0BD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C1 | C6 | sing | 1.53Å | 1.54Å | |
| C1 | O49 | sing | 1.43Å | 1.44Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | O55 | sing | 1.43Å | 1.42Å | |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| C3 | O7 | sing | 1.43Å | 1.44Å | |
| C4 | O5 | sing | 1.43Å | 1.45Å | |
| C4 | C57 | sing | 1.53Å | 1.52Å | |
| O5 | C6 | sing | 1.43Å | 1.43Å | |
| C6 | O16 | sing | 1.43Å | 1.43Å | |
| O7 | C10 | sing | 1.43Å | 1.33Å | |
| O16 | C18 | sing | 1.43Å | 1.43Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C18 | C | sing | 1.53Å | 1.53Å | |
| C19 | C22 | sing | 1.53Å | 1.53Å | |
| C22 | C14 | sing | 1.53Å | 1.54Å | |
| C22 | C13 | sing | 1.53Å | 1.54Å | |
| C57 | O61 | sing | 1.43Å | 1.43Å | |
| C | C12 | sing | 1.53Å | 1.54Å | |
| C12 | C16 | sing | 1.53Å | 1.53Å | |
| C12 | C15 | sing | 1.53Å | 1.54Å | |
| C10 | O71 | sing | 1.43Å | 1.54Å | |
| C10 | C17 | sing | 1.53Å | 1.54Å | |
| O71 | C181 | sing | 1.43Å | 1.54Å | |
| C17 | C191 | sing | 1.53Å | 1.54Å | |
| C181 | C20 | sing | 1.53Å | 1.54Å | |
| C20 | C191 | sing | 1.53Å | 1.65Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| O49 | HO49 | sing | 0.97Å | 0.95Å | |
| O55 | HO55 | sing | 0.97Å | 0.95Å | |
| C57 | H57 | sing | 1.09Å | 1.10Å | |
| C57 | H57A | sing | 1.09Å | 1.10Å | |
| O61 | HO61 | sing | 0.97Å | 0.95Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C14 | H14B | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C | H | sing | 1.09Å | 1.10Å | |
| C | HA | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C16 | H16B | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| C17 | O8 | sing | 1.43Å | 1.43Å | |
| C17 | H31 | sing | 1.09Å | 1.10Å | |
| C181 | C21 | sing | 1.53Å | 1.54Å | |
| C181 | H32 | sing | 1.09Å | 1.10Å | |
| C191 | O9 | sing | 1.43Å | 1.43Å | |
| C191 | H33 | sing | 1.09Å | 1.10Å | |
| C20 | O10 | sing | 1.43Å | 1.43Å | |
| C20 | H34 | sing | 1.09Å | 1.10Å | |
| C21 | H35 | sing | 1.09Å | 1.10Å | |
| C21 | O11 | sing | 1.43Å | 1.43Å | |
| C21 | H36 | sing | 1.09Å | 1.10Å | |
| O8 | H37 | sing | 0.97Å | 0.95Å | |
| O9 | H38 | sing | 0.97Å | 0.95Å | |
| O10 | H39 | sing | 0.97Å | 0.95Å | |
| O11 | H40 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 109.3° | 109.2° |
| C2 | C1 | O49 | 110.7° | 109.5° |
| C1 | C2 | C3 | 111.5° | 109.0° |
| C1 | C2 | O55 | 109.3° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C1 | C2 | H2 | 107.6° | 109.5° |
