PRD_900007
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2D | C2D | sing | 1.43Å | 1.44Å | |
| C2D | C1D | sing | 1.53Å | 1.53Å | |
| C2D | C3D | sing | 1.53Å | 1.52Å | |
| C1D | O5D | sing | 1.43Å | 1.42Å | |
| O5D | C5D | sing | 1.43Å | 1.43Å | |
| O3D | C3D | sing | 1.43Å | 1.44Å | |
| C3D | C4D | sing | 1.53Å | 1.52Å | |
| O6C | C6C | sing | 1.43Å | 1.43Å | |
| C4D | C5D | sing | 1.53Å | 1.52Å | |
| C4D | O4D | sing | 1.43Å | 1.42Å | |
| C5D | C6D | sing | 1.53Å | 1.52Å | |
| O5C | C1C | sing | 1.43Å | 1.42Å | |
| O5C | C5C | sing | 1.43Å | 1.44Å | |
| C6C | C5C | sing | 1.53Å | 1.53Å | |
| C6D | O6D | sing | 1.43Å | 1.43Å | |
| C1C | O4D | sing | 1.43Å | 1.43Å | |
| C1C | C2C | sing | 1.53Å | 1.51Å | |
| O3A | C3A | sing | 1.43Å | 1.43Å | |
| C5C | C4C | sing | 1.53Å | 1.52Å | |
| C3A | C4A | sing | 1.53Å | 1.52Å | |
| C3A | C2A | sing | 1.53Å | 1.52Å | |
| O4A | C4A | sing | 1.43Å | 1.42Å | |
| O2A | C2A | sing | 1.43Å | 1.43Å | |
| C2C | O2C | sing | 1.43Å | 1.44Å | |
| C2C | C3C | sing | 1.53Å | 1.52Å | |
| C4C | C3C | sing | 1.53Å | 1.53Å | |
| C4C | O4C | sing | 1.43Å | 1.43Å | |
| C6B | C5B | sing | 1.53Å | 1.52Å | |
| C4A | C5A | sing | 1.50Å | 1.51Å | |
| C2A | C1A | sing | 1.53Å | 1.53Å | |
| N4B | C1A | sing | 1.47Å | 1.49Å | |
| N4B | C4B | sing | 1.47Å | 1.49Å | |
| C5B | C4B | sing | 1.53Å | 1.53Å | |
| C5B | O5B | sing | 1.43Å | 1.43Å | |
| C3C | O3C | sing | 1.43Å | 1.43Å | |
| O4C | C1B | sing | 1.43Å | 1.42Å | |
| C1A | C7A | sing | 1.50Å | 1.50Å | |
| C4B | C3B | sing | 1.53Å | 1.52Å | |
| O5B | C1B | sing | 1.43Å | 1.42Å | |
| C5A | C7A | doub | 1.29Å | 1.34Å | |
| C5A | C6A | sing | 1.51Å | 1.51Å | |
| C3B | O3B | sing | 1.43Å | 1.42Å | |
| C3B | C2B | sing | 1.53Å | 1.53Å | |
| C1B | C2B | sing | 1.53Å | 1.52Å | |
| C6A | O6A | sing | 1.43Å | 1.42Å | |
| C2B | O2B | sing | 1.43Å | 1.43Å | |
| C1D | O1D | sing | 1.43Å | 1.45Å | |
| C1A | H1A | sing | 1.09Å | 1.10Å | |
| C2A | H2A | sing | 1.09Å | 1.10Å | |
| C3A | H3A | sing | 1.09Å | 1.10Å | |
| C4A | H4A | sing | 1.09Å | 1.10Å | |
| C6A | H6A1 | sing | 1.09Å | 1.10Å | |
| C6A | H6A2 | sing | 1.09Å | 1.10Å | |
| C7A | H7A | sing | 1.08Å | 1.08Å | |
| O2A | HOA2 | sing | 0.97Å | 0.95Å | |
| O3A | HOA3 | sing | 0.97Å | 0.95Å | |
| O4A | HOA4 | sing | 0.97Å | 0.95Å | |
| O6A | HOA6 | sing | 0.97Å | 0.95Å | |
| C1B | H1B | sing | 1.09Å | 1.10Å | |
| C2B | H2B | sing | 1.09Å | 1.10Å | |
| C3B | H3B | sing | 1.09Å | 1.10Å | |
| C4B | H4B | sing | 1.09Å | 1.10Å | |
| C5B | H5B | sing | 1.09Å | 1.10Å | |
| C6B | H6B2 | sing | 1.09Å | 1.10Å | |
| C6B | H6B3 | sing | 1.09Å | 1.10Å | |
| C6B | H6B1 | sing | 1.09Å | 1.10Å | |
| N4B | HN4 | sing | 1.01Å | 1.00Å | |
| O2B | HOB2 | sing | 0.97Å | 0.95Å | |
| O3B | HOB3 | sing | 0.97Å | 0.95Å | |
| C1C | H1C | sing | 1.09Å | 1.10Å | |
| C2C | H2C | sing | 1.09Å | 1.10Å | |
| C3C | H3C | sing | 1.09Å | 1.10Å | |
| C4C | H4C | sing | 1.09Å | 1.10Å | |
| C5C | H5C | sing | 1.09Å | 1.10Å | |
| C6C | H6C2 | sing | 1.09Å | 1.10Å | |
| C6C | H6C1 | sing | 1.09Å | 1.10Å | |
| O2C | HOC2 | sing | 0.97Å | 0.95Å | |
| O3C | HOC3 | sing | 0.97Å | 0.95Å | |
| O6C | HOC6 | sing | 0.97Å | 0.95Å | |
| C1D | H1D | sing | 1.09Å | 1.10Å | |
