9UB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O43 | C41 | doub | 1.21Å | 1.19Å | |
| O34 | C33 | sing | 1.43Å | 1.42Å | |
| C41 | C42 | sing | 1.51Å | 1.53Å | |
| C41 | N40 | sing | 1.35Å | 1.45Å | |
| C39 | N40 | sing | 1.47Å | 1.48Å | |
| C39 | C30 | sing | 1.53Å | 1.52Å | |
| C39 | C37 | sing | 1.53Å | 1.46Å | |
| C33 | C32 | sing | 1.53Å | 1.51Å | |
| O31 | C30 | sing | 1.43Å | 1.48Å | |
| O31 | C32 | sing | 1.43Å | 1.48Å | |
| C30 | C29 | sing | 1.53Å | 1.50Å | |
| O38 | C37 | sing | 1.43Å | 1.47Å | |
| C35 | C37 | sing | 1.53Å | 1.49Å | |
| C35 | C32 | sing | 1.53Å | 1.54Å | |
| C35 | O36 | sing | 1.43Å | 1.44Å | |
| O28 | P26 | doub | 1.48Å | 1.50Å | |
| C29 | P26 | sing | 1.82Å | 1.91Å | |
| O23 | P22 | doub | 1.48Å | 1.51Å | |
| P26 | O25 | sing | 1.61Å | 1.67Å | |
| P26 | O27 | sing | 1.61Å | 1.51Å | |
| O25 | P22 | sing | 1.61Å | 1.67Å | |
| P22 | O24 | sing | 1.61Å | 1.51Å | |
| P22 | O21 | sing | 1.61Å | 1.64Å | |
| O21 | C20 | sing | 1.43Å | 1.40Å | |
| C20 | C19 | sing | 1.51Å | 1.55Å | |
| C19 | C17 | doub | 1.31Å | 1.35Å | |
| C13 | C12 | sing | 1.51Å | 1.53Å | |
| C14 | C12 | doub | 1.31Å | 1.32Å | |
| C14 | C15 | sing | 1.51Å | 1.52Å | |
| C17 | C16 | sing | 1.51Å | 1.56Å | |
| C17 | C18 | sing | 1.51Å | 1.56Å | |
| C16 | C15 | sing | 1.53Å | 1.55Å | |
| C12 | C11 | sing | 1.51Å | 1.56Å | |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| C10 | C09 | sing | 1.51Å | 1.55Å | |
| C09 | C07 | doub | 1.31Å | 1.36Å | |
| C07 | C06 | sing | 1.51Å | 1.57Å | |
| C07 | C08 | sing | 1.51Å | 1.55Å | |
| C03 | C02 | sing | 1.51Å | 1.54Å | |
| C06 | C05 | sing | 1.53Å | 1.53Å | |
| C04 | C02 | doub | 1.31Å | 1.31Å | |
| C04 | C05 | sing | 1.51Å | 1.52Å | |
| C02 | C01 | sing | 1.51Å | 1.54Å | |
| C30 | H1 | sing | 1.09Å | 1.10Å | |
| C29 | H2 | sing | 1.09Å | 1.10Å | |
| C29 | H3 | sing | 1.09Å | 1.10Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.08Å | 1.08Å | |
| C08 | H20 | sing | 1.09Å | 1.10Å | |
| C08 | H21 | sing | 1.09Å | 1.10Å | |
| C08 | H22 | sing | 1.09Å | 1.10Å | |
| C06 | H23 | sing | 1.09Å | 1.10Å | |
| C06 | H24 | sing | 1.09Å | 1.10Å | |
| C05 | H25 | sing | 1.09Å | 1.10Å | |
| C05 | H26 | sing | 1.09Å | 1.10Å | |
| C04 | H27 | sing | 1.08Å | 1.08Å | |
| C03 | H28 | sing | 1.09Å | 1.10Å | |
| C03 | H29 | sing | 1.09Å | 1.10Å | |
| C03 | H30 | sing | 1.09Å | 1.10Å | |
| C01 | H31 | sing | 1.09Å | 1.10Å | |
| C01 | H32 | sing | 1.09Å | 1.10Å | |
| C01 | H33 | sing | 1.09Å | 1.10Å | |
| C10 | H34 | sing | 1.09Å | 1.10Å | |
| C10 | H35 | sing | 1.09Å | 1.10Å | |
| C19 | H36 | sing | 1.08Å | 1.08Å | |
| O24 | H37 | sing | 0.97Å | 0.95Å | |
| O27 | H38 | sing | 0.97Å | 0.95Å | |
| C32 | H39 | sing | 1.09Å | 1.10Å | |
| C33 | H40 | sing | 1.09Å | 1.10Å | |
| C33 | H41 | sing | 1.09Å | 1.10Å | |
| O34 | H42 | sing | 0.97Å | 0.95Å | |
| C35 | H43 | sing | 1.09Å | 1.10Å | |
| O36 | H44 | sing | 0.97Å | 0.95Å | |
| C37 | H45 | sing | 1.09Å | 1.10Å | |
