660
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O24 | P22 | doub | 1.48Å | 1.46Å | |
| O36 | C41 | sing | 1.43Å | 1.40Å | |
| O36 | C37 | sing | 1.43Å | 1.40Å | |
| C41 | C40 | sing | 1.53Å | 1.52Å | |
| C41 | C45 | sing | 1.53Å | 1.52Å | |
| C40 | O44 | sing | 1.43Å | 1.40Å | |
| C40 | C39 | sing | 1.53Å | 1.53Å | |
| P22 | O23 | sing | 1.61Å | 1.46Å | |
| P22 | C45 | sing | 1.82Å | 1.86Å | |
| P22 | O12 | sing | 1.61Å | 1.65Å | |
| O47 | C46 | sing | 1.43Å | 1.40Å | |
| C46 | C37 | sing | 1.53Å | 1.53Å | |
| C37 | C38 | sing | 1.53Å | 1.53Å | |
| O12 | P9 | sing | 1.61Å | 1.65Å | |
| C38 | C39 | sing | 1.53Å | 1.53Å | |
| C38 | O42 | sing | 1.43Å | 1.40Å | |
| C39 | O43 | sing | 1.43Å | 1.40Å | |
| P9 | O11 | doub | 1.48Å | 1.46Å | |
| P9 | O10 | sing | 1.61Å | 1.46Å | |
| P9 | O8 | sing | 1.61Å | 1.65Å | |
| O8 | C5 | sing | 1.43Å | 1.40Å | |
| C5 | C4 | sing | 1.53Å | 1.50Å | |
| C4 | C3 | sing | 1.54Å | 1.49Å | |
| C4 | O6 | sing | 1.44Å | 1.48Å | |
| C3 | O7 | sing | 1.43Å | 1.44Å | |
| C3 | C2 | sing | 1.55Å | 1.47Å | |
| O6 | C1 | sing | 1.44Å | 1.48Å | |
| C2 | C1 | sing | 1.55Å | 1.48Å | |
| C2 | O21 | sing | 1.43Å | 1.44Å | |
| C18 | C17 | doub | 1.35Å | 1.35Å | |
| C18 | N13 | sing | 1.37Å | 1.49Å | |
| C1 | N13 | sing | 1.46Å | 1.42Å | |
| C17 | C20 | sing | 1.42Å | 1.53Å | |
| N13 | C19 | sing | 1.35Å | 1.46Å | |
| C20 | O20 | doub | 1.22Å | 1.19Å | |
| C20 | N15 | sing | 1.35Å | 1.42Å | |
| C19 | N15 | sing | 1.35Å | 1.42Å | |
| C19 | O19 | doub | 1.22Å | 1.19Å | |
| 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 | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| O7 | H7 | sing | 0.97Å | 0.95Å | |
| O10 | H8 | sing | 0.97Å | 0.95Å | |
| N15 | H9 | sing | 0.97Å | 1.00Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C18 | H11 | sing | 1.08Å | 1.08Å | |
| O21 | H12 | sing | 0.97Å | 0.95Å | |
| O23 | H13 | sing | 0.97Å | 0.95Å | |
| C37 | H14 | sing | 1.09Å | 1.10Å | |
| C38 | H15 | sing | 1.09Å | 1.10Å | |
| C39 | H16 | sing | 1.09Å | 1.10Å | |
| C40 | H17 | sing | 1.09Å | 1.10Å | |
| C41 | H18 | sing | 1.09Å | 1.10Å | |
| O42 | H19 | sing | 0.97Å | 0.95Å | |
| O43 | H20 | sing | 0.97Å | 0.95Å | |
| O44 | H21 | sing | 0.97Å | 0.95Å | |
| C45 | H22 | sing | 1.09Å | 1.10Å | |
| C45 | H23 | sing | 1.09Å | 1.10Å | |
| C46 | H24 | sing | 1.09Å | 1.10Å | |
| C46 | H25 | sing | 1.09Å | 1.10Å | |