| C2D | H2D | sing | 1.09Å | 1.10Å | |
| C3D | H3D | sing | 1.09Å | 1.10Å | |
| C4D | H4D | sing | 1.09Å | 1.10Å | |
| C5D | H5D | sing | 1.09Å | 1.10Å | |
| C6D | H6D1 | sing | 1.09Å | 1.10Å | |
| C6D | H6D2 | sing | 1.09Å | 1.10Å | |
| O2D | HOD2 | sing | 0.97Å | 0.95Å | |
| O3D | HOD3 | sing | 0.97Å | 0.95Å | |
| O6D | HOD6 | sing | 0.97Å | 0.95Å | |
| O1D | HOD1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2D | C2D | C1D | 109.6° | 109.5° |
| O2D | C2D | C3D | 108.0° | 109.6° |
| O2D | C2D | H2D | 109.3° | 109.6° |
| C2D | O2D | HOD2 | 109.5° | 114.1° |
| C1D | C2D | C3D | 113.7° | 109.2° |
| C2D | C1D | O5D | 108.1° | 109.4° |
| C2D | C1D | O1D | 111.9° | 109.4° |
| C2D | C1D | H1D | 107.5° | 109.5° |
| C1D | C2D | H2D | 108.1° | 109.5° |
| C2D | C3D | O3D | 109.0° | 109.5° |
| C2D | C3D | C4D | 109.1° | 109.1° |
| C3D | C2D | H2D | 108.2° | 109.5° |
| C2D | C3D | H3D | 108.8° | 109.5° |
| C1D | O5D | C5D | 113.5° | 114.1° |
| O5D | C1D | O1D | 111.8° | 109.5° |
| O5D | C1D | H1D | 108.9° | 109.5° |
| O5D | C5D | C4D | 110.6° | 109.5° |
| O5D | C5D | C6D | 107.7° | 109.5° |
| O5D | C5D | H5D | 109.7° | 109.5° |
| O3D | C3D | C4D | 111.1° | 109.6° |
| O3D | C3D | H3D | 110.0° | 109.6° |
| C3D | O3D | HOD3 | 109.5° | 114.1° |
| C3D | C4D | C5D | 106.5° | 109.2° |
| C3D | C4D | O4D | 111.8° | 109.5° |
| C4D | C3D | H3D | 108.9° | 109.6° |
| C3D | C4D | H4D | 109.6° | 109.5° |
| O6C | C6C | C5C | 112.1° | 109.4° |
| O6C | C6C | H6C2 | 108.8° | 109.5° |
| O6C | C6C | H6C1 | 108.8° | 109.5° |
| C6C | O6C | HOC6 | 109.5° | 114.0° |
| C5D | C4D | O4D | 108.3° | 109.6° |
| C4D | C5D | C6D | 112.2° | 109.5° |
| C5D | C4D | H4D | 109.5° | 109.5° |
| C4D | C5D | H5D | 108.4° | 109.5° |
| C4D | O4D | C1C | 113.7° | 114.0° |
| O4D | C4D | H4D | 110.9° | 109.6° |
| C5D | C6D | O6D | 110.9° | 109.5° |
| C6D | C5D | H5D | 108.4° | 109.5° |
| C5D | C6D | H6D1 | 109.1° | 109.5° |
| C5D | C6D | H6D2 | 109.1° | 109.5° |
| C1C | O5C | C5C | 116.4° | 114.1° |
| O5C | C1C | O4D | 109.4° | 109.5° |
| O5C | C1C | C2C | 110.5° | 109.4° |
| O5C | C1C | H1C | 110.2° | 109.5° |
| O5C | C5C | C6C | 108.7° | 109.5° |
| O5C | C5C | C4C | 112.3° | 109.4° |
| O5C | C5C | H5C | 108.4° | 109.5° |
| C6C | C5C | C4C | 112.5° | 109.5° |
| C6C | C5C | H5C | 107.3° | 109.5° |
| C5C | C6C | H6C2 | 108.8° | 109.5° |
| C5C | C6C | H6C1 | 108.8° | 109.5° |
| O6D | C6D | H6D1 | 109.1° | 109.4° |
| O6D | C6D | H6D2 | 109.1° | 109.4° |
| C6D | O6D | HOD6 | 109.5° | 114.0° |
| O4D | C1C | C2C | 107.7° | 109.5° |
| O4D | C1C | H1C | 110.1° | 109.5° |
| C1C | C2C | O2C | 107.9° | 109.5° |
| C1C | C2C | C3C | 111.8° | 109.2° |
| C2C | C1C | H1C | 109.0° | 109.4° |
| C1C | C2C | H2C | 109.0° | 109.6° |
| O3A | C3A | C4A | 105.5° | 109.6° |
| O3A | C3A | C2A | 111.4° | 109.6° |
| O3A | C3A | H3A | 110.8° | 109.9° |
| C3A | O3A | HOA3 | 109.5° | 113.9° |
| C5C | C4C | C3C | 108.8° | 109.2° |
| C5C | C4C | O4C | 105.7° | 109.5° |
| C5C | C4C | H4C | 109.6° | 109.6° |
| C4C | C5C | H5C | 107.4° | 109.4° |
| C4A | C3A | C2A | 109.9° | 108.4° |
| C3A | C4A | O4A | 108.7° | 109.3° |
| C3A | C4A | C5A | 110.7° | 110.2° |
| C4A | C3A | H3A | 109.5° | 109.7° |
| C3A | C4A | H4A | 108.2° | 109.4° |
