Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| PA | O1A | doub | 1.48Å | 1.50Å | |
| PA | O2A | sing | 1.61Å | 1.54Å | |
| PA | O5B | sing | 1.61Å | 1.60Å | |
| PA | O3 | sing | 1.61Å | 1.58Å | |
| O2A | HOA2 | sing | 0.97Å | 0.95Å | |
| O5B | C5B | sing | 1.43Å | 1.48Å | |
| C5B | C4B | sing | 1.53Å | 1.46Å | |
| C5B | H51A | sing | 1.09Å | 1.12Å | |
| C5B | H52A | sing | 1.09Å | 1.12Å | |
| C4B | O4B | sing | 1.44Å | 1.46Å | |
| C4B | C3B | sing | 1.54Å | 1.57Å | |
| C4B | H4B | sing | 1.09Å | 1.11Å | |
| O4B | C1B | sing | 1.44Å | 1.37Å | |
| C3B | O3B | sing | 1.43Å | 1.47Å | |
| C3B | C2B | sing | 1.55Å | 1.49Å | |
| C3B | H3B | sing | 1.09Å | 1.11Å | |
| O3B | HO3A | sing | 0.97Å | 0.95Å | |
| C2B | O2B | sing | 1.43Å | 1.37Å | |
| C2B | C1B | sing | 1.55Å | 1.57Å | |
| C2B | H2B | sing | 1.09Å | 1.12Å | |
| O2B | HO2A | sing | 0.97Å | 0.95Å | |
| C1B | N9A | sing | 1.46Å | 1.42Å | |
| C1B | H1B | sing | 1.09Å | 1.11Å | |
| N9A | C8A | sing | 1.36Å | 1.37Å | Aromatic |
| N9A | C4A | sing | 1.37Å | 1.40Å | Aromatic |
| C8A | N7A | doub | 1.30Å | 1.32Å | Aromatic |
| C8A | H8A | sing | 1.08Å | 1.10Å | |
| N7A | C5A | sing | 1.36Å | 1.38Å | Aromatic |
| C5A | C6A | sing | 1.41Å | 1.52Å | Aromatic |
| C5A | C4A | doub | 1.41Å | 1.39Å | Aromatic |
| C6A | N6A | sing | 1.38Å | 1.30Å | |
| C6A | N1A | doub | 1.33Å | 1.41Å | Aromatic |
| N6A | H61A | sing | 0.97Å | 1.02Å | |
| N6A | H62A | sing | 0.97Å | 1.02Å | |
| N1A | C2A | sing | 1.32Å | 1.32Å | Aromatic |
| C2A | N3A | doub | 1.32Å | 1.42Å | Aromatic |
| C2A | H2A | sing | 1.08Å | 1.10Å | |
| N3A | C4A | sing | 1.33Å | 1.43Å | Aromatic |
| O3 | PN | sing | 1.61Å | 1.64Å | |
| PN | O1N | doub | 1.55Å | 1.43Å | |
| PN | O2N | sing | 1.54Å | 1.48Å | |
| PN | O5D | sing | 1.61Å | 1.60Å | |
| O5D | C5D | sing | 1.43Å | 1.45Å | |
| C5D | C4D | sing | 1.53Å | 1.48Å | |
| C5D | H51N | sing | 1.09Å | 1.12Å | |
| C5D | H52N | sing | 1.09Å | 1.11Å | |
| C4D | O4D | sing | 1.44Å | 1.51Å | |
| C4D | C3D | sing | 1.55Å | 1.59Å | |
| C4D | H4D | sing | 1.09Å | 1.12Å | |
| O4D | C1D | sing | 1.44Å | 1.39Å | |
| C3D | O3D | sing | 1.43Å | 1.36Å | |
| C3D | C2D | sing | 1.55Å | 1.54Å | |
| C3D | H3D | sing | 1.09Å | 1.12Å | |
| O3D | HO3N | sing | 0.97Å | 0.95Å | |
| C2D | O2D | sing | 1.43Å | 1.38Å | |
| C2D | C1D | sing | 1.54Å | 1.51Å | |
| C2D | H2D | sing | 1.09Å | 1.12Å | |
