Obsolete: DLD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4A | C4A | sing | 1.43Å | 1.45Å | |
| C6A | O6A | sing | 1.43Å | 1.43Å | |
| C6A | C5A | sing | 1.53Å | 1.53Å | |
| C4A | C5A | sing | 1.53Å | 1.53Å | |
| C4A | C3A | sing | 1.53Å | 1.51Å | |
| C5A | O5A | sing | 1.43Å | 1.45Å | |
| O3A | C3A | sing | 1.43Å | 1.42Å | |
| O5A | C1A | sing | 1.43Å | 1.44Å | |
| C3A | C2A | sing | 1.53Å | 1.52Å | |
| O3B | C3B | sing | 1.43Å | 1.43Å | |
| C2A | C1A | sing | 1.53Å | 1.52Å | |
| C2A | N2A | sing | 1.46Å | 1.51Å | |
| C1A | O4B | sing | 1.43Å | 1.39Å | |
| O7A | C7A | doub | 1.21Å | 1.33Å | |
| O4B | C4B | sing | 1.43Å | 1.47Å | |
| N2A | C7A | sing | 1.35Å | 1.33Å | |
| C3B | C4B | sing | 1.53Å | 1.52Å | |
| C3B | C2B | sing | 1.53Å | 1.55Å | |
| C7A | C8A | sing | 1.51Å | 1.47Å | |
| C4B | C5B | sing | 1.53Å | 1.53Å | |
| O7B | C7B | doub | 1.21Å | 1.26Å | |
| N2B | C7B | sing | 1.35Å | 1.41Å | |
| N2B | C2B | sing | 1.47Å | 1.46Å | |
| C7B | C8B | sing | 1.51Å | 1.45Å | |
| C2B | C1B | sing | 1.53Å | 1.53Å | |
| C5B | C6B | sing | 1.53Å | 1.51Å | |
| C5B | O5B | sing | 1.43Å | 1.45Å | |
| C6B | O6B | sing | 1.43Å | 1.40Å | |
| C1B | O5B | sing | 1.43Å | 1.41Å | |
| C1B | O11 | sing | 1.43Å | 1.42Å | |
| O11 | C12 | sing | 1.43Å | 1.44Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | N14 | sing | 1.47Å | 1.50Å | |
| N14 | N15 | doub | 1.12Å | 1.57Å | |
| N15 | N16 | doub | 1.12Å | 1.61Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C1A | H1A | sing | 1.09Å | 1.10Å | |
| C1B | H1B | sing | 1.09Å | 1.10Å | |
| C2A | H2A | sing | 1.09Å | 1.10Å | |
| N2A | HN2A | sing | 0.97Å | 1.00Å | |
| C2B | H2B | sing | 1.09Å | 1.10Å | |
| N2B | HN2B | sing | 0.97Å | 1.00Å | |
| C3A | H3A | sing | 1.09Å | 1.10Å | |
| O3A | HO3A | sing | 0.97Å | 0.95Å | |
| C3B | H3B | sing | 1.09Å | 1.10Å | |
| O3B | HO3B | sing | 0.97Å | 0.95Å | |
| C4A | H4A | sing | 1.09Å | 1.10Å | |
| O4A | HO4A | sing | 0.97Å | 0.95Å | |
| C4B | H4B | sing | 1.09Å | 1.10Å | |
| C5A | H5A | sing | 1.09Å | 1.10Å | |
| C5B | H5B | sing | 1.09Å | 1.10Å | |
| C6A | H6A | sing | 1.09Å | 1.10Å | |
| C6A | H6AA | sing | 1.09Å | 1.10Å | |
| O6A | HO6A | sing | 0.97Å | 0.95Å | |
| C6B | H6B | sing | 1.09Å | 1.10Å | |
| C6B | H6BA | sing | 1.09Å | 1.10Å | |
| O6B | HO6B | sing | 0.97Å | 0.95Å | |
| C8A | H8A | sing | 1.09Å | 1.10Å | |
| C8A | H8AA | sing | 1.09Å | 1.10Å | |
| C8A | H8AB | sing | 1.09Å | 1.10Å | |
| C8B | H8B | sing | 1.09Å | 1.10Å | |
| C8B | H8BA | sing | 1.09Å | 1.10Å | |
