.6° | 109.5° |
| C33 | O34 | H49 | 109.5° | 114.0° |
| C33 | C31 | O32 | 108.1° | 109.5° |
| C33 | C31 | C30 | 111.9° | 109.4° |
| C33 | C31 | H45 | 109.3° | 109.5° |
| C31 | C33 | H47 | 109.6° | 109.5° |
| C31 | C33 | H48 | 109.6° | 109.5° |
| O32 | C31 | C30 | 106.9° | 109.5° |
| O32 | C31 | H45 | 111.2° | 109.5° |
| C31 | O32 | H46 | 109.5° | 114.0° |
| C31 | C30 | O29 | 107.0° | 109.4° |
| C31 | C30 | H43 | 110.1° | 109.5° |
| C31 | C30 | H44 | 110.1° | 109.5° |
| C30 | C31 | H45 | 109.4° | 109.5° |
| C30 | O29 | P27 | 118.0° | 123.0° |
| O29 | C30 | H43 | 110.1° | 109.4° |
| O29 | C30 | H44 | 110.1° | 109.5° |
| O29 | P27 | O35 | 109.7° | 109.5° |
| O29 | P27 | O28 | 109.6° | 109.5° |
| O29 | P27 | O26 | 108.3° | 109.4° |
| O35 | P27 | O28 | 109.8° | 109.5° |
| O35 | P27 | O26 | 109.9° | 109.5° |
| O28 | P27 | O26 | 109.6° | 109.5° |
| P27 | O28 | H42 | 109.5° | 114.0° |
| P27 | O26 | C25 | 117.6° | 123.0° |
| O26 | C25 | C12 | 107.4° | 109.5° |
| O26 | C25 | H40 | 110.0° | 109.5° |
| O26 | C25 | H41 | 110.0° | 109.5° |
| C25 | C12 | C11 | 108.9° | 109.5° |
| C25 | C12 | O13 | 109.1° | 109.5° |
| C25 | C12 | H30 | 109.1° | 109.5° |
| C12 | C25 | H40 | 110.0° | 109.4° |
| C12 | C25 | H41 | 110.0° | 109.5° |
| C12 | C11 | O10 | 107.6° | 109.5° |
| C11 | C12 | O13 | 109.6° | 109.4° |
| C12 | C11 | H28 | 110.0° | 109.5° |
| C12 | C11 | H29 | 110.0° | 109.5° |
| C11 | C12 | H30 | 109.1° | 109.5° |
| C11 | O10 | C09 | 113.9° | 117.0° |
| O10 | C11 | H28 | 109.9° | 109.4° |
| O10 | C11 | H29 | 109.9° | 109.5° |
| C12 | O13 | C14 | 113.1° | 117.0° |
| O13 | C12 | H30 | 110.9° | 109.5° |
| O13 | C14 | O24 | 120.1° | 120.0° |
| O13 | C14 | C15 | 120.2° | 120.0° |
| O36 | C09 | O10 | 120.3° | 120.0° |
| O36 | C09 | C08 | 120.2° | 119.9° |
| O24 | C14 | C15 | 119.7° | 120.0° |
| C14 | C15 | C16 | 111.5° | 109.5° |
| C14 | C15 | H1 | 109.0° | 109.5° |
| C14 | C15 | H2 | 108.9° | 109.5° |
| O10 | C09 | C08 | 119.5° | 120.0° |
| C09 | C08 | C07 | 111.8° | 109.5° |
| C09 | C08 | H26 | 108.9° | 109.4° |
| C09 | C08 | H27 | 108.9° | 109.5° |
| C15 | C16 | C17 | 111.8° | 109.5° |
| C16 | C15 | H1 | 108.9° | 109.5° |
| C16 | C15 | H2 | 109.0° | 109.4° |
| C15 | C16 | H31 | 108.9° | 109.5° |
| C15 | C16 | H32 | 108.8° | 109.4° |
| C08 | C07 | C06 | 112.1° | 109.5° |
| C08 | C07 | H24 | 108.8° | 109.4° |
| C08 | C07 | H25 | 108.8° | 109.5° |
| C07 | C08 | H26 | 108.8° | 109.5° |