| O47 | H26 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O24 | P22 | O23 | 100.7° | 109.5° |
| O24 | P22 | C45 | 111.2° | 109.5° |
| O24 | P22 | O12 | 111.3° | 109.5° |
| C41 | O36 | C37 | 114.8° | 114.1° |
| O36 | C41 | C40 | 109.2° | 109.4° |
| O36 | C41 | C45 | 109.9° | 109.5° |
| O36 | C41 | H18 | 110.8° | 109.5° |
| O36 | C37 | C46 | 109.6° | 109.5° |
| O36 | C37 | C38 | 110.2° | 109.4° |
| O36 | C37 | H14 | 110.6° | 109.5° |
| C40 | C41 | C45 | 108.9° | 109.5° |
| C41 | C40 | O44 | 109.3° | 109.5° |
| C41 | C40 | C39 | 108.4° | 109.1° |
| C41 | C40 | H17 | 109.2° | 109.6° |
| C40 | C41 | H18 | 109.0° | 109.5° |
| C41 | C45 | P22 | 111.2° | 109.5° |
| C45 | C41 | H18 | 109.0° | 109.5° |
| C41 | C45 | H22 | 109.1° | 109.4° |
| C41 | C45 | H23 | 109.1° | 109.5° |
| O44 | C40 | C39 | 109.7° | 109.5° |
| O44 | C40 | H17 | 111.0° | 109.5° |
| C40 | O44 | H21 | 109.5° | 114.1° |
| C40 | C39 | C38 | 109.8° | 109.1° |
| C40 | C39 | O43 | 109.2° | 109.5° |
| C40 | C39 | H16 | 108.8° | 109.7° |
| C39 | C40 | H17 | 109.2° | 109.5° |
| O23 | P22 | C45 | 111.5° | 109.5° |
| O23 | P22 | O12 | 111.3° | 109.5° |
| P22 | O23 | H13 | 109.5° | 114.0° |
| C45 | P22 | O12 | 110.4° | 109.5° |
| P22 | C45 | H22 | 109.0° | 109.5° |
| P22 | C45 | H23 | 109.0° | 109.5° |
| P22 | O12 | P9 | 125.4° | 134.0° |
| O47 | C46 | C37 | 109.8° | 109.4° |
| O47 | C46 | H24 | 109.4° | 109.5° |
| O47 | C46 | H25 | 109.4° | 109.5° |
| C46 | O47 | H26 | 109.5° | 114.0° |
| C46 | C37 | C38 | 108.7° | 109.5° |
| C46 | C37 | H14 | 108.8° | 109.5° |
| C37 | C46 | H24 | 109.4° | 109.5° |
| C37 | C46 | H25 | 109.4° | 109.4° |
| C37 | C38 | C39 | 109.9° | 109.1° |
| C37 | C38 | O42 | 109.1° | 109.5° |
| C38 | C37 | H14 | 108.9° | 109.4° |
| C37 | C38 | H15 | 108.9° | 109.5° |
| O12 | P9 | O11 | 111.0° | 109.5° |
| O12 | P9 | O10 | 110.1° | 109.5° |
| O12 | P9 | O8 | 112.1° | 109.5° |
| C39 | C38 | O42 | 109.5° | 109.6° |
| C38 | C39 | O43 | 109.5° | 109.5° |
| C39 | C38 | H15 | 108.9° | 109.5° |
| C38 | C39 | H16 | 108.8° | 109.6° |
| O42 | C38 | H15 | 110.6° | 109.6° |
| C38 | O42 | H19 | 109.5° | 114.0° |
| O43 | C39 | H16 | 110.6° | 109.5° |
| C39 | O43 | H20 | 109.5° | 114.0° |
| O11 | P9 | O10 | 101.3° | 109.5° |
| O11 | P9 | O8 | 111.5° | 109.5° |
| O10 | P9 | O8 | 110.3° | 109.5° |
| P9 | O10 | H8 | 109.5° | 114.0° |
| P9 | O8 | C5 | 119.3° | 123.0° |
| O8 | C5 | C4 | 110.7° | 109.5° |