| C6 | C1 | O49 | 111.7° | 109.5° |
| C1 | C6 | O5 | 109.5° | 109.4° |
| C1 | C6 | O16 | 108.2° | 109.5° |
| C6 | C1 | H1 | 108.5° | 109.5° |
| C1 | C6 | H6 | 109.8° | 109.5° |
| O49 | C1 | H1 | 107.0° | 109.6° |
| C1 | O49 | HO49 | 109.5° | 114.0° |
| C3 | C2 | O55 | 107.7° | 109.6° |
| C2 | C3 | C4 | 108.2° | 109.2° |
| C2 | C3 | O7 | 108.9° | 109.6° |
| C3 | C2 | H2 | 109.2° | 109.6° |
| C2 | C3 | H3 | 111.8° | 109.5° |
| O55 | C2 | H2 | 111.5° | 109.6° |
| C2 | O55 | HO55 | 109.5° | 114.0° |
| C4 | C3 | O7 | 112.5° | 109.5° |
| C3 | C4 | O5 | 111.7° | 109.4° |
| C3 | C4 | C57 | 111.7° | 109.5° |
| C4 | C3 | H3 | 108.2° | 109.5° |
| C3 | C4 | H4 | 105.7° | 109.5° |
| C3 | O7 | C10 | 79.5° | 114.0° |
| O7 | C3 | H3 | 107.4° | 109.6° |
| O5 | C4 | C57 | 107.3° | 109.5° |
| C4 | O5 | C6 | 114.0° | 114.1° |
| O5 | C4 | H4 | 110.2° | 109.5° |
| C4 | C57 | O61 | 105.2° | 109.5° |
| C57 | C4 | H4 | 110.3° | 109.4° |
| C4 | C57 | H57 | 110.9° | 109.5° |
| C4 | C57 | H57A | 111.8° | 109.5° |
| O5 | C6 | O16 | 107.8° | 109.5° |
| O5 | C6 | H6 | 110.1° | 109.5° |
| C6 | O16 | C18 | 121.2° | 114.0° |
| O16 | C6 | H6 | 111.4° | 109.5° |
| O7 | C10 | O71 | 114.3° | 109.4° |
| O7 | C10 | C17 | 89.6° | 109.4° |
| O7 | C10 | H10 | 123.1° | 109.5° |
| O16 | C18 | C19 | 104.8° | 109.5° |
| O16 | C18 | C | 110.2° | 109.5° |
| O16 | C18 | H18 | 111.4° | 109.4° |
| C19 | C18 | C | 107.4° | 109.5° |
| C18 | C19 | C22 | 113.1° | 109.5° |
| C19 | C18 | H18 | 114.0° | 109.5° |
| C18 | C19 | H19 | 108.3° | 109.5° |
| C18 | C19 | H19A | 107.5° | 109.4° |
| C18 | C | C12 | 120.1° | 109.5° |
| C | C18 | H18 | 108.9° | 109.5° |
| C18 | C | H | 106.1° | 109.5° |
| C18 | C | HA | 103.6° | 109.5° |
| C19 | C22 | C14 | 111.0° | 109.5° |
| C19 | C22 | C13 | 108.6° | 109.5° |
| C22 | C19 | H19 | 108.3° | 109.5° |
| C22 | C19 | H19A | 107.5° | 109.5° |
| C19 | C22 | H22 | 109.3° | 109.4° |
| C14 | C22 | C13 | 110.3° | 109.5° |
| C14 | C22 | H22 | 107.6° | 109.5° |
| C22 | C14 | H14 | 109.5° | 109.5° |
| C22 | C14 | H14A | 109.5° | 109.4° |
| C22 | C14 | H14B | 109.5° | 109.4° |
| C13 | C22 | H22 | 110.0° | 109.4° |
| C22 | C13 | H13 | 109.5° | 109.5° |
| C22 | C13 | H13A | 109.4° | 109.4° |
| C22 | C13 | H13B | 109.5° | 109.4° |
| O61 | C57 | H57 | 110.9° | 109.5° |
| O61 | C57 | H57A | 111.9° | 109.5° |
| C57 | O61 | HO61 | 109.5° | 114.0° |
| C | C12 | C16 | 106.7° | 109.5° |
| C | C12 | C15 | 117.9° | 109.5° |
| C12 | C | H | 106.1° | 109.4° |