| C3A | C2A | O2A | 112.8° | 109.8° |
| C3A | C2A | C1A | 110.7° | 108.4° |
| C3A | C2A | H2A | 107.3° | 109.6° |
| C2A | C3A | H3A | 109.5° | 109.7° |
| O4A | C4A | C5A | 111.6° | 109.3° |
| O4A | C4A | H4A | 109.4° | 109.2° |
| C4A | O4A | HOA4 | 109.5° | 114.0° |
| O2A | C2A | C1A | 110.1° | 109.6° |
| O2A | C2A | H2A | 108.5° | 109.6° |
| C2A | O2A | HOA2 | 109.5° | 114.0° |
| O2C | C2C | C3C | 109.2° | 109.5° |
| O2C | C2C | H2C | 110.0° | 109.5° |
| C2C | O2C | HOC2 | 109.5° | 114.0° |
| C2C | C3C | C4C | 107.0° | 109.0° |
| C2C | C3C | O3C | 111.4° | 109.6° |
| C3C | C2C | H2C | 108.9° | 109.6° |
| C2C | C3C | H3C | 108.3° | 109.6° |
| C3C | C4C | O4C | 112.3° | 109.6° |
| C4C | C3C | O3C | 112.4° | 109.5° |
| C4C | C3C | H3C | 108.2° | 109.6° |
| C3C | C4C | H4C | 109.5° | 109.5° |
| C4C | O4C | C1B | 116.4° | 114.0° |
| O4C | C4C | H4C | 110.9° | 109.5° |
| C6B | C5B | C4B | 111.8° | 109.5° |
| C6B | C5B | O5B | 106.0° | 109.5° |
| C6B | C5B | H5B | 109.1° | 109.5° |
| C5B | C6B | H6B2 | 109.5° | 109.5° |
| C5B | C6B | H6B3 | 109.5° | 109.5° |
| C5B | C6B | H6B1 | 109.5° | 109.5° |
| C4A | C5A | C7A | 123.4° | 124.0° |
| C4A | C5A | C6A | 120.3° | 118.0° |
| C5A | C4A | H4A | 108.3° | 109.3° |
| C2A | C1A | N4B | 116.6° | 109.2° |
| C2A | C1A | C7A | 109.5° | 110.2° |
| C2A | C1A | H1A | 107.4° | 109.4° |
| C1A | C2A | H2A | 107.2° | 109.7° |
| C1A | N4B | C4B | 119.4° | 111.0° |
| N4B | C1A | C7A | 107.3° | 109.3° |
| N4B | C1A | H1A | 108.0° | 109.4° |
| C1A | N4B | HN4 | 106.9° | 111.0° |
| N4B | C4B | C5B | 112.2° | 109.6° |
| N4B | C4B | C3B | 114.0° | 109.5° |
| N4B | C4B | H4B | 108.0° | 109.5° |
| C4B | N4B | HN4 | 107.0° | 111.0° |
| C4B | C5B | O5B | 110.3° | 109.4° |
| C5B | C4B | C3B | 107.2° | 109.2° |
| C5B | C4B | H4B | 107.5° | 109.5° |
| C4B | C5B | H5B | 109.1° | 109.4° |
| C5B | O5B | C1B | 116.8° | 114.2° |
| O5B | C5B | H5B | 110.4° | 109.5° |
| O3C | C3C | H3C | 109.4° | 109.5° |
| C3C | O3C | HOC3 | 109.5° | 114.0° |
| O4C | C1B | O5B | 111.5° | 109.5° |
| O4C | C1B | C2B | 106.7° | 109.5° |
| O4C | C1B | H1B | 110.0° | 109.5° |
| C1A | C7A | C5A | 124.1° | 124.1° |
| C7A | C1A | H1A | 107.8° | 109.3° |
| C1A | C7A | H7A | 117.9° | 117.9° |
| C4B | C3B | O3B | 108.4° | 109.5° |
| C4B | C3B | C2B | 109.8° | 109.0° |
| C4B | C3B | H3B | 109.5° | 109.6° |
| C3B | C4B | H4B | 107.6° | 109.5° |
| O5B | C1B | C2B | 109.9° | 109.4° |
| O5B | C1B | H1B | 110.0° | 109.5° |
| C7A | C5A | C6A | 116.2° | 118.0° |
| C5A | C7A | H7A | 117.9° | 117.9° |
| C5A | C6A | O6A | 106.9° | 109.5° |
| C5A | C6A | H6A1 | 110.1° | 109.5° |
| C5A | C6A | H6A2 | 110.1° | 109.4° |
| O3B | C3B | C2B | 109.0° | 109.6° |
| O3B | C3B | H3B | 110.8° | 109.6° |
| C3B | O3B | HOB3 | 109.5° | 114.0° |
| C3B | C2B | C1B | 109.9° | 109.2° |
| C3B | C2B | O2B | 111.4° | 109.5° |
| C3B | C2B | H2B | 108.3° | 109.5° |
| C2B | C3B | H3B | 109.3° | 109.6° |
| C1B | C2B | O2B | 109.0° | 109.5° |
| C2B | C1B | H1B | 108.7° | 109.5° |
| C1B | C2B | H2B | 108.5° | 109.6° |
| O6A | C6A | H6A1 | 110.1° | 109.5° |
| O6A | C6A | H6A2 | 110.1° | 109.4° |
| C6A | O6A | HOA6 | 109.5° | 113.9° |
| O2B | C2B | H2B | 109.6° | 109.5° |