| O38 | H46 | sing | 0.97Å | 0.95Å | |
| C39 | H47 | sing | 1.09Å | 1.10Å | |
| N40 | H48 | sing | 0.97Å | 1.00Å | |
| C42 | H49 | sing | 1.09Å | 1.10Å | |
| C42 | H50 | sing | 1.09Å | 1.10Å | |
| C42 | H51 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O43 | C41 | C42 | 122.2° | 120.0° |
| O43 | C41 | N40 | 118.6° | 120.0° |
| O34 | C33 | C32 | 106.8° | 109.5° |
| O34 | C33 | H40 | 110.2° | 109.5° |
| O34 | C33 | H41 | 110.1° | 109.5° |
| C33 | O34 | H42 | 109.5° | 114.0° |
| C42 | C41 | N40 | 119.2° | 120.0° |
| C41 | C42 | H49 | 109.5° | 109.5° |
| C41 | C42 | H50 | 109.5° | 109.5° |
| C41 | C42 | H51 | 109.5° | 109.5° |
| C41 | N40 | C39 | 116.8° | 120.0° |
| C41 | N40 | H48 | 121.6° | 120.0° |
| N40 | C39 | C30 | 110.3° | 109.6° |
| N40 | C39 | C37 | 107.4° | 109.5° |
| N40 | C39 | H47 | 109.6° | 109.5° |
| C39 | N40 | H48 | 121.6° | 120.0° |
| C30 | C39 | C37 | 110.6° | 109.2° |
| C39 | C30 | O31 | 111.0° | 109.4° |
| C39 | C30 | C29 | 109.9° | 109.4° |
| C39 | C30 | H1 | 108.2° | 109.5° |
| C30 | C39 | H47 | 109.1° | 109.5° |
| C39 | C37 | O38 | 107.6° | 109.7° |
| C39 | C37 | C35 | 108.8° | 109.0° |
| C39 | C37 | H45 | 109.1° | 109.5° |
| C37 | C39 | H47 | 109.9° | 109.6° |
| C33 | C32 | O31 | 108.5° | 109.5° |
| C33 | C32 | C35 | 107.9° | 109.5° |
| C33 | C32 | H39 | 108.7° | 109.5° |
| C32 | C33 | H40 | 110.2° | 109.4° |
| C32 | C33 | H41 | 110.2° | 109.5° |
| C30 | O31 | C32 | 117.7° | 114.1° |
| O31 | C30 | C29 | 110.8° | 109.5° |
| O31 | C30 | H1 | 108.6° | 109.5° |
| O31 | C32 | C35 | 114.1° | 109.4° |
| O31 | C32 | H39 | 109.1° | 109.5° |
| C30 | C29 | P26 | 112.0° | 109.5° |
| C29 | C30 | H1 | 108.3° | 109.5° |
| C30 | C29 | H2 | 108.8° | 109.5° |
| C30 | C29 | H3 | 108.8° | 109.5° |
| O38 | C37 | C35 | 113.6° | 109.6° |
| O38 | C37 | H45 | 108.9° | 109.6° |
| C37 | O38 | H46 | 109.5° | 114.0° |
| C37 | C35 | C32 | 110.0° | 109.2° |
| C37 | C35 | O36 | 112.6° | 109.5° |
| C37 | C35 | H43 | 108.8° | 109.5° |
| C35 | C37 | H45 | 108.7° | 109.5° |
| C32 | C35 | O36 | 107.9° | 109.5° |
| C35 | C32 | H39 | 108.3° | 109.5° |
| C32 | C35 | H43 | 108.1° | 109.5° |
| O36 | C35 | H43 | 109.3° | 109.5° |
| C35 | O36 | H44 | 109.5° | 114.0° |
| O28 | P26 | C29 | 109.7° | 109.5° |
| O28 | P26 | O25 | 107.6° | 109.5° |
| O28 | P26 | O27 | 109.2° | 109.5° |
| C29 | P26 | O25 | 107.3° | 109.5° |
| C29 | P26 | O27 | 111.1° | 109.5° |
| P26 | C29 | H2 | 108.8° | 109.5° |
| P26 | C29 | H3 | 108.8° | 109.5° |
| O23 | P22 | O25 | 112.9° | 109.4° |
| O23 | P22 | O24 | 109.8° | 109.5° |
| O23 | P22 | O21 | 106.0° | 109.5° |
| O25 | P26 | O27 | 111.9° | 109.5° |
| P26 | O25 | P22 | 128.5° | 134.0° |
| P26 | O27 | H38 | 109.5° | 114.0° |
| O25 | P22 | O24 | 105.3° | 109.5° |
| O25 | P22 | O21 | 112.0° | 109.5° |
| O24 | P22 | O21 | 111.0° | 109.5° |
| P22 | O24 | H37 | 109.5° | 114.0° |
| P22 | O21 | C20 | 117.5° | 123.0° |
| O21 | C20 | C19 | 105.3° | 109.5° |
| O21 | C20 | H4 | 110.5° | 109.5° |