| C8B | H8BB | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4A | C4A | C5A | 112.5° | 109.5° |
| O4A | C4A | C3A | 108.7° | 109.6° |
| O4A | C4A | H4A | 110.0° | 109.6° |
| C4A | O4A | HO4A | 109.5° | 114.0° |
| O6A | C6A | C5A | 114.5° | 109.5° |
| O6A | C6A | H6A | 108.2° | 109.5° |
| O6A | C6A | H6AA | 108.2° | 109.5° |
| C6A | O6A | HO6A | 109.5° | 114.0° |
| C6A | C5A | C4A | 114.4° | 109.5° |
| C6A | C5A | O5A | 110.8° | 109.5° |
| C6A | C5A | H5A | 106.5° | 109.5° |
| C5A | C6A | H6A | 108.2° | 109.4° |
| C5A | C6A | H6AA | 108.2° | 109.4° |
| C5A | C4A | C3A | 107.5° | 109.2° |
| C4A | C5A | O5A | 110.7° | 109.4° |
| C5A | C4A | H4A | 108.9° | 109.5° |
| C4A | C5A | H5A | 106.5° | 109.5° |
| C4A | C3A | O3A | 111.2° | 109.6° |
| C4A | C3A | C2A | 107.6° | 109.0° |
| C4A | C3A | H3A | 109.8° | 109.6° |
| C3A | C4A | H4A | 109.1° | 109.5° |
| C5A | O5A | C1A | 112.1° | 114.1° |
| O5A | C5A | H5A | 107.4° | 109.4° |
| O3A | C3A | C2A | 107.3° | 109.5° |
| O3A | C3A | H3A | 111.2° | 109.6° |
| C3A | O3A | HO3A | 109.5° | 114.0° |
| O5A | C1A | C2A | 109.4° | 109.5° |
| O5A | C1A | O4B | 111.6° | 109.5° |
| O5A | C1A | H1A | 109.4° | 109.5° |
| C3A | C2A | C1A | 109.0° | 109.1° |
| C3A | C2A | N2A | 106.5° | 109.5° |
| C3A | C2A | H2A | 108.2° | 109.6° |
| C2A | C3A | H3A | 109.7° | 109.6° |
| O3B | C3B | C4B | 107.7° | 109.5° |
| O3B | C3B | C2B | 111.0° | 109.5° |
| O3B | C3B | H3B | 109.3° | 109.6° |
| C3B | O3B | HO3B | 109.5° | 114.0° |
| C1A | C2A | N2A | 116.3° | 109.6° |
| C2A | C1A | O4B | 108.0° | 109.5° |
| C2A | C1A | H1A | 108.3° | 109.5° |
| C1A | C2A | H2A | 108.2° | 109.5° |
| C2A | N2A | C7A | 121.5° | 120.0° |
| N2A | C2A | H2A | 108.4° | 109.6° |
| C2A | N2A | HN2A | 119.2° | 120.1° |
| C1A | O4B | C4B | 120.9° | 114.0° |
| O4B | C1A | H1A | 110.1° | 109.4° |
| O7A | C7A | N2A | 124.5° | 120.0° |
| O7A | C7A | C8A | 120.1° | 120.0° |
| O4B | C4B | C3B | 107.4° | 109.6° |
| O4B | C4B | C5B | 108.1° | 109.5° |
| O4B | C4B | H4B | 109.9° | 109.6° |
| N2A | C7A | C8A | 115.3° | 120.0° |
| C7A | N2A | HN2A | 119.3° | 119.9° |
| C4B | C3B | C2B | 112.7° | 109.0° |
| C3B | C4B | C5B | 113.1° | 109.1° |
| C4B | C3B | H3B | 108.1° | 109.6° |
| C3B | C4B | H4B | 109.2° | 109.5° |
| C3B | C2B | N2B | 107.1° | 109.5° |
| C3B | C2B | C1B | 110.8° | 109.1° |
| C3B | C2B | H2B | 109.8° | 109.5° |
| C2B | C3B | H3B | 107.9° | 109.6° |
| C7A | C8A | H8A | 109.5° | 109.5° |
| C7A | C8A | H8AA | 109.4° | 109.5° |
| C7A | C8A | H8AB | 109.4° | 109.5° |
| C4B | C5B | C6B | 111.7° | 109.5° |