| C12 | C | HA | 103.6° | 109.5° |
| C | C12 | H12 | 105.5° | 109.5° |
| C16 | C12 | C15 | 109.2° | 109.5° |
| C16 | C12 | H12 | 114.9° | 109.5° |
| C12 | C16 | H16 | 109.5° | 109.5° |
| C12 | C16 | H16A | 109.5° | 109.5° |
| C12 | C16 | H16B | 109.5° | 109.5° |
| C15 | C12 | H12 | 102.9° | 109.5° |
| C12 | C15 | H15 | 109.5° | 109.5° |
| C12 | C15 | H15A | 109.5° | 109.5° |
| C12 | C15 | H15B | 109.4° | 109.5° |
| O71 | C10 | C17 | 120.0° | 109.4° |
| C10 | O71 | C181 | 109.1° | 114.1° |
| O71 | C10 | H10 | 94.6° | 109.5° |
| C10 | C17 | C191 | 111.9° | 109.1° |
| C17 | C10 | H10 | 117.7° | 109.5° |
| C10 | C17 | O8 | 106.3° | 109.5° |
| C10 | C17 | H31 | 109.0° | 109.5° |
| O71 | C181 | C20 | 111.5° | 109.4° |
| O71 | C181 | C21 | 106.3° | 109.5° |
| O71 | C181 | H32 | 109.3° | 109.5° |
| C17 | C191 | C20 | 107.4° | 109.1° |
| C191 | C17 | O8 | 106.3° | 109.5° |
| C191 | C17 | H31 | 109.0° | 109.6° |
| C17 | C191 | O9 | 106.0° | 109.6° |
| C17 | C191 | H33 | 112.6° | 109.5° |
| C181 | C20 | C191 | 113.3° | 109.2° |
| C20 | C181 | C21 | 106.3° | 109.5° |
| C20 | C181 | H32 | 109.2° | 109.4° |
| C181 | C20 | O10 | 104.6° | 109.5° |
| C181 | C20 | H34 | 109.5° | 109.6° |
| C20 | C191 | O9 | 108.4° | 109.6° |
| C20 | C191 | H33 | 110.4° | 109.6° |
| C191 | C20 | O10 | 107.3° | 109.5° |
| C191 | C20 | H34 | 107.0° | 109.5° |
| H19 | C19 | H19A | 112.4° | 109.5° |
| H57 | C57 | H57A | 106.2° | 109.5° |
| H14 | C14 | H14A | 109.5° | 109.4° |
| H14 | C14 | H14B | 109.4° | 109.5° |
| H14A | C14 | H14B | 109.4° | 109.5° |
| H13 | C13 | H13A | 109.5° | 109.5° |
| H13 | C13 | H13B | 109.4° | 109.5° |
| H13A | C13 | H13B | 109.5° | 109.5° |
| H | C | HA | 118.2° | 109.5° |
| H16 | C16 | H16A | 109.5° | 109.5° |
| H16 | C16 | H16B | 109.4° | 109.5° |
| H16A | C16 | H16B | 109.5° | 109.4° |
| H15 | C15 | H15A | 109.5° | 109.4° |
| H15 | C15 | H15B | 109.5° | 109.4° |
| H15A | C15 | H15B | 109.5° | 109.5° |
| O8 | C17 | H31 | 114.4° | 109.6° |
| C17 | O8 | H37 | 109.5° | 114.0° |
| C21 | C181 | H32 | 114.2° | 109.5° |
| C181 | C21 | H35 | 109.5° | 109.5° |
| C181 | C21 | O11 | 109.5° | 109.5° |
| C181 | C21 | H36 | 109.5° | 109.5° |
| O9 | C191 | H33 | 111.7° | 109.6° |
| C191 | O9 | H38 | 109.5° | 114.0° |
| O10 | C20 | H34 | 115.3° | 109.6° |
| C20 | O10 | H39 | 109.5° | 114.0° |
| H35 | C21 | O11 | 109.5° | 109.5° |
| H35 | C21 | H36 | 109.5° | 109.4° |
| O11 | C21 | H36 | 109.5° | 109.5° |