| C07 | C08 | H27 | 108.9° | 109.5° |
| C16 | C17 | C18 | 112.1° | 109.5° |
| C16 | C17 | H3 | 108.8° | 109.5° |
| C16 | C17 | H4 | 108.8° | 109.4° |
| C17 | C16 | H31 | 108.9° | 109.5° |
| C17 | C16 | H32 | 108.9° | 109.5° |
| C07 | C06 | C05 | 112.2° | 109.5° |
| C07 | C06 | H22 | 108.8° | 109.4° |
| C07 | C06 | H23 | 108.8° | 109.5° |
| C06 | C07 | H24 | 108.8° | 109.5° |
| C06 | C07 | H25 | 108.8° | 109.5° |
| C17 | C18 | C19 | 111.8° | 109.5° |
| C18 | C17 | H3 | 108.8° | 109.5° |
| C18 | C17 | H4 | 108.8° | 109.5° |
| C17 | C18 | H33 | 108.9° | 109.5° |
| C17 | C18 | H34 | 108.9° | 109.4° |
| C06 | C05 | C04 | 111.6° | 109.5° |
| C06 | C05 | H20 | 108.9° | 109.5° |
| C06 | C05 | H21 | 108.9° | 109.5° |
| C05 | C06 | H22 | 108.8° | 109.5° |
| C05 | C06 | H23 | 108.8° | 109.5° |
| C18 | C19 | C20 | 112.0° | 109.5° |
| C19 | C18 | H33 | 108.9° | 109.5° |
| C19 | C18 | H34 | 108.9° | 109.5° |
| C18 | C19 | H35 | 108.8° | 109.4° |
| C18 | C19 | H36 | 108.8° | 109.4° |
| C05 | C04 | C03 | 112.3° | 109.5° |
| C05 | C04 | H18 | 108.8° | 109.5° |
| C05 | C04 | H19 | 108.8° | 109.5° |
| C04 | C05 | H20 | 108.9° | 109.4° |
| C04 | C05 | H21 | 108.9° | 109.5° |
| C19 | C20 | C21 | 111.9° | 109.5° |
| C19 | C20 | H5 | 108.9° | 109.4° |
| C19 | C20 | H6 | 108.9° | 109.5° |
| C20 | C19 | H35 | 108.8° | 109.5° |
| C20 | C19 | H36 | 108.8° | 109.5° |
| C04 | C03 | C02 | 112.3° | 109.4° |
| C04 | C03 | H16 | 108.7° | 109.5° |
| C04 | C03 | H17 | 108.8° | 109.5° |
| C03 | C04 | H18 | 108.7° | 109.5° |
| C03 | C04 | H19 | 108.8° | 109.5° |
| C20 | C21 | C22 | 112.2° | 109.5° |
| C21 | C20 | H5 | 108.8° | 109.4° |
| C21 | C20 | H6 | 108.8° | 109.5° |
| C20 | C21 | H7 | 108.7° | 109.5° |
| C20 | C21 | H8 | 108.8° | 109.4° |
| C03 | C02 | C01 | 112.2° | 109.5° |
| C03 | C02 | H14 | 108.8° | 109.5° |
| C03 | C02 | H15 | 108.8° | 109.4° |
| C02 | C03 | H16 | 108.8° | 109.5° |
| C02 | C03 | H17 | 108.8° | 109.5° |
| C21 | C22 | C23 | 112.2° | 109.5° |
| C22 | C21 | H7 | 108.8° | 109.5° |
| C22 | C21 | H8 | 108.8° | 109.5° |
| C21 | C22 | H9 | 108.8° | 109.5° |
| C21 | C22 | H10 | 108.8° | 109.4° |
| C02 | C01 | H11 | 109.5° | 109.5° |
| C02 | C01 | H12 | 109.5° | 109.5° |
| C02 | C01 | H13 | 109.4° | 109.5° |
| C01 | C02 | H14 | 108.8° | 109.5° |
| C01 | C02 | H15 | 108.8° | 109.5° |
| C23 | C22 | H9 | 108.8° | 109.5° |
| C23 | C22 | H10 | 108.8° | 109.5° |
| C22 | C23 | H37 | 109.5° | 109.5° |