| O8 | C5 | H5 | 109.1° | 109.5° |
| O8 | C5 | H6 | 109.1° | 109.5° |
| C5 | C4 | C3 | 110.4° | 109.9° |
| C5 | C4 | O6 | 111.2° | 109.9° |
| C5 | C4 | H4 | 109.4° | 110.0° |
| C4 | C5 | H5 | 109.2° | 109.5° |
| C4 | C5 | H6 | 109.2° | 109.5° |
| C3 | C4 | O6 | 106.9° | 107.4° |
| C4 | C3 | O7 | 109.5° | 110.5° |
| C4 | C3 | C2 | 106.5° | 104.2° |
| C4 | C3 | H3 | 110.2° | 110.6° |
| C3 | C4 | H4 | 109.4° | 109.9° |
| C4 | O6 | C1 | 104.9° | 106.9° |
| O6 | C4 | H4 | 109.5° | 109.7° |
| O7 | C3 | C2 | 109.0° | 110.5° |
| O7 | C3 | H3 | 110.9° | 110.4° |
| C3 | O7 | H7 | 109.5° | 114.1° |
| C3 | C2 | C1 | 104.4° | 102.1° |
| C3 | C2 | O21 | 109.8° | 110.9° |
| C3 | C2 | H2 | 110.7° | 111.0° |
| C2 | C3 | H3 | 110.6° | 110.5° |
| O6 | C1 | C2 | 104.5° | 103.6° |
| O6 | C1 | N13 | 111.6° | 110.6° |
| O6 | C1 | H1 | 109.3° | 110.6° |
| C1 | C2 | O21 | 110.2° | 110.9° |
| C2 | C1 | N13 | 111.7° | 110.6° |
| C2 | C1 | H1 | 109.3° | 110.6° |
| C1 | C2 | H2 | 110.4° | 110.9° |
| O21 | C2 | H2 | 111.0° | 110.8° |
| C2 | O21 | H12 | 109.5° | 114.0° |
| C17 | C18 | N13 | 119.9° | 119.7° |
| C18 | C17 | C20 | 120.4° | 119.1° |
| C18 | C17 | H10 | 119.8° | 120.4° |
| C17 | C18 | H11 | 120.1° | 120.2° |
| C18 | N13 | C1 | 120.8° | 119.7° |
| C18 | N13 | C19 | 119.8° | 120.6° |
| N13 | C18 | H11 | 120.1° | 120.1° |
| C1 | N13 | C19 | 119.4° | 119.7° |
| N13 | C1 | H1 | 110.2° | 110.6° |
| C17 | C20 | O20 | 120.3° | 120.3° |
| C17 | C20 | N15 | 119.8° | 119.5° |
| C20 | C17 | H10 | 119.8° | 120.5° |
| N13 | C19 | N15 | 120.4° | 121.0° |
| N13 | C19 | O19 | 119.8° | 119.5° |
| O20 | C20 | N15 | 119.9° | 120.3° |
| C20 | N15 | C19 | 119.7° | 120.2° |
| C20 | N15 | H9 | 120.1° | 119.9° |
| N15 | C19 | O19 | 119.8° | 119.5° |
| C19 | N15 | H9 | 120.2° | 119.9° |
| H5 | C5 | H6 | 109.5° | 109.5° |
| H22 | C45 | H23 | 109.5° | 109.5° |
| H24 | C46 | H25 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O24 | P22 | C45 | C41 | 3.3° | 55.0° |
| O24 | P22 | O23 | C45 | 118.1° | 120.0° |
| O24 | P22 | O23 | O12 | 118.1° | 120.0° |
| O24 | P22 | C45 | O12 | 124.1° | 120.0° |
| O24 | P22 | O12 | P9 | 155.2° | 60.0° |
| O24 | P22 | O23 | H13 | 0.0° | 180.0° |
| O24 | P22 | C45 | H22 | 117.0° | 65.0° |
| O24 | P22 | C45 | H23 | 123.5° | 175.0° |
| O36 | C41 | C40 | C45 | 120.0° | 120.0° |
| O36 | C41 | C40 | H18 | 121.2° | 120.0° |