| O21 | C20 | H5 | 110.5° | 109.4° |
| C20 | C19 | C17 | 120.0° | 120.0° |
| C19 | C20 | H4 | 110.5° | 109.5° |
| C19 | C20 | H5 | 110.5° | 109.4° |
| C20 | C19 | H36 | 120.0° | 120.0° |
| C19 | C17 | C16 | 119.7° | 120.0° |
| C19 | C17 | C18 | 118.0° | 120.0° |
| C17 | C19 | H36 | 120.0° | 120.0° |
| C13 | C12 | C14 | 119.0° | 120.0° |
| C13 | C12 | C11 | 119.0° | 120.0° |
| C12 | C13 | H11 | 109.5° | 109.4° |
| C12 | C13 | H12 | 109.5° | 109.5° |
| C12 | C13 | H13 | 109.5° | 109.5° |
| C12 | C14 | C15 | 122.1° | 120.0° |
| C14 | C12 | C11 | 122.0° | 120.0° |
| C12 | C14 | H10 | 119.0° | 120.0° |
| C14 | C15 | C16 | 112.6° | 109.5° |
| C14 | C15 | H8 | 108.7° | 109.5° |
| C14 | C15 | H9 | 108.7° | 109.4° |
| C15 | C14 | H10 | 118.9° | 120.0° |
| C16 | C17 | C18 | 122.4° | 120.0° |
| C17 | C16 | C15 | 115.3° | 109.5° |
| C17 | C16 | H6 | 108.0° | 109.5° |
| C17 | C16 | H7 | 108.0° | 109.4° |
| C17 | C18 | H14 | 109.5° | 109.4° |
| C17 | C18 | H15 | 109.5° | 109.5° |
| C17 | C18 | H16 | 109.5° | 109.5° |
| C15 | C16 | H6 | 108.0° | 109.5° |
| C15 | C16 | H7 | 108.0° | 109.5° |
| C16 | C15 | H8 | 108.7° | 109.5° |
| C16 | C15 | H9 | 108.7° | 109.5° |
| C12 | C11 | C10 | 113.2° | 109.5° |
| C12 | C11 | H17 | 108.5° | 109.5° |
| C12 | C11 | H18 | 108.5° | 109.5° |
| C11 | C10 | C09 | 113.3° | 109.5° |
| C10 | C11 | H17 | 108.5° | 109.4° |
| C10 | C11 | H18 | 108.6° | 109.5° |
| C11 | C10 | H34 | 108.5° | 109.4° |
| C11 | C10 | H35 | 108.5° | 109.5° |
| C10 | C09 | C07 | 122.1° | 120.0° |
| C10 | C09 | H19 | 118.9° | 120.0° |
| C09 | C10 | H34 | 108.5° | 109.5° |
| C09 | C10 | H35 | 108.5° | 109.5° |
| C09 | C07 | C06 | 120.7° | 120.0° |
| C09 | C07 | C08 | 120.1° | 120.0° |
| C07 | C09 | H19 | 118.9° | 120.0° |
| C06 | C07 | C08 | 119.2° | 120.0° |
| C07 | C06 | C05 | 110.4° | 109.4° |
| C07 | C06 | H23 | 109.3° | 109.5° |
| C07 | C06 | H24 | 109.3° | 109.5° |
| C07 | C08 | H20 | 109.5° | 109.5° |
| C07 | C08 | H21 | 109.5° | 109.5° |
| C07 | C08 | H22 | 109.5° | 109.5° |
| C03 | C02 | C04 | 119.6° | 120.0° |
| C03 | C02 | C01 | 120.6° | 120.0° |
| C02 | C03 | H28 | 109.5° | 109.4° |
| C02 | C03 | H29 | 109.5° | 109.5° |
| C02 | C03 | H30 | 109.5° | 109.5° |
| C06 | C05 | C04 | 111.0° | 109.4° |
| C05 | C06 | H23 | 109.2° | 109.5° |
| C05 | C06 | H24 | 109.3° | 109.5° |
| C06 | C05 | H25 | 109.1° | 109.5° |
| C06 | C05 | H26 | 109.1° | 109.5° |
| C02 | C04 | C05 | 121.6° | 120.0° |
| C04 | C02 | C01 | 119.8° | 120.0° |
| C02 | C04 | H27 | 119.2° | 120.0° |
| C04 | C05 | H25 | 109.1° | 109.4° |
| C04 | C05 | H26 | 109.1° | 109.4° |
| C05 | C04 | H27 | 119.2° | 120.0° |
| C02 | C01 | H31 | 109.5° | 109.5° |
| C02 | C01 | H32 | 109.5° | 109.5° |
| C02 | C01 | H33 | 109.4° | 109.5° |
| H2 | C29 | H3 | 109.5° | 109.5° |
| H4 | C20 | H5 | 109.5° | 109.5° |
| H6 | C16 | H7 | 109.5° | 109.5° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H11 | C13 | H12 | 109.5° | 109.5° |
| H11 | C13 | H13 | 109.5° | 109.5° |