| C2B | O2B | HOB2 | 109.5° | 114.0° |
| O1D | C1D | H1D | 108.5° | 109.5° |
| C1D | O1D | HOD1 | 109.5° | 114.0° |
| H6A1 | C6A | H6A2 | 109.5° | 109.5° |
| H6B2 | C6B | H6B3 | 109.5° | 109.5° |
| H6B2 | C6B | H6B1 | 109.4° | 109.4° |
| H6B3 | C6B | H6B1 | 109.5° | 109.4° |
| H6C2 | C6C | H6C1 | 109.5° | 109.5° |
| H6D1 | C6D | H6D2 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2D | C2D | C1D | C3D | 120.9° | 120.0° |
| O2D | C2D | C1D | H2D | 119.0° | 120.2° |
| O2D | C2D | C3D | H2D | 118.1° | 120.2° |
| O2D | C2D | C1D | O5D | 172.9° | 177.5° |
| O2D | C2D | C3D | O3D | 63.0° | 63.2° |
| O2D | C2D | C3D | C4D | 175.6° | 176.9° |
| O2D | C2D | C1D | O1D | 49.3° | 57.6° |
| O2D | C2D | C1D | H1D | 69.7° | 62.5° |
| O2D | C2D | C3D | H3D | 57.0° | 57.0° |
| C1D | C2D | C3D | H2D | 120.0° | 119.9° |
| C2D | C1D | O5D | O1D | 123.7° | 119.9° |
| C2D | C1D | O5D | H1D | 116.5° | 120.0° |
| C2D | C1D | O5D | C5D | 57.3° | 61.1° |
| C1D | C2D | C3D | O3D | 175.2° | 176.9° |
| C1D | C2D | C3D | C4D | 53.8° | 57.0° |
| C2D | C1D | O1D | H1D | 118.4° | 120.0° |
| C1D | C2D | C3D | H3D | 64.9° | 62.9° |
| C1D | C2D | O2D | HOD2 | 180.0° | 60.0° |
| C2D | C1D | O1D | HOD1 | 180.0° | 180.0° |
| C3D | C2D | C1D | O5D | 52.0° | 57.6° |
| C2D | C3D | O3D | C4D | 120.2° | 119.6° |
| C2D | C3D | O3D | H3D | 119.2° | 120.2° |
| C2D | C3D | C4D | H3D | 118.6° | 119.8° |
| C2D | C3D | C4D | C5D | 56.2° | 57.0° |
| C2D | C3D | C4D | O4D | 174.3° | 176.9° |
| C3D | C2D | C1D | O1D | 71.6° | 62.4° |
| C3D | C2D | C1D | H1D | 169.4° | 177.6° |
| C2D | C3D | C4D | H4D | 62.2° | 62.9° |
| C3D | C2D | O2D | HOD2 | 55.7° | 179.7° |
| C2D | C3D | O3D | HOD3 | 180.0° | 60.0° |
| C1D | O5D | C5D | C4D | 65.5° | 61.2° |
| C1D | O5D | C5D | C6D | 171.7° | 178.8° |
| O5D | C1D | O1D | H1D | 120.1° | 120.1° |
| O5D | C1D | C2D | H2D | 68.1° | 62.3° |
| C1D | O5D | C5D | H5D | 53.9° | 58.8° |
| O5D | C1D | O1D | HOD1 | 58.5° | 60.1° |
| O5D | C5D | C4D | C3D | 62.4° | 57.6° |
| O5D | C5D | C4D | C6D | 120.2° | 120.0° |
| O5D | C5D | C4D | H5D | 120.2° | 120.0° |
| O5D | C5D | C4D | O4D | 177.2° | 177.5° |
| O5D | C5D | C6D | H5D | 118.6° | 120.0° |
| O5D | C5D | C6D | O6D | 62.8° | 64.2° |
| C5D | O5D | C1D | O1D | 66.4° | 58.8° |
| C5D | O5D | C1D | H1D | 173.8° | 178.9° |
| O5D | C5D | C4D | H4D | 56.1° | 62.3° |
| O5D | C5D | C6D | H6D1 | 177.0° | 175.8° |
| O5D | C5D | C6D | H6D2 | 57.5° | 55.8° |
| O3D | C3D | C4D | H3D | 121.3° | 120.3° |
| O3D | C3D | C4D | C5D | 176.3° | 176.8° |
| O3D | C3D | C4D | O4D | 65.5° | 63.2° |
| O3D | C3D | C2D | H2D | 55.2° | 57.0° |
| O3D | C3D | C4D | H4D | 57.9° | 57.0° |
| C3D | C4D | C5D | O4D | 120.5° | 119.9° |
| C3D | C4D | C5D | H4D | 118.5° | 119.9° |
| C3D | C4D | O4D | H4D | 122.7° | 120.2° |
| C3D | C4D | C5D | C6D | 177.5° | 177.6° |
| C3D | C4D | O4D | C1C | 93.7° | 85.1° |
| C4D | C3D | C2D | H2D | 66.2° | 62.9° |
| C3D | C4D | C5D | H5D | 57.8° | 62.4° |
| C4D | C3D | O3D | HOD3 | 59.8° | 179.5° |
| O6C | C6C | C5C | O5C | 66.2° | 64.2° |
| O6C | C6C | C5C | H6C2 | 120.4° | 120.0° |
| O6C | C6C | C5C | H6C1 | 120.4° | 120.0° |
| O6C | C6C | C5C | C4C | 58.8° | 175.8° |
| O6C | C6C | C5C | H5C | 176.8° | 55.9° |