| O2D | HO2N | sing | 0.97Å | 0.95Å | |
| C1D | N1N | sing | 1.47Å | 1.49Å | |
| C1D | H1D | sing | 1.09Å | 1.12Å | |
| N1N | C2N | sing | 1.32Å | 1.39Å | Aromatic |
| N1N | C6N | doub | 1.32Å | 1.35Å | Aromatic |
| C2N | C3N | doub | 1.40Å | 1.35Å | Aromatic |
| C2N | H2N | sing | 1.08Å | 1.10Å | |
| C3N | C7N | sing | 1.48Å | 1.60Å | |
| C3N | C4N | sing | 1.40Å | 1.41Å | Aromatic |
| C7N | O7N | doub | 1.22Å | 1.25Å | |
| C7N | N7N | sing | 1.35Å | 1.40Å | |
| N7N | H71N | sing | 0.97Å | 1.02Å | |
| N7N | H72N | sing | 0.97Å | 1.02Å | |
| C4N | C5N | doub | 1.38Å | 1.43Å | Aromatic |
| C4N | H4N | sing | 1.08Å | 1.10Å | |
| C5N | C6N | sing | 1.38Å | 1.37Å | Aromatic |
| C5N | H5N | sing | 1.08Å | 1.10Å | |
| C6N | H6N | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1A | PA | O2A | 119.1° | 109.5° |
| O1A | PA | O5B | 106.4° | 109.5° |
| O1A | PA | O3 | 111.4° | 109.5° |
| O2A | PA | O5B | 111.7° | 109.5° |
| O2A | PA | O3 | 106.4° | 109.5° |
| PA | O2A | HOA2 | 119.1° | 106.8° |
| O5B | PA | O3 | 100.3° | 109.5° |
| PA | O5B | C5B | 122.6° | 106.8° |
| PA | O3 | PN | 134.9° | 106.8° |
| O5B | C5B | C4B | 109.1° | 109.4° |
| O5B | C5B | H51A | 112.4° | 109.5° |
| O5B | C5B | H52A | 112.4° | 109.4° |
| C4B | C5B | H51A | 112.4° | 109.5° |
| C4B | C5B | H52A | 112.3° | 109.5° |
| C5B | C4B | O4B | 110.0° | 109.9° |
| C5B | C4B | C3B | 117.8° | 109.9° |
| C5B | C4B | H4B | 101.7° | 109.9° |
| H51A | C5B | H52A | 98.0° | 109.5° |
| O4B | C4B | C3B | 103.9° | 107.4° |
| O4B | C4B | H4B | 116.0° | 109.8° |
| C4B | O4B | C1B | 107.6° | 107.0° |
| C3B | C4B | H4B | 108.0° | 109.9° |
| C4B | C3B | O3B | 109.2° | 110.8° |
| C4B | C3B | C2B | 104.7° | 104.0° |
| C4B | C3B | H3B | 114.0° | 110.5° |
| O4B | C1B | C2B | 109.2° | 103.5° |
| O4B | C1B | N9A | 104.8° | 110.6° |
| O4B | C1B | H1B | 114.1° | 110.6° |
| O3B | C3B | C2B | 112.9° | 110.5° |
| O3B | C3B | H3B | 106.0° | 110.4° |
| C3B | O3B | HO3A | 109.1° | 106.8° |
| C2B | C3B | H3B | 110.3° | 110.5° |
| C3B | C2B | O2B | 117.0° | 110.9° |
| C3B | C2B | C1B | 95.7° | 102.1° |
| C3B | C2B | H2B | 116.6° | 111.0° |
| O2B | C2B | C1B | 116.6° | 110.9° |
| O2B | C2B | H2B | 95.6° | 110.8° |
| C2B | O2B | HO2A | 117.0° | 106.8° |
| C1B | C2B | H2B | 117.0° | 110.9° |
| C2B | C1B | N9A | 113.5° | 110.7° |
| C2B | C1B | H1B | 105.6° | 110.6° |