| C22 | C23 | H38 | 109.5° | 109.5° |
| C22 | C23 | H39 | 109.5° | 109.5° |
| H1 | C15 | H2 | 109.5° | 109.5° |
| H3 | C17 | H4 | 109.5° | 109.5° |
| H5 | C20 | H6 | 109.5° | 109.5° |
| H7 | C21 | H8 | 109.5° | 109.4° |
| H9 | C22 | H10 | 109.4° | 109.5° |
| H11 | C01 | H12 | 109.4° | 109.5° |
| H11 | C01 | H13 | 109.5° | 109.4° |
| H12 | C01 | H13 | 109.5° | 109.5° |
| H14 | C02 | H15 | 109.5° | 109.5° |
| H16 | C03 | H17 | 109.5° | 109.5° |
| H18 | C04 | H19 | 109.5° | 109.5° |
| H20 | C05 | H21 | 109.5° | 109.5° |
| H22 | C06 | H23 | 109.5° | 109.4° |
| H24 | C07 | H25 | 109.5° | 109.5° |
| H26 | C08 | H27 | 109.5° | 109.5° |
| H28 | C11 | H29 | 109.5° | 109.5° |
| H31 | C16 | H32 | 109.5° | 109.4° |
| H33 | C18 | H34 | 109.5° | 109.5° |
| H35 | C19 | H36 | 109.4° | 109.5° |
| H37 | C23 | H38 | 109.5° | 109.5° |
| H37 | C23 | H39 | 109.5° | 109.5° |
| H38 | C23 | H39 | 109.4° | 109.4° |
| H40 | C25 | H41 | 109.5° | 109.5° |
| H43 | C30 | H44 | 109.5° | 109.5° |
| H47 | C33 | H48 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O34 | C33 | C31 | H47 | 120.0° | 120.1° |
| O34 | C33 | C31 | H48 | 119.9° | 120.0° |
| O34 | C33 | C31 | O32 | 35.1° | 65.1° |
| O34 | C33 | C31 | C30 | 152.6° | 175.0° |
| O34 | C33 | C31 | H45 | 86.1° | 55.0° |
| O34 | C33 | H47 | H48 | 120.2° | 120.0° |
| C33 | C31 | O32 | C30 | 120.6° | 120.0° |
| C33 | C31 | O32 | H45 | 120.0° | 120.1° |
| C33 | C31 | C30 | H45 | 121.3° | 120.0° |
| C33 | C31 | C30 | O29 | 41.5° | 175.1° |
| C33 | C31 | C30 | H43 | 161.1° | 65.0° |
| C33 | C31 | C30 | H44 | 78.1° | 55.0° |
| C33 | C31 | O32 | H46 | 180.0° | 59.9° |
| C31 | C33 | H47 | H48 | 120.2° | 120.0° |
| C31 | C33 | O34 | H49 | 180.0° | 180.0° |
| O32 | C31 | C30 | H45 | 120.5° | 120.0° |
| O32 | C31 | C30 | O29 | 76.8° | 65.0° |
| O32 | C31 | C30 | H43 | 42.9° | 55.0° |
| O32 | C31 | C30 | H44 | 163.6° | 175.0° |
| O32 | C31 | C33 | H47 | 155.1° | 55.0° |
| O32 | C31 | C33 | H48 | 84.8° | 175.0° |
| C31 | C30 | O29 | H43 | 119.6° | 120.0° |
| C31 | C30 | O29 | H44 | 119.6° | 120.0° |
| C31 | C30 | O29 | P27 | 164.7° | 180.0° |
| C31 | C30 | H43 | H44 | 121.1° | 120.0° |
| C30 | C31 | O32 | H46 | 59.4° | 60.0° |
| C30 | C31 | C33 | H47 | 87.4° | 65.0° |
| C30 | C31 | C33 | H48 | 32.7° | 55.0° |
| C30 | O29 | P27 | O35 | 69.9° | 55.0° |
| C30 | O29 | P27 | O28 | 169.5° | 65.1° |
| C30 | O29 | P27 | O26 | 50.0° | 175.0° |