| O6C | C6C | H6C2 | H6C1 | 118.8° | 120.0° |
| C5D | C4D | O4D | H4D | 120.2° | 120.1° |
| C4D | C5D | C6D | H5D | 119.6° | 120.0° |
| C4D | C5D | C6D | O6D | 175.4° | 175.8° |
| C5D | C4D | O4D | C1C | 149.2° | 155.2° |
| C5D | C4D | C3D | H3D | 62.4° | 62.9° |
| C4D | C5D | C6D | H6D1 | 55.2° | 55.9° |
| C4D | C5D | C6D | H6D2 | 64.4° | 64.2° |
| O4D | C4D | C5D | C6D | 57.0° | 62.5° |
| C4D | O4D | C1C | O5C | 73.3° | 72.6° |
| C4D | O4D | C1C | C2C | 166.6° | 167.5° |
| C4D | O4D | C1C | H1C | 47.9° | 47.5° |
| O4D | C4D | C3D | H3D | 55.7° | 57.1° |
| O4D | C4D | C5D | H5D | 62.6° | 57.5° |
| C5D | C6D | O6D | H6D1 | 120.2° | 120.0° |
| C5D | C6D | O6D | H6D2 | 120.2° | 120.0° |
| C6D | C5D | C4D | H4D | 64.1° | 57.7° |
| C5D | C6D | H6D1 | H6D2 | 119.3° | 120.0° |
| C5D | C6D | O6D | HOD6 | 180.0° | 180.0° |
| C1C | O5C | C5C | C6C | 177.5° | 178.9° |
| O5C | C1C | O4D | C2C | 120.1° | 119.9° |
| O5C | C1C | O4D | H1C | 121.2° | 120.1° |
| O5C | C1C | C2C | H1C | 121.2° | 120.0° |
| C1C | O5C | C5C | C4C | 52.4° | 61.1° |
| O5C | C1C | C2C | O2C | 175.3° | 177.5° |
| O5C | C1C | C2C | C3C | 55.2° | 57.6° |
| O5C | C1C | C2C | H2C | 65.2° | 62.4° |
| C1C | O5C | C5C | H5C | 66.1° | 58.8° |
| O5C | C5C | C6C | C4C | 125.0° | 120.0° |
| O5C | C5C | C6C | H5C | 117.0° | 120.1° |
| C5C | O5C | C1C | O4D | 67.5° | 58.8° |
| C5C | O5C | C1C | C2C | 51.0° | 61.2° |
| O5C | C5C | C4C | H5C | 119.1° | 120.0° |
| O5C | C5C | C4C | C3C | 55.2° | 57.6° |
| O5C | C5C | C4C | O4C | 175.9° | 177.5° |
| C5C | O5C | C1C | H1C | 171.4° | 178.9° |
| O5C | C5C | C4C | H4C | 64.5° | 62.4° |
| O5C | C5C | C6C | H6C2 | 173.4° | 175.8° |
| O5C | C5C | C6C | H6C1 | 54.2° | 55.8° |
| C6C | C5C | C4C | H5C | 118.0° | 120.0° |
| C6C | C5C | C4C | C3C | 178.2° | 177.6° |
| C6C | C5C | C4C | O4C | 61.1° | 62.4° |
| C6C | C5C | C4C | H4C | 58.5° | 57.7° |
| C5C | C6C | H6C2 | H6C1 | 118.8° | 120.0° |
| C5C | C6C | O6C | HOC6 | 180.0° | 179.9° |
| O6D | C6D | C5D | H5D | 55.8° | 55.8° |
| O6D | C6D | H6D1 | H6D2 | 119.3° | 120.0° |
| O4D | C1C | C2C | H1C | 119.4° | 120.0° |
| O4D | C1C | C2C | O2C | 55.9° | 57.5° |
| O4D | C1C | C2C | C3C | 64.2° | 62.4° |
| O4D | C1C | C2C | H2C | 175.3° | 177.6° |
| C1C | O4D | C4D | H4D | 28.9° | 35.1° |
| C1C | C2C | O2C | C3C | 121.7° | 119.7° |
| C1C | C2C | O2C | H2C | 118.8° | 120.2° |
| C1C | C2C | C3C | H2C | 120.5° | 120.0° |
| C1C | C2C | C3C | C4C | 60.0° | 57.0° |
| C1C | C2C | C3C | O3C | 176.8° | 176.9° |
| C1C | C2C | C3C | H3C | 56.4° | 63.0° |
| C1C | C2C | O2C | HOC2 | 180.0° | 60.0° |
| O3A | C3A | C4A | C2A | 120.3° | 119.6° |
| O3A | C3A | C4A | H3A | 119.3° | 120.7° |
| O3A | C3A | C2A | H3A | 122.9° | 120.7° |
| O3A | C3A | C4A | O4A | 69.7° | 169.6° |
| O3A | C3A | C2A | O2A | 53.8° | 172.0° |
| O3A | C3A | C4A | C5A | 167.5° | 70.2° |
| O3A | C3A | C2A | C1A | 177.6° | 52.2° |
| O3A | C3A | C2A | H2A | 65.6° | 67.5° |
| O3A | C3A | C4A | H4A | 49.0° | 50.0° |
| C5C | C4C | C3C | C2C | 58.7° | 57.0° |
| C5C | C4C | C3C | O4C | 116.6° | 120.0° |
| C5C | C4C | C3C | H4C | 119.7° | 120.0° |
| C5C | C4C | O4C | H4C | 118.7° | 120.2° |
| C5C | C4C | C3C | O3C | 178.7° | 176.8° |
| C5C | C4C | O4C | C1B | 161.7° | 155.1° |