| N9A | C1B | H1B | 109.8° | 110.5° |
| C1B | N9A | C8A | 131.1° | 126.3° |
| C1B | N9A | C4A | 125.8° | 126.3° |
| C8A | N9A | C4A | 102.9° | 107.4° |
| N9A | C8A | N7A | 114.9° | 110.0° |
| N9A | C8A | H8A | 124.6° | 125.1° |
| N9A | C4A | C5A | 108.1° | 106.0° |
| N9A | C4A | N3A | 129.6° | 134.9° |
| N7A | C8A | H8A | 120.5° | 125.0° |
| C8A | N7A | C5A | 105.5° | 109.4° |
| N7A | C5A | C6A | 131.2° | 134.7° |
| N7A | C5A | C4A | 108.5° | 107.1° |
| C6A | C5A | C4A | 120.3° | 118.2° |
| C5A | C6A | N6A | 126.2° | 120.8° |
| C5A | C6A | N1A | 112.5° | 118.4° |
| C5A | C4A | N3A | 122.3° | 119.1° |
| N6A | C6A | N1A | 121.2° | 120.8° |
| C6A | N6A | H61A | 126.3° | 120.0° |
| C6A | N6A | H62A | 106.4° | 120.0° |
| C6A | N1A | C2A | 126.2° | 121.2° |
| H61A | N6A | H62A | 106.2° | 120.0° |
| N1A | C2A | N3A | 122.6° | 122.5° |
| N1A | C2A | H2A | 114.7° | 118.8° |
| N3A | C2A | H2A | 122.7° | 118.7° |
| C2A | N3A | C4A | 116.0° | 120.6° |
| O3 | PN | O1N | 108.0° | 109.4° |
| O3 | PN | O2N | 108.8° | 109.5° |
| O3 | PN | O5D | 101.9° | 109.5° |
| O1N | PN | O2N | 122.2° | 109.5° |
| O1N | PN | O5D | 109.6° | 109.5° |
| O2N | PN | O5D | 104.5° | 109.5° |
| PN | O5D | C5D | 121.7° | 106.8° |
| O5D | C5D | C4D | 113.5° | 109.5° |
| O5D | C5D | H51N | 110.8° | 109.5° |
| O5D | C5D | H52N | 110.7° | 109.4° |
| C4D | C5D | H51N | 110.7° | 109.5° |
| C4D | C5D | H52N | 110.7° | 109.5° |
| C5D | C4D | O4D | 106.6° | 110.4° |
| C5D | C4D | C3D | 119.3° | 110.5° |
| C5D | C4D | H4D | 102.3° | 110.3° |
| H51N | C5D | H52N | 99.5° | 109.4° |
| O4D | C4D | C3D | 99.7° | 104.8° |
| O4D | C4D | H4D | 121.2° | 110.4° |
| C4D | O4D | C1D | 109.6° | 105.2° |
| C3D | C4D | H4D | 108.9° | 110.4° |
| C4D | C3D | O3D | 103.0° | 110.6° |
| C4D | C3D | C2D | 104.3° | 104.1° |
| C4D | C3D | H3D | 117.2° | 110.5° |
| O4D | C1D | C2D | 107.3° | 105.0° |
| O4D | C1D | N1N | 108.6° | 110.3° |
| O4D | C1D | H1D | 114.3° | 110.4° |
| O3D | C3D | C2D | 111.1° | 110.6° |
| O3D | C3D | H3D | 111.0° | 110.4° |
| C3D | O3D | HO3N | 103.0° | 106.8° |
| C2D | C3D | H3D | 109.9° | 110.6° |
| C3D | C2D | O2D | 112.3° | 110.5° |
| C3D | C2D | C1D | 95.6° | 104.0° |
| C3D | C2D | H2D | 116.7° | 110.5° |
| O2D | C2D | C1D | 110.2° | 110.8° |
| O2D | C2D | H2D | 103.7° | 110.5° |
| C2D | O2D | HO2N | 112.3° | 106.8° |
| C1D | C2D | H2D | 118.6° | 110.5° |