| O29 | C30 | H43 | H44 | 121.2° | 120.0° |
| O29 | C30 | C31 | H45 | 162.7° | 55.0° |
| O29 | P27 | O35 | O28 | 120.5° | 120.0° |
| O29 | P27 | O35 | O26 | 118.9° | 120.0° |
| O29 | P27 | O28 | O26 | 118.7° | 120.0° |
| O29 | P27 | O26 | C25 | 114.6° | 175.0° |
| O29 | P27 | O28 | H42 | 120.6° | 60.0° |
| P27 | O29 | C30 | H43 | 75.7° | 60.0° |
| P27 | O29 | C30 | H44 | 45.1° | 60.0° |
| O35 | P27 | O28 | O26 | 120.8° | 120.0° |
| O35 | P27 | O26 | C25 | 125.6° | 54.9° |
| O35 | P27 | O28 | H42 | 0.0° | 180.0° |
| O28 | P27 | O26 | C25 | 4.8° | 65.1° |
| P27 | O26 | C25 | C12 | 179.1° | 180.0° |
| P27 | O26 | C25 | H40 | 59.4° | 60.1° |
| P27 | O26 | C25 | H41 | 61.3° | 60.0° |
| O26 | P27 | O28 | H42 | 120.8° | 60.0° |
| O26 | C25 | C12 | H40 | 119.7° | 120.0° |
| O26 | C25 | C12 | H41 | 119.7° | 120.1° |
| O26 | C25 | C12 | C11 | 61.1° | 54.9° |
| O26 | C25 | C12 | O13 | 58.5° | 65.0° |
| O26 | C25 | C12 | H30 | 179.8° | 175.0° |
| O26 | C25 | H40 | H41 | 121.0° | 120.1° |
| C25 | C12 | C11 | O13 | 119.3° | 120.0° |
| C25 | C12 | C11 | H30 | 119.1° | 120.0° |
| C25 | C12 | C11 | O10 | 150.9° | 54.9° |
| C25 | C12 | O13 | H30 | 120.2° | 120.0° |
| C25 | C12 | O13 | C14 | 124.1° | 90.0° |
| C25 | C12 | C11 | H28 | 31.2° | 65.0° |
| C25 | C12 | C11 | H29 | 89.5° | 175.0° |
| C12 | C25 | H40 | H41 | 120.9° | 119.9° |
| C12 | C11 | O10 | H28 | 119.7° | 120.0° |
| C12 | C11 | O10 | H29 | 119.7° | 120.0° |
| C11 | C12 | O13 | H30 | 120.5° | 120.0° |
| C11 | C12 | O13 | C14 | 116.7° | 150.0° |
| C12 | C11 | O10 | C09 | 177.9° | 180.0° |
| C12 | C11 | H28 | H29 | 120.9° | 120.0° |
| C11 | C12 | C25 | H40 | 179.2° | 65.0° |
| C11 | C12 | C25 | H41 | 58.5° | 175.0° |
| O10 | C11 | C12 | O13 | 89.8° | 65.0° |
| C11 | O10 | C09 | O36 | 19.2° | 0.1° |
| C11 | O10 | C09 | C08 | 161.0° | 180.0° |
| O10 | C11 | H28 | H29 | 120.9° | 120.0° |
| O10 | C11 | C12 | H30 | 31.8° | 175.0° |
| C12 | O13 | C14 | O24 | 50.3° | 0.0° |
| C12 | O13 | C14 | C15 | 129.5° | 180.0° |
| O13 | C12 | C11 | H28 | 150.5° | 175.0° |
| O13 | C12 | C11 | H29 | 29.8° | 55.0° |
| O13 | C12 | C25 | H40 | 61.2° | 175.0° |
| O13 | C12 | C25 | H41 | 178.1° | 55.1° |
| O13 | C14 | O24 | C15 | 179.9° | 180.0° |
| O13 | C14 | C15 | C16 | 169.0° | 180.0° |
| O13 | C14 | C15 | H1 | 48.7° | 60.0° |
| O13 | C14 | C15 | H2 | 70.6° | 60.0° |
| C14 | O13 | C12 | H30 | 3.9° | 30.0° |
| O36 | C09 | O10 | C08 | 179.8° | 179.9° |