| C21 | O11 | H40 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | O49 | 122.9° | 119.9° |
| C2 | C1 | C6 | H1 | 119.4° | 119.9° |
| C2 | C1 | O49 | H1 | 119.3° | 120.1° |
| C1 | C2 | C3 | O55 | 119.9° | 119.9° |
| C1 | C2 | C3 | H2 | 118.8° | 119.9° |
| C1 | C2 | O55 | H2 | 118.9° | 120.2° |
| C1 | C2 | C3 | C4 | 53.4° | 57.0° |
| C1 | C2 | C3 | O7 | 175.9° | 176.9° |
| C2 | C1 | C6 | O5 | 57.3° | 57.6° |
| C2 | C1 | C6 | O16 | 174.6° | 177.6° |
| C1 | C2 | C3 | H3 | 65.6° | 62.9° |
| C2 | C1 | C6 | H6 | 63.6° | 62.4° |
| C2 | C1 | O49 | HO49 | 57.3° | 179.9° |
| C1 | C2 | O55 | HO55 | 20.3° | 60.0° |
| C6 | C1 | O49 | H1 | 118.6° | 120.2° |
| C6 | C1 | C2 | C3 | 55.8° | 57.0° |
| C6 | C1 | C2 | O55 | 174.8° | 176.9° |
| C1 | C6 | O5 | C4 | 60.7° | 61.2° |
| C1 | C6 | O5 | O16 | 117.5° | 119.9° |
| C1 | C6 | O5 | H6 | 120.8° | 120.0° |
| C1 | C6 | O16 | H6 | 120.7° | 120.0° |
| C1 | C6 | O16 | C18 | 159.9° | 168.7° |
| C6 | C1 | C2 | H2 | 64.0° | 62.9° |
| C6 | C1 | O49 | HO49 | 179.4° | 60.4° |
| O49 | C1 | C2 | C3 | 179.2° | 176.9° |
| O49 | C1 | C2 | O55 | 61.8° | 63.2° |
| O49 | C1 | C6 | O5 | 179.8° | 177.5° |
| O49 | C1 | C6 | O16 | 62.5° | 62.5° |
| O49 | C1 | C2 | H2 | 59.4° | 57.0° |
| O49 | C1 | C6 | H6 | 59.2° | 57.5° |
| C3 | C2 | O55 | H2 | 119.8° | 120.2° |
| C2 | C3 | C4 | O7 | 120.3° | 119.9° |
| C2 | C3 | C4 | H3 | 121.2° | 119.9° |
| C2 | C3 | O7 | H3 | 121.2° | 120.2° |
| C2 | C3 | C4 | O5 | 53.9° | 57.6° |
| C2 | C3 | C4 | C57 | 174.1° | 177.6° |
| C2 | C3 | O7 | C10 | 142.6° | 90.0° |
| C3 | C2 | C1 | H1 | 63.0° | 62.9° |
| C2 | C3 | C4 | H4 | 66.0° | 62.4° |
| C3 | C2 | O55 | HO55 | 101.0° | 179.6° |
| O55 | C2 | C3 | C4 | 173.3° | 176.8° |
| O55 | C2 | C3 | O7 | 64.2° | 63.3° |
| O55 | C2 | C1 | H1 | 56.0° | 56.9° |
| O55 | C2 | C3 | H3 | 54.3° | 57.0° |
| C4 | C3 | O7 | H3 | 118.9° | 120.1° |
| C3 | C4 | O5 | C57 | 122.7° | 120.0° |
| C3 | C4 | O5 | H4 | 117.2° | 120.0° |
| C3 | C4 | C57 | H4 | 117.2° | 120.0° |
| C3 | C4 | O5 | C6 | 60.0° | 61.2° |
| C4 | C3 | O7 | C10 | 97.5° | 150.3° |
| C3 | C4 | C57 | O61 | 155.0° | 175.0° |
| C4 | C3 | C2 | H2 | 65.5° | 62.9° |
| C3 | C4 | C57 | H57 | 35.0° | 55.0° |
| C3 | C4 | C57 | H57A | 83.4° | 65.0° |
| O7 | C3 | C4 | O5 | 174.2° | 177.5° |
| O7 | C3 | C4 | C57 | 65.6° | 62.5° |
| C3 | O7 | C10 | O71 | 125.6° | 70.1° |
| C3 | O7 | C10 | C17 | 111.3° | 170.0° |
| O7 | C3 | C2 | H2 | 57.1° | 57.0° |
| O7 | C3 | C4 | H4 | 54.4° | 57.5° |
| C3 | O7 | C10 | H10 | 12.1° | 50.0° |