| C2D | C1D | N1N | 116.6° | 110.4° |
| C2D | C1D | H1D | 105.8° | 110.4° |
| N1N | C1D | H1D | 104.5° | 110.3° |
| C1D | N1N | C2N | 120.1° | 119.0° |
| C1D | N1N | C6N | 113.5° | 119.0° |
| C2N | N1N | C6N | 126.2° | 121.9° |
| N1N | C2N | C3N | 113.5° | 120.5° |
| N1N | C2N | H2N | 124.4° | 119.7° |
| N1N | C6N | C5N | 117.2° | 121.0° |
| N1N | C6N | H6N | 120.6° | 119.4° |
| C3N | C2N | H2N | 122.1° | 119.8° |
| C2N | C3N | C7N | 108.9° | 120.5° |
| C2N | C3N | C4N | 127.5° | 118.9° |
| C7N | C3N | C4N | 123.6° | 120.5° |
| C3N | C7N | O7N | 118.1° | 120.0° |
| C3N | C7N | N7N | 116.6° | 120.0° |
| C3N | C4N | C5N | 112.9° | 118.3° |
| C3N | C4N | H4N | 122.8° | 120.9° |
| O7N | C7N | N7N | 125.2° | 120.0° |
| C7N | N7N | H71N | 125.3° | 120.0° |
| C7N | N7N | H72N | 116.6° | 120.0° |
| H71N | N7N | H72N | 118.1° | 120.0° |
| C5N | C4N | H4N | 124.3° | 120.9° |
| C4N | C5N | C6N | 122.8° | 119.3° |
| C4N | C5N | H5N | 120.9° | 120.4° |
| C6N | C5N | H5N | 116.3° | 120.3° |
| C5N | C6N | H6N | 122.2° | 119.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1A | PA | O2A | O5B | 124.7° | 120.0° |
| O1A | PA | O2A | O3 | 126.8° | 120.0° |
| O1A | PA | O5B | O3 | 116.0° | 120.0° |
| O1A | PA | O2A | HOA2 | 179.9° | 180.0° |
| O1A | PA | O5B | C5B | 71.0° | 55.0° |
| O1A | PA | O3 | PN | 33.4° | 40.1° |
| O2A | PA | O5B | O3 | 112.4° | 120.0° |
| O2A | PA | O5B | C5B | 60.5° | 65.0° |
| O2A | PA | O3 | PN | 164.7° | 80.0° |
| O5B | PA | O2A | HOA2 | 55.3° | 60.0° |
| PA | O5B | C5B | C4B | 87.5° | 180.0° |
| PA | O5B | C5B | H51A | 147.2° | 60.0° |
| PA | O5B | C5B | H52A | 37.8° | 60.0° |
| O5B | PA | O3 | PN | 78.8° | 160.0° |
| O3 | PA | O2A | HOA2 | 53.2° | 59.9° |
| O3 | PA | O5B | C5B | 172.9° | 175.0° |
| PA | O3 | PN | O1N | 4.4° | 80.0° |
| PA | O3 | PN | O2N | 139.0° | 40.0° |
| PA | O3 | PN | O5D | 110.9° | 160.0° |
| O5B | C5B | C4B | H51A | 125.3° | 120.0° |
| O5B | C5B | C4B | H52A | 125.3° | 119.9° |
| O5B | C5B | H51A | H52A | 118.3° | 120.0° |
| O5B | C5B | C4B | O4B | 148.8° | 66.7° |
| O5B | C5B | C4B | C3B | 92.5° | 175.3° |
| O5B | C5B | C4B | H4B | 25.3° | 54.3° |
| C4B | C5B | H51A | H52A | 118.2° | 120.0° |
| C5B | C4B | O4B | C3B | 126.9° | 119.5° |
| C5B | C4B | O4B | H4B | 114.7° | 121.0° |
| C5B | C4B | C3B | H4B | 114.3° | 121.1° |
| C5B | C4B | O4B | C1B | 128.0° | 145.9° |