| O36 | C09 | C08 | C07 | 140.7° | 0.1° |
| O36 | C09 | C08 | H26 | 98.9° | 120.0° |
| O36 | C09 | C08 | H27 | 20.4° | 120.0° |
| O24 | C14 | C15 | C16 | 10.8° | 0.0° |
| O24 | C14 | C15 | H1 | 131.1° | 120.0° |
| O24 | C14 | C15 | H2 | 109.5° | 120.0° |
| C14 | C15 | C16 | H1 | 120.3° | 120.0° |
| C14 | C15 | C16 | H2 | 120.3° | 120.0° |
| C14 | C15 | C16 | C17 | 147.1° | 180.0° |
| C14 | C15 | H1 | H2 | 119.0° | 120.0° |
| C14 | C15 | C16 | H31 | 92.5° | 60.0° |
| C14 | C15 | C16 | H32 | 26.8° | 60.0° |
| O10 | C09 | C08 | C07 | 39.1° | 180.0° |
| O10 | C09 | C08 | H26 | 81.3° | 60.0° |
| O10 | C09 | C08 | H27 | 159.4° | 60.0° |
| C09 | O10 | C11 | H28 | 58.2° | 60.0° |
| C09 | O10 | C11 | H29 | 62.4° | 60.0° |
| C09 | C08 | C07 | H26 | 120.3° | 119.9° |
| C09 | C08 | C07 | H27 | 120.4° | 120.0° |
| C09 | C08 | C07 | C06 | 178.7° | 180.0° |
| C09 | C08 | C07 | H24 | 58.3° | 60.0° |
| C09 | C08 | C07 | H25 | 60.9° | 60.0° |
| C09 | C08 | H26 | H27 | 118.9° | 120.0° |
| C15 | C16 | C17 | H31 | 120.4° | 120.0° |
| C15 | C16 | C17 | H32 | 120.3° | 120.0° |
| C15 | C16 | C17 | C18 | 161.4° | 180.0° |
| C16 | C15 | H1 | H2 | 119.1° | 120.0° |
| C15 | C16 | C17 | H3 | 41.0° | 59.9° |
| C15 | C16 | C17 | H4 | 78.2° | 60.0° |
| C15 | C16 | H31 | H32 | 118.9° | 119.9° |
| C08 | C07 | C06 | H24 | 120.4° | 119.9° |
| C08 | C07 | C06 | H25 | 120.4° | 120.0° |
| C08 | C07 | C06 | C05 | 156.2° | 180.0° |
| C08 | C07 | C06 | H22 | 83.5° | 60.0° |
| C08 | C07 | C06 | H23 | 35.8° | 60.0° |
| C08 | C07 | H24 | H25 | 118.8° | 120.0° |
| C07 | C08 | H26 | H27 | 118.9° | 120.0° |
| C16 | C17 | C18 | H3 | 120.4° | 120.1° |
| C16 | C17 | C18 | H4 | 120.4° | 119.9° |
| C16 | C17 | C18 | C19 | 127.2° | 180.0° |
| C17 | C16 | C15 | H1 | 26.8° | 59.9° |
| C17 | C16 | C15 | H2 | 92.6° | 60.0° |
| C16 | C17 | H3 | H4 | 118.8° | 119.9° |
| C17 | C16 | H31 | H32 | 118.9° | 120.0° |
| C16 | C17 | C18 | H33 | 112.5° | 59.9° |
| C16 | C17 | C18 | H34 | 6.8° | 60.1° |
| C07 | C06 | C05 | H22 | 120.4° | 120.0° |
| C07 | C06 | C05 | H23 | 120.4° | 120.0° |
| C07 | C06 | C05 | C04 | 116.2° | NaN° |
| C07 | C06 | C05 | H20 | 123.5° | 60.0° |
| C07 | C06 | C05 | H21 | 4.1° | 60.0° |
| C07 | C06 | H22 | H23 | 118.8° | 120.0° |
| C06 | C07 | H24 | H25 | 118.8° | 120.0° |
| C06 | C07 | C08 | H26 | 61.0° | 60.1° |
| C06 | C07 | C08 | H27 | 58.3° | 60.0° |
| C17 | C18 | C19 | H33 | 120.4° | 120.0° |