| O5 | C4 | C57 | H4 | 120.0° | 120.0° |
| C4 | O5 | C6 | O16 | 178.2° | 178.9° |
| O5 | C4 | C57 | O61 | 82.2° | 65.0° |
| O5 | C4 | C3 | H3 | 67.3° | 62.3° |
| C4 | O5 | C6 | H6 | 60.1° | 58.8° |
| O5 | C4 | C57 | H57 | 157.7° | 175.0° |
| O5 | C4 | C57 | H57A | 39.4° | 55.0° |
| C57 | C4 | O5 | C6 | 177.3° | 178.8° |
| C4 | C57 | O61 | H57 | 120.0° | 120.0° |
| C4 | C57 | O61 | H57A | 121.6° | 120.0° |
| C57 | C4 | C3 | H3 | 52.9° | 57.7° |
| C4 | C57 | H57 | H57A | 121.7° | 120.0° |
| C4 | C57 | O61 | HO61 | 88.7° | 180.0° |
| O5 | C6 | O16 | H6 | 120.9° | 120.1° |
| O5 | C6 | O16 | C18 | 81.7° | 71.4° |
| O5 | C6 | C1 | H1 | 62.0° | 62.3° |
| C6 | O5 | C4 | H4 | 57.2° | 58.9° |
| C6 | O16 | C18 | C19 | 145.1° | 140.2° |
| C6 | O16 | C18 | C | 99.7° | 99.7° |
| O16 | C6 | C1 | H1 | 55.2° | 57.7° |
| C6 | O16 | C18 | H18 | 21.3° | 20.3° |
| O7 | C10 | O71 | C17 | 104.6° | 119.9° |
| O7 | C10 | O71 | H10 | 129.6° | 120.1° |
| O7 | C10 | C17 | H10 | 127.8° | 120.0° |
| O7 | C10 | O71 | C181 | 55.5° | 178.9° |
| O7 | C10 | C17 | C191 | 67.8° | 177.6° |
| C10 | O7 | C3 | H3 | 21.4° | 30.2° |
| O7 | C10 | C17 | O8 | 176.6° | 62.5° |
| O7 | C10 | C17 | H31 | 52.9° | 57.7° |
| O16 | C18 | C19 | C | 117.2° | 120.0° |
| O16 | C18 | C19 | H18 | 122.0° | 119.9° |
| O16 | C18 | C | H18 | 122.5° | 120.0° |
| O16 | C18 | C19 | C22 | 60.5° | 64.5° |
| O16 | C18 | C | C12 | 130.5° | 65.8° |
| C18 | O16 | C6 | H6 | 39.2° | 48.7° |
| O16 | C18 | C19 | H19 | 59.5° | 55.5° |
| O16 | C18 | C19 | H19A | 178.9° | 175.5° |
| O16 | C18 | C | H | 109.4° | 174.2° |
| O16 | C18 | C | HA | 15.7° | 54.2° |
| C19 | C18 | C | H18 | 123.9° | 120.0° |
| C18 | C19 | C22 | H19 | 120.0° | 120.0° |
| C18 | C19 | C22 | H19A | 118.4° | 119.9° |
| C18 | C19 | C22 | C14 | 71.6° | 174.4° |
| C18 | C19 | C22 | C13 | 167.0° | 65.5° |
| C19 | C18 | C | C12 | 115.9° | 174.2° |
| C18 | C19 | H19 | H19A | 118.5° | 119.9° |
| C18 | C19 | C22 | H22 | 46.9° | 54.4° |
| C19 | C18 | C | H | 4.1° | 54.2° |
| C19 | C18 | C | HA | 129.3° | 65.8° |
| C | C18 | C19 | C22 | 177.6° | 175.5° |
| C18 | C | C12 | H | 120.0° | 120.0° |
| C18 | C | C12 | HA | 114.8° | 120.0° |
| C18 | C | C12 | C16 | 157.0° | 65.9° |
| C18 | C | C12 | C15 | 33.7° | 174.1° |
| C | C18 | C19 | H19 | 57.7° | 64.5° |
| C | C18 | C19 | H19A | 63.9° | 55.5° |
| C18 | C | H | HA | 115.6° | 120.0° |
| C18 | C | C12 | H12 | 80.4° | 54.1° |
| C19 | C22 | C14 | C13 | 120.4° | 120.1° |
| C19 | C22 | C14 | H22 | 119.5° | 120.0° |