| C5C | C4C | C3C | H3C | 57.8° | 63.0° |
| C4C | C5C | C6C | H6C2 | 61.6° | 55.8° |
| C4C | C5C | C6C | H6C1 | 179.2° | 64.2° |
| C4A | C3A | C2A | H3A | 120.4° | 119.7° |
| C3A | C4A | O4A | C5A | 122.3° | 120.7° |
| C3A | C4A | O4A | H4A | 117.9° | 119.6° |
| C4A | C3A | C2A | O2A | 170.4° | 52.4° |
| C3A | C4A | C5A | H4A | 118.4° | 120.2° |
| C4A | C3A | C2A | C1A | 65.7° | 67.4° |
| C3A | C4A | C5A | C7A | 15.9° | 17.1° |
| C3A | C4A | C5A | C6A | 166.8° | 162.9° |
| C4A | C3A | C2A | H2A | 51.0° | 172.8° |
| C4A | C3A | O3A | HOA3 | 180.0° | 60.0° |
| C3A | C4A | O4A | HOA4 | 180.0° | 180.0° |
| C2A | C3A | C4A | O4A | 170.0° | 70.8° |
| C3A | C2A | O2A | C1A | 124.2° | 119.0° |
| C3A | C2A | O2A | H2A | 118.8° | 120.5° |
| C2A | C3A | C4A | C5A | 47.2° | 49.4° |
| C3A | C2A | C1A | H2A | 116.8° | 119.7° |
| C3A | C2A | C1A | N4B | 74.4° | 169.5° |
| C3A | C2A | C1A | C7A | 47.7° | 49.4° |
| C3A | C2A | C1A | H1A | 164.4° | 70.8° |
| C2A | C3A | C4A | H4A | 71.3° | 169.6° |
| C3A | C2A | O2A | HOA2 | 180.0° | 61.0° |
| C2A | C3A | O3A | HOA3 | 60.7° | 178.9° |
| O4A | C4A | C5A | H4A | 120.5° | 119.6° |
| O4A | C4A | C5A | C7A | 137.0° | 103.1° |
| O4A | C4A | C5A | C6A | 45.7° | 76.9° |
| O4A | C4A | C3A | H3A | 49.6° | 48.9° |
| O2A | C2A | C1A | H2A | 117.8° | 120.4° |
| O2A | C2A | C1A | N4B | 51.0° | 49.7° |
| O2A | C2A | C1A | C7A | 173.1° | 70.4° |
| O2A | C2A | C1A | H1A | 70.2° | 169.4° |
| O2A | C2A | C3A | H3A | 69.1° | 67.3° |
| O2C | C2C | C3C | H2C | 120.1° | 120.1° |
| O2C | C2C | C3C | C4C | 179.4° | 176.9° |
| O2C | C2C | C3C | O3C | 57.4° | 63.2° |
| O2C | C2C | C1C | H1C | 63.5° | 62.5° |
| O2C | C2C | C3C | H3C | 62.9° | 56.9° |
| C2C | C3C | C4C | O3C | 122.6° | 119.9° |
| C2C | C3C | C4C | H3C | 116.5° | 120.0° |
| C2C | C3C | C4C | O4C | 175.3° | 176.9° |
| C2C | C3C | O3C | H3C | 119.7° | 120.2° |
| C3C | C2C | C1C | H1C | 176.4° | 177.6° |
| C2C | C3C | C4C | H4C | 61.0° | 63.0° |
| C3C | C2C | O2C | HOC2 | 58.2° | 179.7° |
| C2C | C3C | O3C | HOC3 | 180.0° | 60.0° |
| C3C | C4C | O4C | H4C | 122.8° | 120.1° |
| C4C | C3C | O3C | H3C | 120.2° | 120.2° |
| C3C | C4C | O4C | C1B | 79.9° | 85.1° |
| C4C | C3C | C2C | H2C | 60.5° | 63.0° |
| C3C | C4C | C5C | H5C | 63.9° | 62.4° |
| C4C | C3C | O3C | HOC3 | 59.9° | 179.6° |
| O4C | C4C | C3C | O3C | 62.1° | 63.2° |
| C4C | O4C | C1B | O5B | 66.1° | 72.6° |
| C4C | O4C | C1B | C2B | 173.9° | 167.5° |
| C4C | O4C | C1B | H1B | 56.2° | 47.4° |
| O4C | C4C | C3C | H3C | 58.8° | 57.0° |
| O4C | C4C | C5C | H5C | 56.9° | 57.6° |
| C6B | C5B | C4B | N4B | 59.1° | 62.4° |
| C6B | C5B | C4B | O5B | 117.7° | 120.0° |
| C6B | C5B | C4B | H5B | 120.8° | 120.0° |
| C6B | C5B | O5B | H5B | 118.1° | 120.1° |
| C6B | C5B | C4B | C3B | 175.0° | 177.6° |
| C6B | C5B | O5B | C1B | 179.0° | 178.9° |
| C6B | C5B | C4B | H4B | 59.5° | 57.6° |
| C5B | C6B | H6B2 | H6B3 | 120.0° | 120.1° |
| C5B | C6B | H6B2 | H6B1 | 120.0° | 120.0° |
| C5B | C6B | H6B3 | H6B1 | 120.0° | 120.0° |
| C4A | C5A | C7A | C1A | 0.1° | 0.5° |
| C4A | C5A | C7A | C6A | 177.4° | 180.0° |
| C4A | C5A | C6A | O6A | 74.2° | 180.0° |
| C5A | C4A | C3A | H3A | 73.2° | 169.1° |
| C4A | C5A | C6A | H6A1 | 166.2° | 60.0° |