| C17 | C18 | C19 | H34 | 120.4° | 120.0° |
| C17 | C18 | C19 | C20 | 142.3° | 180.0° |
| C18 | C17 | H3 | H4 | 118.8° | 120.0° |
| C18 | C17 | C16 | H31 | 78.2° | 60.0° |
| C18 | C17 | C16 | H32 | 41.1° | 60.0° |
| C17 | C18 | H33 | H34 | 119.0° | 120.0° |
| C17 | C18 | C19 | H35 | 97.3° | 60.0° |
| C17 | C18 | C19 | H36 | 21.9° | 59.9° |
| C06 | C05 | C04 | H20 | 120.3° | 120.0° |
| C06 | C05 | C04 | H21 | 120.4° | 120.0° |
| C06 | C05 | C04 | C03 | 130.0° | 180.0° |
| C06 | C05 | C04 | H18 | 109.5° | 60.0° |
| C06 | C05 | C04 | H19 | 9.6° | 60.0° |
| C06 | C05 | H20 | H21 | 119.0° | 120.0° |
| C05 | C06 | H22 | H23 | 118.7° | 120.0° |
| C05 | C06 | C07 | H24 | 35.7° | 60.0° |
| C05 | C06 | C07 | H25 | 83.5° | 60.0° |
| C18 | C19 | C20 | H35 | 120.4° | 120.0° |
| C18 | C19 | C20 | H36 | 120.4° | 120.0° |
| C18 | C19 | C20 | C21 | 107.3° | 180.0° |
| C19 | C18 | C17 | H3 | 6.8° | 60.0° |
| C19 | C18 | C17 | H4 | 112.5° | 60.1° |
| C18 | C19 | C20 | H5 | 132.4° | 60.0° |
| C18 | C19 | C20 | H6 | 13.1° | 60.0° |
| C19 | C18 | H33 | H34 | 118.9° | 120.0° |
| C18 | C19 | H35 | H36 | 118.8° | 119.9° |
| C05 | C04 | C03 | H18 | 120.4° | 120.0° |
| C05 | C04 | C03 | H19 | 120.4° | 120.0° |
| C05 | C04 | C03 | C02 | 173.0° | 180.0° |
| C05 | C04 | C03 | H16 | 66.6° | 60.1° |
| C05 | C04 | C03 | H17 | 52.5° | 60.0° |
| C05 | C04 | H18 | H19 | 118.7° | 120.0° |
| C04 | C05 | H20 | H21 | 119.0° | 120.0° |
| C04 | C05 | C06 | H22 | 4.2° | 60.0° |
| C04 | C05 | C06 | H23 | 123.4° | 60.0° |
| C19 | C20 | C21 | H5 | 120.4° | 119.9° |
| C19 | C20 | C21 | H6 | 120.4° | 120.0° |
| C19 | C20 | C21 | C22 | 169.0° | 180.0° |
| C19 | C20 | H5 | H6 | 118.9° | 120.0° |
| C19 | C20 | C21 | H7 | 70.6° | 59.9° |
| C19 | C20 | C21 | H8 | 48.6° | 60.0° |
| C20 | C19 | C18 | H33 | 22.0° | 60.0° |
| C20 | C19 | C18 | H34 | 97.3° | 60.0° |
| C20 | C19 | H35 | H36 | 118.8° | 120.1° |
| C04 | C03 | C02 | H16 | 120.4° | 120.0° |
| C04 | C03 | C02 | H17 | 120.4° | 120.0° |
| C04 | C03 | C02 | C01 | 171.2° | 180.0° |
| C04 | C03 | C02 | H14 | 68.5° | 60.0° |
| C04 | C03 | C02 | H15 | 50.8° | 60.0° |
| C04 | C03 | H16 | H17 | 118.7° | 120.0° |
| C03 | C04 | H18 | H19 | 118.7° | 120.0° |
| C03 | C04 | C05 | H20 | 9.7° | 60.0° |
| C03 | C04 | C05 | H21 | 109.6° | 60.0° |
| C20 | C21 | C22 | H7 | 120.4° | 120.1° |
| C20 | C21 | C22 | H8 | 120.4° | 120.0° |
| C20 | C21 | C22 | C23 | 167.8° | 180.0° |