| C4B | C5B | O5B | 113.2° | 109.4° |
| C5B | C4B | H4B | 109.1° | 109.5° |
| C4B | C5B | H5B | 108.4° | 109.5° |
| O7B | C7B | N2B | 125.9° | 120.1° |
| O7B | C7B | C8B | 113.0° | 120.0° |
| C7B | N2B | C2B | 123.6° | 119.9° |
| N2B | C7B | C8B | 121.1° | 119.9° |
| C7B | N2B | HN2B | 118.2° | 120.1° |
| N2B | C2B | C1B | 108.2° | 109.6° |
| N2B | C2B | H2B | 110.9° | 109.6° |
| C2B | N2B | HN2B | 118.2° | 120.0° |
| C7B | C8B | H8B | 109.5° | 109.4° |
| C7B | C8B | H8BA | 109.5° | 109.5° |
| C7B | C8B | H8BB | 109.5° | 109.5° |
| C2B | C1B | O5B | 110.6° | 109.4° |
| C2B | C1B | O11 | 108.8° | 109.4° |
| C2B | C1B | H1B | 109.1° | 109.5° |
| C1B | C2B | H2B | 110.0° | 109.5° |
| C6B | C5B | O5B | 105.5° | 109.4° |
| C5B | C6B | O6B | 109.7° | 109.5° |
| C6B | C5B | H5B | 108.5° | 109.5° |
| C5B | C6B | H6B | 109.4° | 109.4° |
| C5B | C6B | H6BA | 109.4° | 109.5° |
| C5B | O5B | C1B | 113.6° | 114.1° |
| O5B | C5B | H5B | 109.4° | 109.5° |
| O6B | C6B | H6B | 109.4° | 109.5° |
| O6B | C6B | H6BA | 109.4° | 109.5° |
| C6B | O6B | HO6B | 109.5° | 114.0° |
| O5B | C1B | O11 | 106.9° | 109.5° |
| O5B | C1B | H1B | 110.8° | 109.5° |
| C1B | O11 | C12 | 115.6° | 114.0° |
| O11 | C1B | H1B | 110.7° | 109.5° |
| O11 | C12 | C13 | 107.1° | 109.5° |
| O11 | C12 | H12 | 110.1° | 109.5° |
| O11 | C12 | H12A | 110.0° | 109.5° |
| C12 | C13 | N14 | 109.6° | 109.5° |
| C13 | C12 | H12 | 110.0° | 109.5° |
| C13 | C12 | H12A | 110.1° | 109.4° |
| C12 | C13 | H13 | 109.5° | 109.5° |
| C12 | C13 | H13A | 109.5° | 109.5° |
| C13 | N14 | N15 | 105.2° | 119.9° |
| N14 | C13 | H13 | 109.4° | 109.5° |
| N14 | C13 | H13A | 109.4° | 109.5° |
| N14 | N15 | N16 | 163.1° | 180.0° |
| H12 | C12 | H12A | 109.5° | 109.5° |
| H13 | C13 | H13A | 109.5° | 109.5° |
| H6A | C6A | H6AA | 109.5° | 109.5° |
| H6B | C6B | H6BA | 109.5° | 109.5° |
| H8A | C8A | H8AA | 109.5° | 109.4° |
| H8A | C8A | H8AB | 109.4° | 109.5° |
| H8AA | C8A | H8AB | 109.5° | 109.4° |
| H8B | C8B | H8BA | 109.5° | 109.4° |
| H8B | C8B | H8BB | 109.5° | 109.5° |
| H8BA | C8B | H8BB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4A | C4A | C5A | C6A | 66.5° | 57.7° |
| O4A | C4A | C5A | C3A | 119.6° | 119.9° |
| O4A | C4A | C5A | H4A | 122.3° | 120.2° |
| O4A | C4A | C3A | H4A | 120.0° | 120.2° |
| O4A | C4A | C5A | O5A | 59.6° | 62.3° |
| O4A | C4A | C3A | O3A | 55.8° | 57.0° |
| O4A | C4A | C3A | C2A | 61.4° | 62.9° |
| O4A | C4A | C3A | H3A | 179.2° | 177.2° |
| O4A | C4A | C5A | H5A | 176.1° | 177.8° |
| O6A | C6A | C5A | H6A | 120.7° | 120.0° |