| C4A | C5A | C6A | H6A2 | 45.3° | 60.0° |
| C4A | C5A | C7A | H7A | 179.9° | 179.6° |
| C5A | C4A | O4A | HOA4 | 57.7° | 59.3° |
| C2A | C1A | N4B | C7A | 123.2° | 120.6° |
| C2A | C1A | N4B | H1A | 120.9° | 119.7° |
| C2A | C1A | N4B | C4B | 173.1° | 157.5° |
| C2A | C1A | C7A | H1A | 116.5° | 120.2° |
| C2A | C1A | C7A | C5A | 16.0° | 17.1° |
| C1A | C2A | C3A | H3A | 54.7° | 172.9° |
| C2A | C1A | C7A | H7A | 164.0° | 162.9° |
| C1A | C2A | O2A | HOA2 | 55.8° | 180.0° |
| C2A | C1A | N4B | HN4 | 51.6° | 33.6° |
| C1A | N4B | C4B | HN4 | 121.4° | 123.9° |
| C1A | N4B | C4B | C5B | 144.3° | 149.6° |
| N4B | C1A | C7A | H1A | 116.0° | 119.7° |
| C1A | N4B | C4B | C3B | 93.6° | 90.6° |
| N4B | C1A | C7A | C5A | 111.5° | 137.2° |
| N4B | C1A | C2A | H2A | 168.8° | 70.7° |
| N4B | C1A | C7A | H7A | 68.5° | 42.9° |
| C1A | N4B | C4B | H4B | 26.0° | 29.5° |
| N4B | C4B | C5B | C3B | 125.9° | 120.0° |
| N4B | C4B | C5B | H4B | 118.6° | 120.1° |
| N4B | C4B | C5B | O5B | 176.8° | 177.6° |
| C4B | N4B | C1A | C7A | 63.8° | 81.9° |
| N4B | C4B | C3B | H4B | 119.8° | 120.1° |
| N4B | C4B | C3B | O3B | 56.8° | 63.2° |
| N4B | C4B | C3B | C2B | 175.8° | 176.9° |
| C4B | N4B | C1A | H1A | 52.1° | 37.8° |
| N4B | C4B | C3B | H3B | 64.1° | 57.0° |
| N4B | C4B | C5B | H5B | 61.7° | 57.6° |
| C4B | C5B | O5B | H5B | 120.7° | 119.9° |
| C5B | C4B | C3B | H4B | 115.4° | 119.9° |
| C4B | C5B | O5B | C1B | 57.8° | 61.2° |
| C5B | C4B | C3B | O3B | 178.4° | 176.8° |
| C5B | C4B | C3B | C2B | 59.4° | 57.0° |
| C5B | C4B | C3B | H3B | 60.7° | 62.9° |
| C4B | C5B | C6B | H6B2 | 180.0° | 54.9° |
| C4B | C5B | C6B | H6B3 | 60.0° | 175.0° |
| C4B | C5B | C6B | H6B1 | 60.0° | 65.0° |
| C5B | C4B | N4B | HN4 | 94.3° | 86.5° |
| C5B | O5B | C1B | O4C | 63.0° | 58.8° |
| O5B | C5B | C4B | C3B | 57.3° | 57.6° |
| C5B | O5B | C1B | C2B | 55.1° | 61.2° |
| C5B | O5B | C1B | H1B | 174.7° | 178.9° |
| O5B | C5B | C4B | H4B | 58.2° | 62.3° |
| O5B | C5B | C6B | H6B2 | 59.7° | 65.0° |
| O5B | C5B | C6B | H6B3 | 179.7° | 55.1° |
| O5B | C5B | C6B | H6B1 | 60.3° | 175.1° |
| O3C | C3C | C2C | H2C | 62.7° | 56.9° |
| O3C | C3C | C4C | H4C | 61.5° | 56.9° |
| O4C | C1B | O5B | C2B | 118.1° | 120.0° |
| O4C | C1B | O5B | H1B | 122.3° | 120.1° |
| O4C | C1B | C2B | C3B | 67.6° | 62.4° |
| O4C | C1B | C2B | H1B | 118.5° | 120.1° |
| O4C | C1B | C2B | O2B | 54.9° | 57.5° |
| O4C | C1B | C2B | H2B | 174.2° | 177.7° |
| C1B | O4C | C4C | H4C | 42.9° | 35.0° |
| C1A | C7A | C5A | H7A | 180.0° | 179.9° |
| C1A | C7A | C5A | C6A | 177.4° | 179.5° |
| C7A | C1A | C2A | H2A | 69.2° | 169.1° |
| C7A | C1A | N4B | HN4 | 174.8° | 154.2° |
| C4B | C3B | O3B | C2B | 119.5° | 119.5° |
| C4B | C3B | O3B | H3B | 120.1° | 120.3° |
| C4B | C3B | C2B | H3B | 120.1° | 119.9° |
| C4B | C3B | C2B | C1B | 58.5° | 57.0° |
| C4B | C3B | C2B | O2B | 179.4° | 176.9° |
| C4B | C3B | C2B | H2B | 59.9° | 63.0° |
| C3B | C4B | C5B | H5B | 64.2° | 62.4° |
| C3B | C4B | N4B | HN4 | 27.8° | 33.3° |
| C4B | C3B | O3B | HOB3 | 180.0° | 179.6° |
| O5B | C1B | C2B | C3B | 53.5° | 57.6° |
| O5B | C1B | C2B | H1B | 120.4° | 120.0° |
| O5B | C1B | C2B | O2B | 175.9° | 177.5° |
| O5B | C1B | C2B | H2B | 64.8° | 62.4° |