| C19 | C22 | C13 | H22 | 119.6° | 119.9° |
| C22 | C19 | C18 | H18 | 61.6° | 55.4° |
| C22 | C19 | H19 | H19A | 118.5° | 120.0° |
| C19 | C22 | C14 | H14 | 90.8° | 175.0° |
| C19 | C22 | C14 | H14A | 149.2° | 55.0° |
| C19 | C22 | C14 | H14B | 29.2° | 64.9° |
| C19 | C22 | C13 | H13 | 83.6° | 60.0° |
| C19 | C22 | C13 | H13A | 156.4° | 180.0° |
| C19 | C22 | C13 | H13B | 36.4° | 60.1° |
| C14 | C22 | C13 | H22 | 118.5° | 120.0° |
| C14 | C22 | C19 | H19 | 168.4° | 54.4° |
| C14 | C22 | C19 | H19A | 46.9° | 65.7° |
| C22 | C14 | H14 | H14A | 120.0° | 120.0° |
| C22 | C14 | H14 | H14B | 120.0° | 120.0° |
| C22 | C14 | H14A | H14B | 120.0° | 119.9° |
| C14 | C22 | C13 | H13 | 38.3° | 180.0° |
| C14 | C22 | C13 | H13A | 81.7° | 60.0° |
| C14 | C22 | C13 | H13B | 158.3° | 60.0° |
| C13 | C22 | C19 | H19 | 47.0° | 174.4° |
| C13 | C22 | C19 | H19A | 74.6° | 54.4° |
| C13 | C22 | C14 | H14 | 148.8° | 64.9° |
| C13 | C22 | C14 | H14A | 28.7° | 175.1° |
| C13 | C22 | C14 | H14B | 91.2° | 55.1° |
| C22 | C13 | H13 | H13A | 120.0° | 120.0° |
| C22 | C13 | H13 | H13B | 120.0° | 120.0° |
| C22 | C13 | H13A | H13B | 120.0° | 120.0° |
| O61 | C57 | C4 | H4 | 37.8° | 55.0° |
| O61 | C57 | H57 | H57A | 121.7° | 120.0° |
| C | C12 | C16 | C15 | 128.5° | 120.0° |
| C | C12 | C16 | H12 | 116.6° | 120.0° |
| C | C12 | C15 | H12 | 115.5° | 120.0° |
| C12 | C | C18 | H18 | 8.1° | 54.1° |
| C12 | C | H | HA | 115.6° | 120.0° |
| C | C12 | C16 | H16 | 57.7° | 60.0° |
| C | C12 | C16 | H16A | 177.8° | 180.0° |
| C | C12 | C16 | H16B | 62.2° | 60.0° |
| C | C12 | C15 | H15 | 144.9° | 60.0° |
| C | C12 | C15 | H15A | 95.1° | 180.0° |
| C | C12 | C15 | H15B | 24.9° | 60.0° |
| C16 | C12 | C15 | H12 | 122.5° | 120.0° |
| C16 | C12 | C | H | 37.0° | 54.1° |
| C16 | C12 | C | HA | 88.2° | 174.1° |
| C12 | C16 | H16 | H16A | 120.0° | 120.0° |
| C12 | C16 | H16 | H16B | 120.0° | 120.0° |
| C12 | C16 | H16A | H16B | 120.0° | 120.0° |
| C16 | C12 | C15 | H15 | 22.9° | 180.0° |
| C16 | C12 | C15 | H15A | 142.9° | 60.0° |
| C16 | C12 | C15 | H15B | 97.1° | 60.0° |
| C15 | C12 | C | H | 86.3° | 65.9° |
| C15 | C12 | C | HA | 148.6° | 54.1° |
| C15 | C12 | C16 | H16 | 173.8° | 60.0° |
| C15 | C12 | C16 | H16A | 53.7° | 60.0° |
| C15 | C12 | C16 | H16B | 66.3° | 180.0° |
| C12 | C15 | H15 | H15A | 120.0° | 120.0° |
| C12 | C15 | H15 | H15B | 120.0° | 120.0° |
| C12 | C15 | H15A | H15B | 120.0° | 120.0° |
| O71 | C10 | C17 | H10 | 114.1° | 120.1° |