| O6A | C6A | C5A | H6AA | 120.7° | 120.0° |
| O6A | C6A | C5A | C4A | 166.4° | 175.0° |
| O6A | C6A | C5A | O5A | 40.3° | 65.0° |
| O6A | C6A | C5A | H5A | 76.2° | 54.9° |
| O6A | C6A | H6A | H6AA | 117.7° | 120.1° |
| C6A | C5A | C4A | O5A | 126.1° | 120.0° |
| C6A | C5A | C4A | H5A | 117.4° | 120.1° |
| C6A | C5A | C4A | C3A | 173.9° | 177.6° |
| C6A | C5A | O5A | H5A | 115.9° | 120.0° |
| C6A | C5A | O5A | C1A | 171.8° | 178.9° |
| C6A | C5A | C4A | H4A | 55.8° | 62.5° |
| C5A | C6A | H6A | H6AA | 117.7° | 119.9° |
| C5A | C6A | O6A | HO6A | 180.0° | 180.0° |
| C5A | C4A | C3A | H4A | 118.0° | 119.9° |
| C4A | C5A | O5A | H5A | 116.0° | 120.0° |
| C5A | C4A | C3A | O3A | 177.7° | 176.9° |
| C4A | C5A | O5A | C1A | 60.0° | 61.1° |
| C5A | C4A | C3A | C2A | 60.6° | 57.0° |
| C5A | C4A | C3A | H3A | 58.8° | 62.9° |
| C5A | C4A | O4A | HO4A | 180.0° | 60.0° |
| C4A | C5A | C6A | H6A | 45.6° | 55.0° |
| C4A | C5A | C6A | H6AA | 72.9° | 65.0° |
| C3A | C4A | C5A | O5A | 60.0° | 57.6° |
| C4A | C3A | O3A | C2A | 117.4° | 119.6° |
| C4A | C3A | O3A | H3A | 122.7° | 120.2° |
| C4A | C3A | C2A | H3A | 119.4° | 119.9° |
| C4A | C3A | C2A | C1A | 61.3° | 57.0° |
| C4A | C3A | C2A | N2A | 172.5° | 176.9° |
| C4A | C3A | C2A | H2A | 56.1° | 62.9° |
| C4A | C3A | O3A | HO3A | 180.0° | 60.4° |
| C3A | C4A | O4A | HO4A | 61.1° | 179.7° |
| C3A | C4A | C5A | H5A | 56.5° | 62.3° |
| C5A | O5A | C1A | C2A | 59.1° | 61.1° |
| C5A | O5A | C1A | O4B | 178.6° | 178.9° |
| C5A | O5A | C1A | H1A | 59.4° | 58.9° |
| O5A | C5A | C4A | H4A | 178.1° | 177.5° |
| O5A | C5A | C6A | H6A | 80.4° | 175.0° |
| O5A | C5A | C6A | H6AA | 161.0° | 55.0° |
| O3A | C3A | C2A | H3A | 120.9° | 120.2° |
| O3A | C3A | C2A | C1A | 179.0° | 176.9° |
| O3A | C3A | C2A | N2A | 52.8° | 63.2° |
| O3A | C3A | C2A | H2A | 63.6° | 57.0° |
| O3A | C3A | C4A | H4A | 64.3° | 63.2° |
| O5A | C1A | C2A | C3A | 59.7° | 57.6° |
| O5A | C1A | C2A | O4B | 121.6° | 120.0° |
| O5A | C1A | C2A | H1A | 119.2° | 120.1° |
| O5A | C1A | C2A | N2A | 179.9° | 177.5° |
| O5A | C1A | O4B | H1A | 121.7° | 120.0° |
| O5A | C1A | O4B | C4B | 76.9° | 70.2° |
| O5A | C1A | C2A | H2A | 57.7° | 62.3° |
| C1A | O5A | C5A | H5A | 55.9° | 58.9° |
| C3A | C2A | C1A | N2A | 120.4° | 119.9° |
| C3A | C2A | C1A | H2A | 117.4° | 119.9° |
| C3A | C2A | N2A | H2A | 116.2° | 120.2° |
| C3A | C2A | C1A | O4B | 178.6° | 177.6° |
| C3A | C2A | N2A | C7A | 141.1° | 155.3° |
| C3A | C2A | C1A | H1A | 59.5° | 62.4° |
| C3A | C2A | N2A | HN2A | 38.9° | 24.7° |