| H12 | C13 | H13 | 109.4° | 109.4° |
| H14 | C18 | H15 | 109.4° | 109.5° |
| H14 | C18 | H16 | 109.4° | 109.4° |
| H15 | C18 | H16 | 109.5° | 109.5° |
| H17 | C11 | H18 | 109.5° | 109.4° |
| H20 | C08 | H21 | 109.4° | 109.5° |
| H20 | C08 | H22 | 109.5° | 109.5° |
| H21 | C08 | H22 | 109.4° | 109.4° |
| H23 | C06 | H24 | 109.4° | 109.6° |
| H25 | C05 | H26 | 109.5° | 109.5° |
| H28 | C03 | H29 | 109.5° | 109.5° |
| H28 | C03 | H30 | 109.5° | 109.5° |
| H29 | C03 | H30 | 109.4° | 109.5° |
| H31 | C01 | H32 | 109.5° | 109.5° |
| H31 | C01 | H33 | 109.5° | 109.4° |
| H32 | C01 | H33 | 109.5° | 109.5° |
| H34 | C10 | H35 | 109.5° | 109.5° |
| H40 | C33 | H41 | 109.4° | 109.4° |
| H49 | C42 | H50 | 109.5° | 109.5° |
| H49 | C42 | H51 | 109.5° | 109.4° |
| H50 | C42 | H51 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O43 | C41 | C42 | N40 | 179.9° | 180.0° |
| O43 | C41 | N40 | C39 | 0.9° | 0.0° |
| O43 | C41 | N40 | H48 | 179.1° | 179.9° |
| O43 | C41 | C42 | H49 | 0.0° | 90.0° |
| O43 | C41 | C42 | H50 | 120.0° | 30.1° |
| O43 | C41 | C42 | H51 | 120.0° | 150.0° |
| O34 | C33 | C32 | H40 | 119.6° | 120.0° |
| O34 | C33 | C32 | H41 | 119.6° | 120.0° |
| O34 | C33 | C32 | O31 | 60.4° | 65.0° |
| O34 | C33 | C32 | C35 | 63.7° | 175.0° |
| O34 | C33 | C32 | H39 | 179.0° | 55.0° |
| O34 | C33 | H40 | H41 | 121.2° | 120.1° |
| C42 | C41 | N40 | C39 | 179.2° | 180.0° |
| C42 | C41 | N40 | H48 | 0.8° | 0.0° |
| C41 | C42 | H49 | H50 | 120.0° | 120.0° |
| C41 | C42 | H49 | H51 | 120.0° | 120.0° |
| C41 | C42 | H50 | H51 | 120.0° | 120.0° |
| C41 | N40 | C39 | H48 | 180.0° | 180.0° |
| C41 | N40 | C39 | C30 | 82.2° | 155.0° |
| C41 | N40 | C39 | C37 | 157.3° | 85.3° |
| C41 | N40 | C39 | H47 | 37.9° | 34.9° |
| N40 | C41 | C42 | H49 | 179.9° | 90.0° |
| N40 | C41 | C42 | H50 | 60.1° | 150.0° |
| N40 | C41 | C42 | H51 | 59.8° | 30.0° |
| N40 | C39 | C30 | C37 | 118.6° | 119.9° |
| N40 | C39 | C30 | H47 | 120.5° | 120.1° |
| N40 | C39 | C37 | H47 | 119.1° | 120.1° |
| N40 | C39 | C30 | O31 | 173.4° | 177.5° |
| N40 | C39 | C30 | C29 | 50.5° | 57.5° |
| N40 | C39 | C37 | O38 | 49.0° | 63.2° |
| N40 | C39 | C37 | C35 | 172.5° | 176.9° |
| N40 | C39 | C30 | H1 | 67.6° | 62.5° |
| N40 | C39 | C37 | H45 | 69.1° | 57.1° |
| C30 | C39 | C37 | H47 | 120.5° | 119.9° |
| C39 | C30 | O31 | C29 | 122.4° | 120.0° |
| C39 | C30 | O31 | H1 | 118.8° | 120.0° |
| C39 | C30 | O31 | C32 | 39.8° | 61.1° |
| C39 | C30 | C29 | H1 | 118.0° | 120.0° |
| C30 | C39 | C37 | O38 | 169.3° | 176.9° |
| C30 | C39 | C37 | C35 | 67.1° | 56.9° |
| C39 | C30 | C29 | P26 | 165.6° | 175.0° |
| C39 | C30 | C29 | H2 | 74.0° | 55.0° |
| C39 | C30 | C29 | H3 | 45.3° | 65.0° |
| C30 | C39 | C37 | H45 | 51.3° | 62.9° |
| C30 | C39 | N40 | H48 | 97.8° | 25.0° |
| C37 | C39 | C30 | O31 | 54.8° | 57.6° |
| C37 | C39 | C30 | C29 | 68.1° | 62.4° |
| C39 | C37 | O38 | C35 | 120.6° | 119.6° |
| C39 | C37 | O38 | H45 | 118.1° | 120.2° |