| C1B | O5B | C5B | H5B | 62.9° | 58.8° |
| C7A | C5A | C6A | O6A | 103.2° | 0.1° |
| C5A | C7A | C1A | H1A | 132.5° | 103.1° |
| C7A | C5A | C4A | H4A | 102.5° | 137.4° |
| C7A | C5A | C6A | H6A1 | 16.4° | 120.0° |
| C7A | C5A | C6A | H6A2 | 137.2° | 120.0° |
| C5A | C6A | O6A | H6A1 | 119.6° | 120.0° |
| C5A | C6A | O6A | H6A2 | 119.6° | 119.9° |
| C6A | C5A | C4A | H4A | 74.8° | 42.7° |
| C5A | C6A | H6A1 | H6A2 | 121.2° | 120.0° |
| C6A | C5A | C7A | H7A | 2.6° | 0.4° |
| C5A | C6A | O6A | HOA6 | 180.0° | 180.0° |
| O3B | C3B | C2B | H3B | 121.3° | 120.2° |
| O3B | C3B | C2B | C1B | 177.1° | 176.8° |
| O3B | C3B | C2B | O2B | 62.0° | 63.2° |
| O3B | C3B | C2B | H2B | 58.7° | 56.8° |
| O3B | C3B | C4B | H4B | 63.0° | 56.9° |
| C3B | C2B | C1B | O2B | 122.4° | 119.9° |
| C3B | C2B | C1B | H2B | 118.3° | 119.9° |
| C3B | C2B | O2B | H2B | 119.9° | 120.1° |
| C3B | C2B | C1B | H1B | 173.9° | 177.6° |
| C2B | C3B | C4B | H4B | 56.0° | 63.0° |
| C3B | C2B | O2B | HOB2 | 180.0° | 179.7° |
| C2B | C3B | O3B | HOB3 | 60.5° | 60.0° |
| C1B | C2B | O2B | H2B | 118.6° | 120.2° |
| C1B | C2B | C3B | H3B | 61.6° | 63.0° |
| C1B | C2B | O2B | HOB2 | 58.5° | 60.0° |
| O6A | C6A | H6A1 | H6A2 | 121.2° | 120.0° |
| O2B | C2B | C1B | H1B | 63.7° | 62.5° |
| O2B | C2B | C3B | H3B | 59.3° | 57.0° |
| O1D | C1D | C2D | H2D | 168.3° | 177.8° |
| H1A | C1A | C2A | H2A | 47.6° | 48.9° |
| H1A | C1A | C7A | H7A | 47.5° | 76.9° |
| H1A | C1A | N4B | HN4 | 69.3° | 86.1° |
| H2A | C2A | C3A | H3A | 171.4° | 53.1° |
| H2A | C2A | O2A | HOA2 | 61.2° | 59.5° |
| H3A | C3A | C4A | H4A | 168.3° | 70.7° |
| H3A | C3A | O3A | HOA3 | 61.5° | 60.6° |
| H4A | C4A | O4A | HOA4 | 62.1° | 60.3° |
| H6A1 | C6A | O6A | HOA6 | 60.4° | 59.9° |
| H6A2 | C6A | O6A | HOA6 | 60.4° | 60.1° |
| H1B | C1B | C2B | H2B | 55.7° | 57.6° |
| H2B | C2B | C3B | H3B | 180.0° | 177.1° |
| H2B | C2B | O2B | HOB2 | 60.1° | 60.2° |
| H3B | C3B | C4B | H4B | 176.1° | 177.1° |
| H3B | C3B | O3B | HOB3 | 59.9° | 60.2° |
| H4B | C4B | C5B | H5B | 179.7° | 177.7° |
| H4B | C4B | N4B | HN4 | 147.4° | 153.4° |
| H5B | C5B | C6B | H6B2 | 59.2° | 174.9° |
| H5B | C5B | C6B | H6B3 | 60.8° | 65.0° |
| H5B | C5B | C6B | H6B1 | 179.2° | 55.0° |
| H6B2 | C6B | H6B3 | H6B1 | 120.0° | 119.9° |
| H1C | C1C | C2C | H2C | 55.9° | 57.6° |
| H2C | C2C | C3C | H3C | 176.9° | 177.0° |
| H2C | C2C | O2C | HOC2 | 61.2° | 60.2° |
| H3C | C3C | C4C | H4C | 177.6° | 177.0° |
| H3C | C3C | O3C | HOC3 | 60.3° | 60.2° |
| H4C | C4C | C5C | H5C | 176.5° | 177.7° |
| H5C | C5C | C6C | H6C2 | 56.4° | 64.2° |
| H5C | C5C | C6C | H6C1 | 62.8° | 175.8° |
| H6C2 | C6C | O6C | HOC6 | 59.6° | 60.1° |
| H6C1 | C6C | O6C | HOC6 | 59.6° | 60.0° |
| H1D | C1D | C2D | H2D | 49.3° | 57.7° |
| H1D | C1D | O1D | HOD1 | 61.6° | 60.0° |
| H2D | C2D | C3D | H3D | 175.1° | 177.2° |
| H2D | C2D | O2D | HOD2 | 61.8° | 60.2° |
| H3D | C3D | C4D | H4D | 179.2° | 177.3° |
| H3D | C3D | O3D | HOD3 | 60.8° | 60.2° |
| H4D | C4D | C5D | H5D | 176.3° | 177.7° |
| H5D | C5D | C6D | H6D1 | 64.4° | 64.2° |
| H5D | C5D | C6D | H6D2 | 176.0° | 175.8° |
| H6D1 | C6D | O6D | HOD6 | 59.8° | 60.0° |
| H6D2 | C6D | O6D | HOD6 | 59.7° | 60.0° |