| C2A | C3A | O3A | HO3A | 62.6° | 180.0° |
| C2A | C3A | C4A | H4A | 178.6° | 176.9° |
| O3B | C3B | C4B | O4B | 76.3° | 63.3° |
| O3B | C3B | C4B | C2B | 122.8° | 119.8° |
| O3B | C3B | C4B | H3B | 118.0° | 120.3° |
| O3B | C3B | C2B | H3B | 119.8° | 120.3° |
| O3B | C3B | C4B | C5B | 164.6° | 176.8° |
| O3B | C3B | C2B | N2B | 74.1° | 63.3° |
| O3B | C3B | C2B | C1B | 168.1° | 176.8° |
| O3B | C3B | C2B | H2B | 46.5° | 56.9° |
| O3B | C3B | C4B | H4B | 42.9° | 57.0° |
| C1A | C2A | N2A | H2A | 122.1° | 120.2° |
| C2A | C1A | O4B | H1A | 118.0° | 120.0° |
| C2A | C1A | O4B | C4B | 162.8° | 169.9° |
| C1A | C2A | N2A | C7A | 97.2° | 85.0° |
| C1A | C2A | N2A | HN2A | 82.8° | 94.9° |
| C1A | C2A | C3A | H3A | 58.1° | 62.9° |
| N2A | C2A | C1A | O4B | 58.3° | 62.5° |
| C2A | N2A | C7A | O7A | 0.7° | 0.0° |
| C2A | N2A | C7A | HN2A | 180.0° | 180.0° |
| C2A | N2A | C7A | C8A | 179.1° | 180.0° |
| N2A | C2A | C1A | H1A | 60.9° | 57.5° |
| N2A | C2A | C3A | H3A | 68.1° | 57.0° |
| C1A | O4B | C4B | C3B | 139.1° | 139.6° |
| C1A | O4B | C4B | C5B | 98.6° | 100.8° |
| O4B | C1A | C2A | H2A | 63.9° | 57.7° |
| C1A | O4B | C4B | H4B | 20.3° | 19.4° |
| O7A | C7A | N2A | C8A | 179.8° | 180.0° |
| O7A | C7A | N2A | HN2A | 179.3° | 180.0° |
| O7A | C7A | C8A | H8A | 0.0° | 180.0° |
| O7A | C7A | C8A | H8AA | 120.0° | 60.0° |
| O7A | C7A | C8A | H8AB | 120.0° | 60.0° |
| O4B | C4B | C3B | C5B | 119.1° | 119.9° |
| O4B | C4B | C3B | H4B | 119.2° | 120.3° |
| O4B | C4B | C3B | C2B | 160.9° | 176.9° |
| O4B | C4B | C5B | H4B | 119.5° | 120.2° |
| O4B | C4B | C5B | C6B | 77.3° | 62.5° |
| O4B | C4B | C5B | O5B | 163.8° | 177.6° |
| C4B | O4B | C1A | H1A | 44.7° | 49.8° |
| O4B | C4B | C3B | H3B | 41.7° | 57.0° |
| O4B | C4B | C5B | H5B | 42.2° | 57.5° |
| C7A | N2A | C2A | H2A | 24.9° | 35.1° |
| N2A | C7A | C8A | H8A | 179.8° | 0.0° |
| N2A | C7A | C8A | H8AA | 59.8° | 120.0° |
| N2A | C7A | C8A | H8AB | 60.2° | 120.0° |
| C4B | C3B | C2B | H3B | 119.3° | 119.9° |
| C3B | C4B | C5B | H4B | 121.7° | 119.8° |
| C4B | C3B | C2B | N2B | 165.0° | 176.9° |
| C4B | C3B | C2B | C1B | 47.2° | 57.0° |
| C3B | C4B | C5B | C6B | 163.9° | 177.5° |
| C3B | C4B | C5B | O5B | 45.0° | 57.6° |
| C4B | C3B | C2B | H2B | 74.4° | 62.9° |
| C4B | C3B | O3B | HO3B | 180.0° | 180.0° |
| C3B | C4B | C5B | H5B | 76.5° | 62.4° |
| C2B | C3B | C4B | C5B | 41.8° | 57.0° |
| C3B | C2B | N2B | C7B | 139.9° | 155.4° |
| C3B | C2B | N2B | C1B | 119.5° | 119.7° |
| C3B | C2B | N2B | H2B | 119.8° | 120.1° |