| O36 | C41 | C45 | H18 | 121.6° | 120.0° |
| O36 | C41 | C40 | O44 | 178.7° | 177.5° |
| O36 | C41 | C40 | C39 | 59.1° | 57.7° |
| O36 | C41 | C45 | P22 | 90.7° | 65.0° |
| C41 | O36 | C37 | C46 | 180.0° | 178.8° |
| C41 | O36 | C37 | C38 | 60.4° | 61.2° |
| C41 | O36 | C37 | H14 | 60.1° | 58.8° |
| O36 | C41 | C40 | H17 | 59.7° | 62.3° |
| O36 | C41 | C45 | H22 | 149.0° | 55.0° |
| O36 | C41 | C45 | H23 | 29.5° | 174.9° |
| C37 | O36 | C41 | C40 | 63.3° | 61.2° |
| C37 | O36 | C41 | C45 | 56.0° | 58.8° |
| O36 | C37 | C46 | O47 | 77.0° | 65.0° |
| O36 | C37 | C46 | C38 | 120.5° | 120.0° |
| O36 | C37 | C46 | H14 | 121.0° | 120.0° |
| O36 | C37 | C38 | H14 | 121.5° | 119.9° |
| O36 | C37 | C38 | C39 | 53.6° | 57.6° |
| O36 | C37 | C38 | O42 | 173.7° | 177.5° |
| O36 | C37 | C38 | H15 | 65.6° | 62.3° |
| C37 | O36 | C41 | H18 | 176.5° | 178.8° |
| O36 | C37 | C46 | H24 | 43.1° | 175.0° |
| O36 | C37 | C46 | H25 | 162.9° | 55.0° |
| C40 | C41 | C45 | H18 | 118.9° | 120.0° |
| C41 | C40 | O44 | C39 | 118.7° | 119.6° |
| C41 | C40 | O44 | H17 | 120.5° | 120.3° |
| C41 | C40 | C39 | H17 | 118.8° | 120.0° |
| C40 | C41 | C45 | P22 | 149.7° | 175.0° |
| C41 | C40 | C39 | C38 | 55.9° | 57.0° |
| C41 | C40 | C39 | O43 | 176.0° | 176.9° |
| C41 | C40 | C39 | H16 | 63.1° | 62.9° |
| C41 | C40 | O44 | H21 | 180.0° | 179.6° |
| C40 | C41 | C45 | H22 | 29.4° | 65.0° |
| C40 | C41 | C45 | H23 | 90.1° | 55.0° |
| C45 | C41 | C40 | O44 | 58.7° | 57.5° |
| C45 | C41 | C40 | C39 | 60.9° | 62.4° |
| C41 | C45 | P22 | O23 | 114.8° | 65.0° |
| C41 | C45 | P22 | H22 | 120.3° | 120.0° |
| C41 | C45 | P22 | H23 | 120.3° | 120.0° |
| C41 | C45 | P22 | O12 | 120.9° | 175.0° |
| C45 | C41 | C40 | H17 | 179.7° | 177.7° |
| C41 | C45 | H22 | H23 | 119.2° | 119.9° |
| O44 | C40 | C39 | H17 | 121.8° | 120.1° |
| O44 | C40 | C39 | C38 | 175.2° | 176.9° |
| O44 | C40 | C39 | O43 | 64.7° | 63.3° |
| O44 | C40 | C39 | H16 | 56.2° | 56.9° |
| O44 | C40 | C41 | H18 | 60.1° | 62.5° |
| C40 | C39 | C38 | C37 | 53.4° | 57.0° |
| C40 | C39 | C38 | O43 | 120.0° | 119.8° |
| C40 | C39 | C38 | H16 | 119.0° | 120.0° |
| C40 | C39 | C38 | O42 | 173.2° | 176.9° |
| C40 | C39 | O43 | H16 | 119.8° | 120.3° |
| C40 | C39 | C38 | H15 | 65.8° | 62.8° |
| C39 | C40 | C41 | H18 | 179.7° | 177.6° |
| C40 | C39 | O43 | H20 | 180.0° | 179.5° |
| C39 | C40 | O44 | H21 | 61.2° | 60.0° |