| O71 | C10 | C17 | C191 | 50.3° | 57.7° |
| C10 | O71 | C181 | C20 | 51.3° | 61.2° |
| O71 | C10 | C17 | O8 | 65.2° | 177.5° |
| O71 | C10 | C17 | H31 | 171.0° | 62.2° |
| C10 | O71 | C181 | C21 | 64.3° | 178.8° |
| C10 | O71 | C181 | H32 | 172.1° | 58.8° |
| C17 | C10 | O71 | C181 | 49.1° | 61.2° |
| C10 | C17 | C191 | O8 | 115.6° | 119.9° |
| C10 | C17 | C191 | H31 | 120.7° | 119.8° |
| C10 | C17 | C191 | C20 | 48.9° | 57.0° |
| C10 | C17 | O8 | H31 | 120.3° | 120.1° |
| C10 | C17 | C191 | O9 | 164.6° | 62.9° |
| C10 | C17 | C191 | H33 | 72.9° | 176.9° |
| C10 | C17 | O8 | H37 | 9.8° | 60.0° |
| O71 | C181 | C20 | C21 | 115.5° | 120.0° |
| O71 | C181 | C20 | H32 | 120.9° | 120.0° |
| O71 | C181 | C20 | C191 | 58.6° | 57.6° |
| C181 | O71 | C10 | H10 | 174.9° | 58.8° |
| O71 | C181 | C21 | H32 | 120.5° | 120.0° |
| O71 | C181 | C20 | O10 | 175.1° | 62.3° |
| O71 | C181 | C20 | H34 | 60.7° | 177.5° |
| O71 | C181 | C21 | H35 | 1.2° | 175.0° |
| O71 | C181 | C21 | O11 | 118.8° | 65.0° |
| O71 | C181 | C21 | H36 | 121.2° | 55.0° |
| C17 | C191 | C20 | C181 | 56.4° | 57.0° |
| C17 | C191 | C20 | O9 | 114.2° | 119.9° |
| C17 | C191 | C20 | H33 | 123.2° | 119.8° |
| C191 | C17 | C10 | H10 | 164.5° | 62.4° |
| C191 | C17 | O8 | H31 | 120.4° | 120.2° |
| C17 | C191 | O9 | H33 | 123.1° | 120.2° |
| C17 | C191 | C20 | O10 | 171.3° | 62.9° |
| C17 | C191 | C20 | H34 | 64.4° | 176.9° |
| C191 | C17 | O8 | H37 | 109.5° | 179.7° |
| C17 | C191 | O9 | H38 | 2.7° | 60.0° |
| C181 | C20 | C191 | O10 | 114.9° | 119.9° |
| C181 | C20 | C191 | H34 | 120.8° | 119.9° |
| C20 | C181 | C21 | H32 | 120.5° | 120.0° |
| C181 | C20 | C191 | O9 | 170.5° | 62.9° |
| C181 | C20 | C191 | H33 | 66.8° | 176.9° |
| C181 | C20 | O10 | H34 | 120.3° | 120.2° |
| C20 | C181 | C21 | H35 | 117.8° | 55.0° |
| C20 | C181 | C21 | O11 | 122.2° | 175.1° |
| C20 | C181 | C21 | H36 | 2.2° | 65.0° |
| C181 | C20 | O10 | H39 | 178.6° | 180.0° |
| C20 | C191 | C17 | O8 | 66.7° | 176.9° |
| C20 | C191 | C17 | H31 | 169.5° | 62.8° |
| C191 | C20 | C181 | C21 | 56.9° | 177.6° |
| C191 | C20 | C181 | H32 | 179.5° | 62.4° |
| C20 | C191 | O9 | H33 | 121.9° | 120.2° |
| C191 | C20 | O10 | H34 | 119.0° | 120.2° |
| C20 | C191 | O9 | H38 | 112.4° | 179.6° |
| C191 | C20 | O10 | H39 | 60.8° | 60.3° |
| H1 | C1 | C2 | H2 | 177.3° | 177.2° |
| H1 | C1 | C6 | H6 | 177.0° | 177.7° |
| H1 | C1 | O49 | HO49 | 62.0° | 59.8° |
| H2 | C2 | C3 | H3 | 175.5° | 177.2° |