| C3B | C2B | C1B | H2B | 121.6° | 119.9° |
| C3B | C2B | C1B | O5B | 56.9° | 57.6° |
| C3B | C2B | C1B | O11 | 174.0° | 177.6° |
| C3B | C2B | C1B | H1B | 65.2° | 62.4° |
| C3B | C2B | N2B | HN2B | 40.1° | 24.7° |
| C2B | C3B | O3B | HO3B | 56.3° | 60.5° |
| C2B | C3B | C4B | H4B | 79.9° | 62.8° |
| C8A | C7A | N2A | HN2A | 0.9° | 0.0° |
| C7A | C8A | H8A | H8AA | 120.0° | 120.0° |
| C7A | C8A | H8A | H8AB | 120.0° | 120.0° |
| C7A | C8A | H8AA | H8AB | 120.0° | 120.0° |
| C4B | C5B | C6B | O5B | 123.4° | 119.9° |
| C4B | C5B | C6B | H5B | 119.4° | 120.1° |
| C4B | C5B | O5B | H5B | 121.0° | 120.0° |
| C4B | C5B | C6B | O6B | 161.0° | 174.7° |
| C4B | C5B | O5B | C1B | 56.2° | 61.2° |
| C5B | C4B | C3B | H3B | 77.4° | 62.9° |
| C4B | C5B | C6B | H6B | 40.9° | 54.8° |
| C4B | C5B | C6B | H6BA | 79.0° | 65.2° |
| O7B | C7B | N2B | C8B | 179.9° | 179.9° |
| O7B | C7B | N2B | C2B | 179.8° | 0.1° |
| O7B | C7B | N2B | HN2B | 0.3° | 180.0° |
| O7B | C7B | C8B | H8B | 0.0° | 90.0° |
| O7B | C7B | C8B | H8BA | 120.0° | 29.9° |
| O7B | C7B | C8B | H8BB | 120.0° | 149.9° |
| C7B | N2B | C2B | HN2B | 180.0° | 179.9° |
| C7B | N2B | C2B | C1B | 100.6° | 85.0° |
| C7B | N2B | C2B | H2B | 20.1° | 35.2° |
| N2B | C7B | C8B | H8B | 179.9° | 90.1° |
| N2B | C7B | C8B | H8BA | 59.9° | 150.0° |
| N2B | C7B | C8B | H8BB | 60.1° | 30.0° |
| C2B | N2B | C7B | C8B | 0.1° | 180.0° |
| N2B | C2B | C1B | H2B | 121.3° | 120.2° |
| N2B | C2B | C1B | O5B | 174.0° | 177.5° |
| N2B | C2B | C1B | O11 | 68.9° | 62.5° |
| N2B | C2B | C1B | H1B | 51.9° | 57.5° |
| N2B | C2B | C3B | H3B | 45.7° | 57.0° |
| C8B | C7B | N2B | HN2B | 179.9° | 0.1° |
| C7B | C8B | H8B | H8BA | 120.0° | 119.9° |
| C7B | C8B | H8B | H8BB | 120.0° | 120.1° |
| C7B | C8B | H8BA | H8BB | 120.0° | 120.1° |
| C2B | C1B | O5B | C5B | 62.0° | 61.2° |
| C2B | C1B | O5B | O11 | 118.3° | 119.9° |
| C2B | C1B | O5B | H1B | 121.0° | 120.0° |
| C2B | C1B | O11 | H1B | 119.8° | 120.0° |
| C2B | C1B | O11 | C12 | 179.5° | 175.0° |
| C1B | C2B | N2B | HN2B | 79.4° | 95.0° |
| C1B | C2B | C3B | H3B | 72.1° | 62.9° |
| C6B | C5B | O5B | H5B | 116.6° | 120.0° |
| C5B | C6B | O6B | H6B | 120.0° | 119.9° |
| C5B | C6B | O6B | H6BA | 120.0° | 120.1° |
| C6B | C5B | O5B | C1B | 178.6° | 178.9° |
| C6B | C5B | C4B | H4B | 42.2° | 57.7° |
| C5B | C6B | H6B | H6BA | 119.9° | 120.0° |
| C5B | C6B | O6B | HO6B | 180.0° | 180.0° |
| O5B | C5B | C6B | O6B | 75.6° | 65.3° |
| C5B | O5B | C1B | O11 | 179.7° | 178.9° |
| C5B | O5B | C1B | H1B | 59.0° | 58.8° |