| O23 | P22 | C45 | O12 | 124.3° | 120.0° |
| O23 | P22 | O12 | P9 | 43.7° | 60.0° |
| O23 | P22 | C45 | H22 | 5.5° | 175.0° |
| O23 | P22 | C45 | H23 | 124.9° | 55.0° |
| C45 | P22 | O12 | P9 | 80.8° | 180.0° |
| C45 | P22 | O23 | H13 | 118.1° | 60.0° |
| P22 | C45 | C41 | H18 | 30.8° | 55.0° |
| P22 | C45 | H22 | H23 | 119.2° | 120.1° |
| P22 | O12 | P9 | O11 | 60.1° | 45.0° |
| P22 | O12 | P9 | O10 | 171.4° | 75.0° |
| P22 | O12 | P9 | O8 | 65.4° | 165.0° |
| O12 | P22 | O23 | H13 | 118.1° | 60.0° |
| O12 | P22 | C45 | H22 | 118.9° | 55.0° |
| O12 | P22 | C45 | H23 | 0.6° | 65.0° |
| O47 | C46 | C37 | H24 | 120.1° | 120.0° |
| O47 | C46 | C37 | H25 | 120.1° | 120.0° |
| O47 | C46 | C37 | C38 | 162.5° | 175.1° |
| O47 | C46 | C37 | H14 | 44.0° | 55.1° |
| O47 | C46 | H24 | H25 | 119.9° | 120.1° |
| C46 | C37 | C38 | H14 | 118.4° | 120.0° |
| C46 | C37 | C38 | C39 | 173.8° | 177.6° |
| C46 | C37 | C38 | O42 | 66.2° | 62.4° |
| C46 | C37 | C38 | H15 | 54.6° | 57.7° |
| C37 | C46 | H24 | H25 | 119.8° | 120.0° |
| C37 | C46 | O47 | H26 | 180.0° | 180.0° |
| C37 | C38 | C39 | O42 | 119.8° | 119.9° |
| C37 | C38 | C39 | H15 | 119.2° | 119.9° |
| C37 | C38 | O42 | H15 | 119.7° | 120.1° |
| C37 | C38 | C39 | O43 | 173.3° | 176.8° |
| C37 | C38 | C39 | H16 | 65.6° | 63.0° |
| C37 | C38 | O42 | H19 | 180.0° | 60.0° |
| C38 | C37 | C46 | H24 | 77.5° | 55.0° |
| C38 | C37 | C46 | H25 | 42.4° | 65.0° |
| O12 | P9 | O11 | O10 | 116.9° | 120.0° |
| O12 | P9 | O11 | O8 | 125.8° | 120.0° |
| O12 | P9 | O10 | O8 | 124.3° | 120.0° |
| O12 | P9 | O8 | C5 | 76.6° | 175.0° |
| O12 | P9 | O10 | H8 | 117.5° | 60.0° |
| C39 | C38 | O42 | H15 | 120.0° | 120.2° |
| C38 | C39 | O43 | H16 | 119.9° | 120.2° |
| C39 | C38 | C37 | H14 | 67.8° | 62.4° |
| C38 | C39 | C40 | H17 | 63.0° | 63.0° |
| C39 | C38 | O42 | H19 | 59.7° | 179.6° |
| C38 | C39 | O43 | H20 | 59.7° | 60.0° |
| O42 | C38 | C39 | O43 | 66.9° | 63.3° |
| O42 | C38 | C37 | H14 | 52.2° | 57.6° |
| O42 | C38 | C39 | H16 | 54.2° | 56.9° |
| O43 | C39 | C38 | H15 | 54.1° | 57.0° |
| O43 | C39 | C40 | H17 | 57.1° | 56.8° |
| O11 | P9 | O10 | O8 | 118.2° | 120.0° |
| O11 | P9 | O8 | C5 | 48.5° | 55.0° |
| O11 | P9 | O10 | H8 | 0.0° | 180.0° |
| O10 | P9 | O8 | C5 | 160.3° | 64.9° |
| P9 | O8 | C5 | C4 | 125.6° | 180.0° |
| P9 | O8 | C5 | H5 | 5.4° | 60.0° |
| P9 | O8 | C5 | H6 | 114.2° | 59.9° |
| O8 | P9 | O10 | H8 | 118.2° | 60.0° |