| C39 | C37 | C35 | H45 | 118.7° | 119.8° |
| C39 | C37 | C35 | C32 | 61.4° | 56.9° |
| C39 | C37 | C35 | O36 | 178.2° | 176.8° |
| C37 | C39 | C30 | H1 | 173.8° | 177.6° |
| C39 | C37 | C35 | H43 | 56.8° | 63.0° |
| C39 | C37 | O38 | H46 | 180.0° | 179.6° |
| C37 | C39 | N40 | H48 | 22.8° | 94.8° |
| C33 | C32 | O31 | C30 | 156.7° | 178.9° |
| C33 | C32 | O31 | C35 | 120.4° | 120.0° |
| C33 | C32 | O31 | H39 | 118.3° | 120.0° |
| C33 | C32 | C35 | C37 | 166.4° | 177.6° |
| C33 | C32 | C35 | H39 | 117.6° | 120.0° |
| C33 | C32 | C35 | O36 | 70.4° | 62.5° |
| C32 | C33 | H40 | H41 | 121.3° | 119.9° |
| C32 | C33 | O34 | H42 | 180.0° | 180.0° |
| C33 | C32 | C35 | H43 | 47.8° | 57.7° |
| O31 | C30 | C29 | H1 | 119.0° | 120.0° |
| C30 | O31 | C32 | C35 | 36.3° | 61.1° |
| O31 | C30 | C29 | P26 | 42.6° | 65.0° |
| O31 | C30 | C29 | H2 | 162.9° | 175.0° |
| O31 | C30 | C29 | H3 | 77.8° | 55.0° |
| C30 | O31 | C32 | H39 | 85.0° | 58.8° |
| O31 | C30 | C39 | H47 | 66.1° | 62.4° |
| C32 | O31 | C30 | C29 | 82.5° | 58.8° |
| O31 | C32 | C35 | C37 | 45.7° | 57.6° |
| O31 | C32 | C35 | H39 | 121.8° | 120.0° |
| O31 | C32 | C35 | O36 | 169.0° | 177.5° |
| C32 | O31 | C30 | H1 | 158.6° | 178.8° |
| O31 | C32 | C33 | H40 | 180.0° | 175.0° |
| O31 | C32 | C33 | H41 | 59.1° | 55.0° |
| O31 | C32 | C35 | H43 | 72.9° | 62.3° |
| C30 | C29 | P26 | O28 | 40.1° | 55.0° |
| C30 | C29 | P26 | H2 | 120.3° | 120.0° |
| C30 | C29 | P26 | H3 | 120.4° | 120.0° |
| C30 | C29 | P26 | O25 | 76.5° | 175.0° |
| C30 | C29 | P26 | O27 | 160.9° | 65.0° |
| C30 | C29 | H2 | H3 | 118.9° | 120.0° |
| C29 | C30 | C39 | H47 | 171.0° | 177.6° |
| O38 | C37 | C35 | H45 | 121.4° | 120.2° |
| O38 | C37 | C35 | C32 | 178.7° | 176.9° |
| O38 | C37 | C35 | O36 | 58.3° | 63.1° |
| O38 | C37 | C35 | H43 | 63.1° | 57.0° |
| O38 | C37 | C39 | H47 | 70.2° | 56.9° |
| C37 | C35 | C32 | O36 | 123.2° | 119.9° |
| C37 | C35 | C32 | H43 | 118.6° | 119.9° |
| C37 | C35 | O36 | H43 | 121.0° | 120.1° |
| C37 | C35 | C32 | H39 | 76.0° | 62.4° |
| C37 | C35 | O36 | H44 | 180.0° | 179.9° |
| C35 | C37 | O38 | H46 | 59.4° | 60.0° |
| C35 | C37 | C39 | H47 | 53.3° | 63.0° |
| C32 | C35 | O36 | H43 | 117.3° | 120.1° |
| C35 | C32 | C33 | H40 | 55.9° | 55.0° |
| C35 | C32 | C33 | H41 | 176.8° | 64.9° |
| C32 | C35 | O36 | H44 | 58.4° | 60.3° |
| C32 | C35 | C37 | H45 | 57.3° | 62.9° |
| O36 | C35 | C32 | H39 | 47.2° | 57.6° |
| O36 | C35 | C37 | H45 | 63.1° | 57.0° |
| O28 | P26 | C29 | O25 | 116.6° | 120.0° |
| O28 | P26 | C29 | O27 | 120.8° | 120.0° |
| O28 | P26 | O25 | O27 | 120.0° | 120.0° |
| O28 | P26 | O25 | P22 | 30.4° | 60.0° |
| O28 | P26 | C29 | H2 | 80.2° | 175.0° |
| O28 | P26 | C29 | H3 | 160.5° | 65.0° |
| O28 | P26 | O27 | H38 | 0.0° | 180.0° |
| C29 | P26 | O25 | O27 | 122.1° | 120.0° |
| C29 | P26 | O25 | P22 | 148.3° | 180.0° |
| P26 | C29 | C30 | H1 | 76.4° | 55.0° |
| P26 | C29 | H2 | H3 | 118.9° | 120.0° |
| C29 | P26 | O27 | H38 | 121.1° | 60.0° |