| C21 | C20 | H5 | H6 | 118.9° | 120.0° |
| C20 | C21 | H7 | H8 | 118.7° | 119.9° |
| C20 | C21 | C22 | H9 | 71.8° | 59.9° |
| C20 | C21 | C22 | H10 | 47.3° | 60.1° |
| C21 | C20 | C19 | H35 | 13.1° | 60.1° |
| C21 | C20 | C19 | H36 | 132.3° | 60.0° |
| C03 | C02 | C01 | H14 | 120.4° | 120.0° |
| C03 | C02 | C01 | H15 | 120.4° | 119.9° |
| C03 | C02 | C01 | H11 | 180.0° | 180.0° |
| C03 | C02 | C01 | H12 | 60.0° | 60.0° |
| C03 | C02 | C01 | H13 | 60.0° | 60.0° |
| C03 | C02 | H14 | H15 | 118.8° | 120.0° |
| C02 | C03 | H16 | H17 | 118.7° | 120.0° |
| C02 | C03 | C04 | H18 | 52.5° | 60.0° |
| C02 | C03 | C04 | H19 | 66.6° | 60.0° |
| C21 | C22 | C23 | H9 | 120.4° | 120.0° |
| C21 | C22 | C23 | H10 | 120.4° | 120.0° |
| C22 | C21 | C20 | H5 | 48.6° | 60.1° |
| C22 | C21 | C20 | H6 | 70.6° | 60.0° |
| C22 | C21 | H7 | H8 | 118.8° | 120.0° |
| C21 | C22 | H9 | H10 | 118.7° | 120.0° |
| C21 | C22 | C23 | H37 | 180.0° | 180.0° |
| C21 | C22 | C23 | H38 | 60.0° | 60.0° |
| C21 | C22 | C23 | H39 | 60.0° | 60.0° |
| C02 | C01 | H11 | H12 | 120.0° | 120.0° |
| C02 | C01 | H11 | H13 | 120.0° | 120.0° |
| C02 | C01 | H12 | H13 | 120.0° | 120.0° |
| C01 | C02 | H14 | H15 | 118.8° | 120.0° |
| C01 | C02 | C03 | H16 | 50.7° | 60.0° |
| C01 | C02 | C03 | H17 | 68.4° | 60.0° |
| C23 | C22 | C21 | H7 | 47.4° | 60.0° |
| C23 | C22 | C21 | H8 | 71.8° | 60.0° |
| C23 | C22 | H9 | H10 | 118.7° | 120.0° |
| C22 | C23 | H37 | H38 | 120.0° | 120.0° |
| C22 | C23 | H37 | H39 | 120.0° | 120.0° |
| C22 | C23 | H38 | H39 | 120.0° | 120.0° |
| H1 | C15 | C16 | H31 | 147.2° | 180.0° |
| H1 | C15 | C16 | H32 | 93.5° | 60.0° |
| H2 | C15 | C16 | H31 | 27.8° | 60.0° |
| H2 | C15 | C16 | H32 | 147.1° | 180.0° |
| H3 | C17 | C16 | H31 | 161.4° | 180.0° |
| H3 | C17 | C16 | H32 | 79.3° | 60.1° |
| H3 | C17 | C18 | H33 | 127.1° | 180.0° |
| H3 | C17 | C18 | H34 | 113.6° | 60.0° |
| H4 | C17 | C16 | H31 | 42.2° | 60.0° |
| H4 | C17 | C16 | H32 | 161.5° | 180.0° |
| H4 | C17 | C18 | H33 | 7.9° | 59.9° |
| H4 | C17 | C18 | H34 | 127.2° | 179.9° |
| H5 | C20 | C21 | H7 | 169.0° | 60.0° |
| H5 | C20 | C21 | H8 | 71.8° | 179.9° |
| H5 | C20 | C19 | H35 | 107.2° | 180.0° |
| H5 | C20 | C19 | H36 | 12.0° | 60.0° |
| H6 | C20 | C21 | H7 | 49.8° | 180.0° |
| H6 | C20 | C21 | H8 | 168.9° | 60.1° |
| H6 | C20 | C19 | H35 | 133.5° | 60.0° |
| H6 | C20 | C19 | H36 | 107.3° | 180.0° |
| H7 | C21 | C22 | H9 | 167.8° | 180.0° |