| H2 | C2 | O55 | HO55 | 139.2° | 60.1° |
| H3 | C3 | C4 | H4 | 172.8° | 177.7° |
| H4 | C4 | C57 | H57 | 82.2° | 65.0° |
| H4 | C4 | C57 | H57A | 159.4° | 175.0° |
| H18 | C18 | C19 | H19 | 178.5° | 175.5° |
| H18 | C18 | C19 | H19A | 56.9° | 64.6° |
| H18 | C18 | C | H | 128.1° | 65.8° |
| H18 | C18 | C | HA | 106.8° | 174.2° |
| H19 | C19 | C22 | H22 | 73.1° | 65.6° |
| H19A | C19 | C22 | H22 | 165.4° | 174.3° |
| H22 | C22 | C14 | H14 | 28.8° | 55.1° |
| H22 | C22 | C14 | H14A | 91.3° | 64.9° |
| H22 | C22 | C14 | H14B | 148.7° | 175.1° |
| H22 | C22 | C13 | H13 | 156.8° | 60.0° |
| H22 | C22 | C13 | H13A | 36.8° | 60.0° |
| H22 | C22 | C13 | H13B | 83.2° | 180.0° |
| H57 | C57 | O61 | HO61 | 31.3° | 60.0° |
| H57A | C57 | O61 | HO61 | 149.7° | 60.0° |
| H10 | C10 | C17 | O8 | 48.9° | 57.5° |
| H10 | C10 | C17 | H31 | 74.9° | 177.7° |
| H14 | C14 | H14A | H14B | 120.0° | 120.1° |
| H13 | C13 | H13A | H13B | 120.0° | 120.1° |
| H | C | C12 | H12 | 159.6° | 174.1° |
| HA | C | C12 | H12 | 34.5° | 65.9° |
| H12 | C12 | C16 | H16 | 58.8° | 180.0° |
| H12 | C12 | C16 | H16A | 61.2° | 60.0° |
| H12 | C12 | C16 | H16B | 178.8° | 60.0° |
| H12 | C12 | C15 | H15 | 99.5° | 60.0° |
| H12 | C12 | C15 | H15A | 20.5° | 60.0° |
| H12 | C12 | C15 | H15B | 140.5° | 180.0° |
| H16 | C16 | H16A | H16B | 120.0° | 120.0° |
| H15 | C15 | H15A | H15B | 120.0° | 119.9° |
| O8 | C17 | C191 | O9 | 49.0° | 57.0° |
| O8 | C17 | C191 | H33 | 171.5° | 63.2° |
| H31 | C17 | C191 | O9 | 74.7° | 177.3° |
| H31 | C17 | C191 | H33 | 47.8° | 57.1° |
| H31 | C17 | O8 | H37 | 130.1° | 60.1° |
| C21 | C181 | C20 | O10 | 59.6° | 57.7° |
| C21 | C181 | C20 | H34 | 176.2° | 62.5° |
| C181 | C21 | H35 | O11 | 120.0° | 120.1° |
| C181 | C21 | H35 | H36 | 120.0° | 120.0° |
| C181 | C21 | O11 | H36 | 120.0° | 120.0° |
| C181 | C21 | O11 | H40 | 93.0° | 180.0° |
| H32 | C181 | C20 | O10 | 64.0° | 177.7° |
| H32 | C181 | C20 | H34 | 60.1° | 57.5° |
| H32 | C181 | C21 | H35 | 121.7° | 65.0° |
| H32 | C181 | C21 | O11 | 1.7° | 55.1° |
| H32 | C181 | C21 | H36 | 118.3° | 175.0° |
| O9 | C191 | C20 | O10 | 74.5° | 177.2° |
| O9 | C191 | C20 | H34 | 49.8° | 57.0° |
| H33 | C191 | C20 | O10 | 48.2° | 57.0° |
| H33 | C191 | C20 | H34 | 172.4° | 63.2° |
| H33 | C191 | O9 | H38 | 125.8° | 60.2° |
| H34 | C20 | O10 | H39 | 58.2° | 59.8° |
| H35 | C21 | O11 | H36 | 120.0° | 120.0° |
| H35 | C21 | O11 | H40 | 147.0° | 59.9° |
| H36 | C21 | O11 | H40 | 27.0° | 60.0° |