| O23 | P22 | O25 | P26 | 57.2° | 45.0° |
| O23 | P22 | O25 | O24 | 119.8° | 120.0° |
| O23 | P22 | O25 | O21 | 119.5° | 120.0° |
| O23 | P22 | O24 | O21 | 116.9° | 120.0° |
| O23 | P22 | O21 | C20 | 97.4° | 55.0° |
| O23 | P22 | O24 | H37 | 0.0° | 180.0° |
| P26 | O25 | P22 | O24 | 177.0° | 75.0° |
| P26 | O25 | P22 | O21 | 62.3° | 165.0° |
| O25 | P26 | C29 | H2 | 163.2° | 65.0° |
| O25 | P26 | C29 | H3 | 43.9° | 55.0° |
| O25 | P26 | O27 | H38 | 119.0° | 60.0° |
| O27 | P26 | O25 | P22 | 89.6° | 60.0° |
| O27 | P26 | C29 | H2 | 40.6° | 55.0° |
| O27 | P26 | C29 | H3 | 78.7° | 175.0° |
| O25 | P22 | O24 | O21 | 121.4° | 120.0° |
| O25 | P22 | O21 | C20 | 139.2° | 175.0° |
| O25 | P22 | O24 | H37 | 121.8° | 60.0° |
| O24 | P22 | O21 | C20 | 21.8° | 65.0° |
| P22 | O21 | C20 | C19 | 149.4° | 180.0° |
| P22 | O21 | C20 | H4 | 30.0° | 60.0° |
| P22 | O21 | C20 | H5 | 91.3° | 60.0° |
| O21 | P22 | O24 | H37 | 116.9° | 60.0° |
| O21 | C20 | C19 | H4 | 119.3° | 120.1° |
| O21 | C20 | C19 | H5 | 119.4° | 119.9° |
| O21 | C20 | C19 | C17 | 141.7° | 134.8° |
| O21 | C20 | H4 | H5 | 121.9° | 120.0° |
| O21 | C20 | C19 | H36 | 38.3° | 45.1° |
| C20 | C19 | C17 | H36 | 180.0° | 179.9° |
| C20 | C19 | C17 | C16 | 0.3° | 0.4° |
| C20 | C19 | C17 | C18 | 179.6° | 179.6° |
| C19 | C20 | H4 | H5 | 121.9° | 120.0° |
| C19 | C17 | C16 | C18 | 179.9° | 180.0° |
| C19 | C17 | C16 | C15 | 119.1° | 92.3° |
| C17 | C19 | C20 | H4 | 22.4° | 14.7° |
| C17 | C19 | C20 | H5 | 99.0° | 105.3° |
| C19 | C17 | C16 | H6 | 120.0° | 147.7° |
| C19 | C17 | C16 | H7 | 1.7° | 27.7° |
| C19 | C17 | C18 | H14 | 180.0° | 90.0° |
| C19 | C17 | C18 | H15 | 60.0° | 30.0° |
| C19 | C17 | C18 | H16 | 60.0° | 150.0° |
| C13 | C12 | C14 | C11 | 179.0° | 180.0° |
| C13 | C12 | C14 | C15 | 179.2° | 178.5° |
| C13 | C12 | C11 | C10 | 85.2° | 88.6° |
| C13 | C12 | C14 | H10 | 0.8° | 1.5° |
| C12 | C13 | H11 | H12 | 120.0° | 120.0° |
| C12 | C13 | H11 | H13 | 120.0° | 120.0° |
| C12 | C13 | H12 | H13 | 120.0° | 120.1° |
| C13 | C12 | C11 | H17 | 154.3° | 31.4° |
| C13 | C12 | C11 | H18 | 35.4° | 151.4° |
| C12 | C14 | C15 | H10 | 180.0° | 180.0° |
| C12 | C14 | C15 | C16 | 163.8° | 119.5° |
| C14 | C12 | C11 | C10 | 93.8° | 91.4° |
| C12 | C14 | C15 | H8 | 43.3° | 0.5° |
| C12 | C14 | C15 | H9 | 75.8° | 120.5° |
| C14 | C12 | C13 | H11 | 180.0° | 90.0° |
| C14 | C12 | C13 | H12 | 60.0° | 150.0° |
| C14 | C12 | C13 | H13 | 60.0° | 30.0° |
| C14 | C12 | C11 | H17 | 26.7° | 148.6° |
| C14 | C12 | C11 | H18 | 145.6° | 28.6° |
| C14 | C15 | C16 | C17 | 59.3° | 180.0° |
| C14 | C15 | C16 | H8 | 120.5° | 120.0° |
| C14 | C15 | C16 | H9 | 120.5° | 120.0° |
| C15 | C14 | C12 | C11 | 0.2° | 1.5° |
| C14 | C15 | C16 | H6 | 179.9° | 60.0° |
| C14 | C15 | C16 | H7 | 61.5° | 60.0° |
| C14 | C15 | H8 | H9 | 118.5° | 120.0° |
| C17 | C16 | C15 | H6 | 120.8° | 120.0° |
| C17 | C16 | C15 | H7 | 120.8° | 120.0° |
| C17 | C16 | H6 | H7 | 117.4° | 120.0° |