| O8 | C5 | C4 | H5 | 120.2° | 120.0° |
| O8 | C5 | C4 | H6 | 120.2° | 120.0° |
| O8 | C5 | C4 | C3 | 88.0° | 175.0° |
| O8 | C5 | C4 | O6 | 30.5° | 67.0° |
| O8 | C5 | C4 | H4 | 151.6° | 53.9° |
| O8 | C5 | H5 | H6 | 119.4° | 120.0° |
| C5 | C4 | C3 | O6 | 121.1° | 119.6° |
| C5 | C4 | C3 | H4 | 120.4° | 121.1° |
| C5 | C4 | O6 | H4 | 121.0° | 121.1° |
| C5 | C4 | C3 | O7 | 127.6° | 119.9° |
| C5 | C4 | C3 | C2 | 114.7° | 121.5° |
| C5 | C4 | O6 | C1 | 136.5° | 145.8° |
| C5 | C4 | C3 | H3 | 5.3° | 2.7° |
| C4 | C5 | H5 | H6 | 119.5° | 120.0° |
| C3 | C4 | O6 | H4 | 118.4° | 119.4° |
| C4 | C3 | O7 | C2 | 116.1° | 114.8° |
| C4 | C3 | O7 | H3 | 121.9° | 122.7° |
| C4 | C3 | C2 | H3 | 119.8° | 118.8° |
| C3 | C4 | O6 | C1 | 15.9° | 26.3° |
| C4 | C3 | C2 | C1 | 26.0° | 20.9° |
| C4 | C3 | C2 | O21 | 144.2° | 139.0° |
| C4 | C3 | C2 | H2 | 92.8° | 97.3° |
| C3 | C4 | C5 | H5 | 32.2° | 55.0° |
| C3 | C4 | C5 | H6 | 151.9° | 65.0° |
| C4 | C3 | O7 | H7 | 180.0° | 176.2° |
| O6 | C4 | C3 | O7 | 111.4° | 120.6° |
| O6 | C4 | C3 | C2 | 6.3° | 1.9° |
| C4 | O6 | C1 | C2 | 32.0° | 39.8° |
| C4 | O6 | C1 | N13 | 152.9° | 158.4° |
| C4 | O6 | C1 | H1 | 84.9° | 78.7° |
| O6 | C4 | C3 | H3 | 126.3° | 116.8° |
| O6 | C4 | C5 | H5 | 150.7° | 173.0° |
| O6 | C4 | C5 | H6 | 89.6° | 53.0° |
| O7 | C3 | C2 | H3 | 122.2° | 122.5° |
| O7 | C3 | C2 | C1 | 92.0° | 97.8° |
| O7 | C3 | C2 | O21 | 26.2° | 20.3° |
| O7 | C3 | C2 | H2 | 149.2° | 144.0° |
| O7 | C3 | C4 | H4 | 7.1° | 1.3° |
| C3 | C2 | C1 | O6 | 36.1° | 36.9° |
| C3 | C2 | C1 | O21 | 117.9° | 118.2° |
| C3 | C2 | C1 | H2 | 119.0° | 118.2° |
| C3 | C2 | O21 | H2 | 122.7° | 123.7° |
| C3 | C2 | C1 | N13 | 157.0° | 155.5° |
| C3 | C2 | C1 | H1 | 80.8° | 81.6° |
| C2 | C3 | C4 | H4 | 124.9° | 117.4° |
| C2 | C3 | O7 | H7 | 63.8° | 61.4° |
| C3 | C2 | O21 | H12 | 180.0° | 67.3° |
| O6 | C1 | C2 | N13 | 120.9° | 118.6° |
| O6 | C1 | C2 | H1 | 116.9° | 118.6° |
| O6 | C1 | C2 | O21 | 154.0° | 155.1° |
| O6 | C1 | N13 | C18 | 61.7° | 51.7° |
| O6 | C1 | N13 | H1 | 121.7° | 122.9° |
| O6 | C1 | N13 | C19 | 118.3° | 128.5° |
| O6 | C1 | C2 | H2 | 82.9° | 81.3° |
| C1 | O6 | C4 | H4 | 102.6° | 93.1° |
| C1 | C2 | O21 | H2 | 122.7° | 123.6° |
| C2 | C1 | N13 | C18 | 55.0° | 62.6° |
| C2 | C1 | N13 | H1 | 121.7° | 122.9° |
| C2 | C1 | N13 | C19 | 125.1° | 117.2° |
| C1 | C2 | C3 | H3 | 145.8° | 139.7° |