| O5B | C5B | C4B | H4B | 76.7° | 62.2° |
| O5B | C5B | C6B | H6B | 164.3° | 174.7° |
| O5B | C5B | C6B | H6BA | 44.4° | 54.8° |
| O6B | C6B | C5B | H5B | 41.6° | 54.7° |
| O6B | C6B | H6B | H6BA | 119.9° | 120.0° |
| O5B | C1B | O11 | H1B | 120.7° | 120.1° |
| O5B | C1B | O11 | C12 | 61.0° | 65.0° |
| O5B | C1B | C2B | H2B | 64.7° | 62.2° |
| C1B | O5B | C5B | H5B | 64.7° | 58.8° |
| C1B | O11 | C12 | C13 | 172.4° | 180.0° |
| C1B | O11 | C12 | H12 | 68.0° | 60.0° |
| C1B | O11 | C12 | H12A | 52.7° | 60.0° |
| O11 | C1B | C2B | H2B | 52.4° | 57.7° |
| O11 | C12 | C13 | H12 | 119.7° | 120.0° |
| O11 | C12 | C13 | H12A | 119.6° | 120.0° |
| O11 | C12 | C13 | N14 | 86.0° | 65.0° |
| O11 | C12 | H12 | H12A | 121.1° | 120.0° |
| O11 | C12 | C13 | H13 | 34.0° | 175.0° |
| O11 | C12 | C13 | H13A | 154.0° | 55.0° |
| C12 | O11 | C1B | H1B | 59.7° | 55.0° |
| C12 | C13 | N14 | H13 | 120.0° | 120.0° |
| C12 | C13 | N14 | H13A | 120.0° | 120.0° |
| C12 | C13 | N14 | N15 | 68.8° | 120.0° |
| C13 | C12 | H12 | H12A | 121.1° | 120.0° |
| C12 | C13 | H13 | H13A | 120.0° | 120.0° |
| C13 | N14 | N15 | N16 | 177.6° | 141.9° |
| N14 | C13 | C12 | H12 | 154.4° | 55.0° |
| N14 | C13 | C12 | H12A | 33.6° | 175.0° |
| N14 | C13 | H13 | H13A | 119.9° | 120.0° |
| N15 | N14 | C13 | H13 | 171.2° | 0.0° |
| N15 | N14 | C13 | H13A | 51.2° | 120.0° |
| H12 | C12 | C13 | H13 | 85.6° | 65.0° |
| H12 | C12 | C13 | H13A | 34.4° | 175.0° |
| H12A | C12 | C13 | H13 | 153.7° | 55.0° |
| H12A | C12 | C13 | H13A | 86.4° | 65.0° |
| H1A | C1A | C2A | H2A | 176.9° | 177.6° |
| H1B | C1B | C2B | H2B | 173.2° | 177.7° |
| H2A | C2A | N2A | HN2A | 155.1° | 144.9° |
| H2A | C2A | C3A | H3A | 175.5° | 177.2° |
| H2B | C2B | N2B | HN2B | 159.9° | 144.9° |
| H2B | C2B | C3B | H3B | 166.3° | 177.2° |
| H3A | C3A | O3A | HO3A | 57.3° | 59.8° |
| H3A | C3A | C4A | H4A | 59.2° | 57.0° |
| H3B | C3B | O3B | HO3B | 62.7° | 59.7° |
| H3B | C3B | C4B | H4B | 160.9° | 177.2° |
| H4A | C4A | O4A | HO4A | 58.4° | 60.1° |
| H4A | C4A | C5A | H5A | 61.6° | 57.6° |
| H4B | C4B | C5B | H5B | 161.7° | 177.8° |
| H5A | C5A | C6A | H6A | 163.0° | 65.1° |
| H5A | C5A | C6A | H6AA | 44.5° | 174.9° |
| H5B | C5B | C6B | H6B | 78.5° | 65.2° |
| H5B | C5B | C6B | H6BA | 161.6° | 174.8° |
| H6A | C6A | O6A | HO6A | 59.3° | 60.1° |
| H6AA | C6A | O6A | HO6A | 59.3° | 60.0° |
| H6B | C6B | O6B | HO6B | 60.0° | 60.0° |
| H6BA | C6B | O6B | HO6B | 60.0° | 60.0° |
| H8A | C8A | H8AA | H8AB | 120.0° | 120.0° |
| H8B | C8B | H8BA | H8BB | 120.0° | 120.0° |