| H7 | C21 | C22 | H10 | 73.0° | 60.0° |
| H8 | C21 | C22 | H9 | 48.6° | 60.0° |
| H8 | C21 | C22 | H10 | 167.7° | 180.0° |
| H9 | C22 | C23 | H37 | 59.6° | 60.0° |
| H9 | C22 | C23 | H38 | 179.6° | 180.0° |
| H9 | C22 | C23 | H39 | 60.4° | 60.0° |
| H10 | C22 | C23 | H37 | 59.6° | 60.0° |
| H10 | C22 | C23 | H38 | 60.5° | 60.0° |
| H10 | C22 | C23 | H39 | 179.6° | 179.9° |
| H11 | C01 | H12 | H13 | 120.0° | 120.0° |
| H11 | C01 | C02 | H14 | 59.6° | 60.1° |
| H11 | C01 | C02 | H15 | 59.6° | 60.0° |
| H12 | C01 | C02 | H14 | 179.6° | 60.0° |
| H12 | C01 | C02 | H15 | 60.4° | 179.9° |
| H13 | C01 | C02 | H14 | 60.4° | 180.0° |
| H13 | C01 | C02 | H15 | 179.6° | 60.0° |
| H14 | C02 | C03 | H16 | 171.1° | 180.0° |
| H14 | C02 | C03 | H17 | 52.0° | 60.0° |
| H15 | C02 | C03 | H16 | 69.7° | 60.0° |
| H15 | C02 | C03 | H17 | 171.2° | 180.0° |
| H16 | C03 | C04 | H18 | 172.9° | 180.0° |
| H16 | C03 | C04 | H19 | 53.8° | 60.0° |
| H17 | C03 | C04 | H18 | 67.9° | 60.0° |
| H17 | C03 | C04 | H19 | 172.9° | 180.0° |
| H18 | C04 | C05 | H20 | 130.1° | 180.0° |
| H18 | C04 | C05 | H21 | 10.8° | 60.0° |
| H19 | C04 | C05 | H20 | 110.7° | 60.0° |
| H19 | C04 | C05 | H21 | 130.0° | 180.0° |
| H20 | C05 | C06 | H22 | 116.1° | 180.0° |
| H20 | C05 | C06 | H23 | 3.0° | 60.0° |
| H21 | C05 | C06 | H22 | 124.5° | 60.0° |
| H21 | C05 | C06 | H23 | 116.3° | 180.0° |
| H22 | C06 | C07 | H24 | 156.1° | 179.9° |
| H22 | C06 | C07 | H25 | 36.9° | 60.0° |
| H23 | C06 | C07 | H24 | 84.6° | 60.0° |
| H23 | C06 | C07 | H25 | 156.1° | 180.0° |
| H24 | C07 | C08 | H26 | 178.6° | 179.9° |
| H24 | C07 | C08 | H27 | 62.1° | 60.0° |
| H25 | C07 | C08 | H26 | 59.4° | 60.0° |
| H25 | C07 | C08 | H27 | 178.7° | 180.0° |
| H28 | C11 | C12 | H30 | 87.9° | 55.0° |
| H29 | C11 | C12 | H30 | 151.5° | 65.0° |
| H30 | C12 | C25 | H40 | 60.1° | 55.0° |
| H30 | C12 | C25 | H41 | 60.5° | 65.0° |
| H33 | C18 | C19 | H35 | 142.4° | 60.0° |
| H33 | C18 | C19 | H36 | 98.4° | 180.0° |
| H34 | C18 | C19 | H35 | 23.1° | 180.0° |
| H34 | C18 | C19 | H36 | 142.3° | 60.0° |
| H37 | C23 | H38 | H39 | 120.0° | 120.0° |
| H43 | C30 | C31 | H45 | 77.7° | 175.0° |
| H44 | C30 | C31 | H45 | 43.1° | 65.0° |
| H45 | C31 | O32 | H46 | 60.0° | 180.0° |
| H45 | C31 | C33 | H47 | 33.9° | 175.0° |
| H45 | C31 | C33 | H48 | 154.0° | 65.0° |
| H47 | C33 | O34 | H49 | 60.1° | 60.0° |
| H48 | C33 | O34 | H49 | 60.1° | 60.0° |