| C17 | C16 | C15 | H8 | 179.8° | 60.0° |
| C17 | C16 | C15 | H9 | 61.2° | 60.0° |
| C16 | C17 | C18 | H14 | 0.1° | 90.0° |
| C16 | C17 | C18 | H15 | 120.1° | 150.0° |
| C16 | C17 | C18 | H16 | 119.9° | 30.0° |
| C16 | C17 | C19 | H36 | 179.7° | 179.7° |
| C18 | C17 | C16 | C15 | 61.0° | 87.7° |
| C18 | C17 | C16 | H6 | 59.8° | 32.3° |
| C18 | C17 | C16 | H7 | 178.1° | 152.3° |
| C17 | C18 | H14 | H15 | 120.0° | 120.0° |
| C17 | C18 | H14 | H16 | 120.0° | 120.0° |
| C17 | C18 | H15 | H16 | 120.0° | 120.0° |
| C18 | C17 | C19 | H36 | 0.4° | 0.3° |
| C15 | C16 | H6 | H7 | 117.4° | 120.0° |
| C16 | C15 | H8 | H9 | 118.6° | 120.0° |
| C16 | C15 | C14 | H10 | 16.2° | 60.5° |
| C12 | C11 | C10 | H17 | 120.5° | 120.0° |
| C12 | C11 | C10 | H18 | 120.5° | 120.0° |
| C12 | C11 | C10 | C09 | 170.8° | 180.0° |
| C11 | C12 | C14 | H10 | 179.8° | 178.5° |
| C11 | C12 | C13 | H11 | 1.0° | 90.0° |
| C11 | C12 | C13 | H12 | 121.0° | 30.0° |
| C11 | C12 | C13 | H13 | 119.1° | 150.0° |
| C12 | C11 | H17 | H18 | 118.3° | 120.1° |
| C12 | C11 | C10 | H34 | 50.2° | 60.1° |
| C12 | C11 | C10 | H35 | 68.7° | 60.0° |
| C11 | C10 | C09 | H34 | 120.6° | 119.9° |
| C11 | C10 | C09 | H35 | 120.6° | 120.0° |
| C11 | C10 | C09 | C07 | 138.5° | 125.0° |
| C10 | C11 | H17 | H18 | 118.3° | 120.0° |
| C11 | C10 | C09 | H19 | 41.5° | 55.0° |
| C11 | C10 | H34 | H35 | 118.3° | 120.0° |
| C10 | C09 | C07 | H19 | 180.0° | 180.0° |
| C10 | C09 | C07 | C06 | 0.6° | 6.7° |
| C10 | C09 | C07 | C08 | 179.5° | 173.4° |
| C09 | C10 | C11 | H17 | 68.7° | 60.0° |
| C09 | C10 | C11 | H18 | 50.2° | 60.0° |
| C09 | C10 | H34 | H35 | 118.3° | 120.0° |
| C09 | C07 | C06 | C08 | 179.9° | 179.9° |
| C09 | C07 | C06 | C05 | 113.3° | 95.6° |
| C09 | C07 | C08 | H20 | 180.0° | 90.0° |
| C09 | C07 | C08 | H21 | 60.0° | 149.9° |
| C09 | C07 | C08 | H22 | 60.0° | 30.0° |
| C09 | C07 | C06 | H23 | 6.8° | 24.3° |
| C09 | C07 | C06 | H24 | 126.5° | 144.4° |
| C07 | C09 | C10 | H34 | 100.9° | 5.1° |
| C07 | C09 | C10 | H35 | 17.9° | 115.0° |
| C07 | C06 | C05 | H23 | 120.2° | 120.0° |
| C07 | C06 | C05 | H24 | 120.2° | 119.9° |
| C07 | C06 | C05 | C04 | 69.5° | 180.0° |
| C06 | C07 | C09 | H19 | 179.5° | 173.3° |
| C06 | C07 | C08 | H20 | 0.1° | 90.0° |
| C06 | C07 | C08 | H21 | 120.0° | 30.0° |
| C06 | C07 | C08 | H22 | 120.1° | 149.9° |
| C07 | C06 | H23 | H24 | 119.6° | 120.0° |
| C07 | C06 | C05 | H25 | 170.3° | 60.1° |
| C07 | C06 | C05 | H26 | 50.7° | 60.1° |
| C08 | C07 | C06 | C05 | 66.8° | 84.4° |
| C08 | C07 | C09 | H19 | 0.5° | 6.6° |
| C07 | C08 | H20 | H21 | 120.0° | 120.1° |
| C07 | C08 | H20 | H22 | 120.0° | 120.1° |
| C07 | C08 | H21 | H22 | 120.0° | 120.0° |
| C08 | C07 | C06 | H23 | 173.1° | 155.6° |
| C08 | C07 | C06 | H24 | 53.4° | 35.5° |
| C03 | C02 | C04 | C01 | 179.5° | 179.9° |
| C03 | C02 | C04 | C05 | 179.9° | 7.6° |
| C03 | C02 | C04 | H27 | 0.1° | 172.4° |
| C02 | C03 | H28 | H29 | 120.0° | 120.0° |
| C02 | C03 | H28 | H30 | 120.0° | 119.9° |