| C1 | C2 | O21 | H12 | 65.5° | 180.0° |
| O21 | C2 | C1 | N13 | 85.1° | 86.3° |
| O21 | C2 | C1 | H1 | 37.1° | 36.6° |
| O21 | C2 | C3 | H3 | 96.0° | 102.1° |
| C17 | C18 | N13 | H11 | 180.0° | 180.0° |
| C17 | C18 | N13 | C1 | 179.9° | 180.0° |
| C18 | C17 | C20 | H10 | 180.0° | 179.7° |
| C17 | C18 | N13 | C19 | 0.0° | 0.2° |
| C18 | C17 | C20 | O20 | 180.0° | 179.8° |
| C18 | C17 | C20 | N15 | 0.1° | 0.2° |
| C18 | N13 | C1 | C19 | 179.9° | 179.8° |
| N13 | C18 | C17 | C20 | 0.0° | 0.0° |
| C18 | N13 | C19 | N15 | 0.1° | 0.2° |
| C18 | N13 | C19 | O19 | 179.9° | 179.7° |
| C18 | N13 | C1 | H1 | 176.6° | 174.5° |
| N13 | C18 | C17 | H10 | 180.0° | 179.8° |
| C1 | N13 | C19 | N15 | 179.8° | 180.0° |
| C1 | N13 | C19 | O19 | 0.0° | 0.1° |
| N13 | C1 | C2 | H2 | 38.0° | 37.3° |
| C1 | N13 | C18 | H11 | 0.1° | 0.0° |
| C17 | C20 | O20 | N15 | 179.9° | 180.0° |
| C17 | C20 | N15 | C19 | 0.1° | 0.3° |
| C17 | C20 | N15 | H9 | 179.8° | 179.7° |
| C20 | C17 | C18 | H11 | 180.0° | 180.0° |
| N13 | C19 | N15 | C20 | 0.1° | 0.1° |
| N13 | C19 | N15 | O19 | 179.8° | 179.9° |
| C19 | N13 | C1 | H1 | 3.4° | 5.6° |
| N13 | C19 | N15 | H9 | 179.8° | 179.9° |
| C19 | N13 | C18 | H11 | 180.0° | 179.8° |
| O20 | C20 | N15 | C19 | 179.9° | 179.8° |
| O20 | C20 | N15 | H9 | 0.1° | 0.3° |
| O20 | C20 | C17 | H10 | 0.0° | 0.1° |
| C20 | N15 | C19 | H9 | 180.0° | 179.9° |
| C20 | N15 | C19 | O19 | 179.9° | 180.0° |
| N15 | C20 | C17 | H10 | 179.9° | 180.0° |
| O19 | C19 | N15 | H9 | 0.0° | 0.0° |
| H1 | C1 | C2 | H2 | 160.2° | 160.1° |
| H2 | C2 | C3 | H3 | 26.9° | 21.5° |
| H2 | C2 | O21 | H12 | 57.3° | 56.4° |
| H3 | C3 | C4 | H4 | 115.2° | 123.8° |
| H3 | C3 | O7 | H7 | 58.2° | 61.1° |
| H4 | C4 | C5 | H5 | 88.2° | 66.1° |
| H4 | C4 | C5 | H6 | 31.4° | 173.9° |
| H10 | C17 | C18 | H11 | 0.0° | 0.3° |
| H14 | C37 | C38 | H15 | 173.0° | 177.8° |
| H14 | C37 | C46 | H24 | 164.1° | 65.0° |
| H14 | C37 | C46 | H25 | 76.0° | 175.0° |
| H15 | C38 | C39 | H16 | 175.2° | 177.1° |
| H15 | C38 | O42 | H19 | 60.2° | 60.2° |
| H16 | C39 | C40 | H17 | 178.0° | 177.1° |
| H16 | C39 | O43 | H20 | 60.2° | 60.2° |
| H17 | C40 | C41 | H18 | 61.5° | 57.7° |
| H17 | C40 | O44 | H21 | 59.5° | 60.1° |
| H18 | C41 | C45 | H22 | 89.4° | 175.0° |
| H18 | C41 | C45 | H23 | 151.1° | 65.0° |
| H24 | C46 | O47 | H26 | 59.9° | 60.0° |
| H25 | C46 | O47 | H26 | 60.0° | 60.0° |