| C02 | C03 | H29 | H30 | 120.0° | 120.0° |
| C03 | C02 | C01 | H31 | 180.0° | 90.0° |
| C03 | C02 | C01 | H32 | 60.0° | 30.0° |
| C03 | C02 | C01 | H33 | 60.0° | 150.0° |
| C06 | C05 | C04 | C02 | 117.1° | 127.1° |
| C06 | C05 | C04 | H25 | 120.2° | 120.0° |
| C06 | C05 | C04 | H26 | 120.2° | 120.0° |
| C05 | C06 | H23 | H24 | 119.6° | 120.0° |
| C06 | C05 | H25 | H26 | 119.3° | 120.1° |
| C06 | C05 | C04 | H27 | 62.9° | 52.8° |
| C02 | C04 | C05 | H27 | 180.0° | 180.0° |
| C02 | C04 | C05 | H25 | 122.7° | 7.1° |
| C02 | C04 | C05 | H26 | 3.1° | 112.8° |
| C04 | C02 | C03 | H28 | 180.0° | 1.6° |
| C04 | C02 | C03 | H29 | 60.0° | 121.5° |
| C04 | C02 | C03 | H30 | 60.0° | 118.4° |
| C04 | C02 | C01 | H31 | 0.5° | 90.0° |
| C04 | C02 | C01 | H32 | 119.6° | 150.0° |
| C04 | C02 | C01 | H33 | 120.5° | 29.9° |
| C05 | C04 | C02 | C01 | 0.5° | 172.4° |
| C04 | C05 | C06 | H23 | 50.7° | 60.0° |
| C04 | C05 | C06 | H24 | 170.3° | 60.1° |
| C04 | C05 | H25 | H26 | 119.3° | 119.9° |
| C01 | C02 | C04 | H27 | 179.5° | 7.5° |
| C01 | C02 | C03 | H28 | 0.5° | 178.4° |
| C01 | C02 | C03 | H29 | 119.5° | 58.4° |
| C01 | C02 | C03 | H30 | 120.5° | 61.7° |
| C02 | C01 | H31 | H32 | 120.0° | 120.1° |
| C02 | C01 | H31 | H33 | 120.0° | 120.0° |
| C02 | C01 | H32 | H33 | 119.9° | 120.0° |
| H1 | C30 | C29 | H2 | 44.0° | 65.0° |
| H1 | C30 | C29 | H3 | 163.3° | 175.0° |
| H1 | C30 | C39 | H47 | 52.9° | 57.6° |
| H4 | C20 | C19 | H36 | 157.6° | 165.2° |
| H5 | C20 | C19 | H36 | 81.1° | 74.8° |
| H6 | C16 | C15 | H8 | 59.4° | 180.0° |
| H6 | C16 | C15 | H9 | 59.7° | 60.0° |
| H7 | C16 | C15 | H8 | 58.9° | 60.0° |
| H7 | C16 | C15 | H9 | 178.0° | 180.0° |
| H8 | C15 | C14 | H10 | 136.7° | 179.5° |
| H9 | C15 | C14 | H10 | 104.2° | 59.4° |
| H11 | C13 | H12 | H13 | 120.0° | 120.0° |
| H14 | C18 | H15 | H16 | 120.0° | 120.0° |
| H17 | C11 | C10 | H34 | 170.8° | 179.9° |
| H17 | C11 | C10 | H35 | 51.9° | 60.0° |
| H18 | C11 | C10 | H34 | 70.3° | 60.0° |
| H18 | C11 | C10 | H35 | 170.8° | 180.0° |
| H19 | C09 | C10 | H34 | 79.0° | 174.9° |
| H19 | C09 | C10 | H35 | 162.1° | 65.0° |
| H20 | C08 | H21 | H22 | 119.9° | 119.9° |
| H23 | C06 | C05 | H25 | 69.6° | 180.0° |
| H23 | C06 | C05 | H26 | 170.9° | 59.9° |
| H24 | C06 | C05 | H25 | 50.1° | 59.9° |
| H24 | C06 | C05 | H26 | 69.4° | 180.0° |
| H25 | C05 | C04 | H27 | 57.3° | 172.8° |
| H26 | C05 | C04 | H27 | 176.8° | 67.2° |
| H28 | C03 | H29 | H30 | 120.0° | 120.0° |
| H31 | C01 | H32 | H33 | 120.0° | 119.9° |
| H39 | C32 | C33 | H40 | 61.4° | 65.0° |
| H39 | C32 | C33 | H41 | 59.5° | 175.0° |
| H39 | C32 | C35 | H43 | 165.4° | 177.7° |
| H40 | C33 | O34 | H42 | 60.4° | 60.0° |
| H41 | C33 | O34 | H42 | 60.4° | 60.0° |
| H43 | C35 | O36 | H44 | 58.9° | 59.8° |
| H43 | C35 | C37 | H45 | 175.5° | 177.2° |
| H45 | C37 | O38 | H46 | 61.9° | 60.2° |
| H45 | C37 | C39 | H47 | 171.8° | 177.2° |
| H47 | C39 | N40 | H48 | 142.1° | 145.1° |
| H49 | C42 | H50 | H51 | 120.0° | 120.0° |