| C5B | C4B | C3B | O3B | 143.5° | 119.9° |
| C5B | C4B | C3B | C2B | 95.3° | 121.4° |
| C5B | C4B | C3B | H3B | 25.3° | 2.8° |
| H51A | C5B | C4B | O4B | 23.5° | 53.3° |
| H51A | C5B | C4B | C3B | 142.2° | 64.7° |
| H51A | C5B | C4B | H4B | 100.0° | 174.3° |
| H52A | C5B | C4B | O4B | 85.9° | 173.3° |
| H52A | C5B | C4B | C3B | 32.8° | 55.3° |
| H52A | C5B | C4B | H4B | 150.6° | 65.7° |
| O4B | C4B | C3B | H4B | 123.8° | 119.4° |
| O4B | C4B | C3B | O3B | 94.6° | 120.6° |
| O4B | C4B | C3B | C2B | 26.5° | 1.9° |
| O4B | C4B | C3B | H3B | 147.1° | 116.7° |
| C4B | O4B | C1B | C2B | 27.6° | 40.0° |
| C4B | O4B | C1B | N9A | 149.5° | 158.7° |
| C4B | O4B | C1B | H1B | 90.3° | 78.5° |
| C3B | C4B | O4B | C1B | 1.1° | 26.4° |
| C4B | C3B | O3B | C2B | 116.0° | 114.7° |
| C4B | C3B | O3B | H3B | 123.2° | 122.7° |
| C4B | C3B | C2B | H3B | 123.0° | 118.6° |
| C4B | C3B | O3B | HO3A | 180.0° | 176.2° |
| C4B | C3B | C2B | O2B | 162.5° | 139.2° |
| C4B | C3B | C2B | C1B | 38.7° | 21.0° |
| C4B | C3B | C2B | H2B | 85.3° | 97.2° |
| H4B | C4B | O4B | C1B | 117.3° | 93.0° |
| H4B | C4B | C3B | O3B | 29.2° | 1.2° |
| H4B | C4B | C3B | C2B | 150.3° | 117.5° |
| H4B | C4B | C3B | H3B | 89.1° | 123.9° |
| O4B | C1B | C2B | C3B | 42.5° | 37.1° |
| O4B | C1B | C2B | O2B | 166.6° | 155.3° |
| O4B | C1B | C2B | N9A | 116.5° | 118.6° |
| O4B | C1B | C2B | H1B | 123.1° | 118.5° |
| O4B | C1B | C2B | H2B | 81.3° | 81.2° |
| O4B | C1B | N9A | H1B | 123.0° | 122.9° |
| O4B | C1B | N9A | C8A | 64.6° | 23.5° |
| O4B | C1B | N9A | C4A | 110.1° | 156.7° |
| O3B | C3B | C2B | H3B | 118.3° | 122.5° |
| O3B | C3B | C2B | O2B | 43.9° | 20.3° |
| O3B | C3B | C2B | C1B | 79.9° | 97.9° |
| O3B | C3B | C2B | H2B | 156.1° | 143.8° |
| C2B | C3B | O3B | HO3A | 64.0° | 61.5° |
| C3B | C2B | O2B | C1B | 112.3° | 112.7° |
| C3B | C2B | O2B | H2B | 123.8° | 123.6° |
| C3B | C2B | C1B | H2B | 123.8° | 118.3° |
| C3B | C2B | O2B | HO2A | 180.0° | 67.3° |
| C3B | C2B | C1B | N9A | 159.0° | 155.7° |
| C3B | C2B | C1B | H1B | 80.6° | 81.4° |
| H3B | C3B | O3B | HO3A | 56.9° | 61.0° |
| H3B | C3B | C2B | O2B | 74.5° | 102.2° |
| H3B | C3B | C2B | C1B | 161.8° | 139.6° |
| H3B | C3B | C2B | H2B | 37.8° | 21.3° |
| O2B | C2B | C1B | H2B | 112.2° | 123.5° |
| O2B | C2B | C1B | N9A | 76.9° | 86.1° |
| O2B | C2B | C1B | H1B | 43.4° | 36.8° |
| C1B | C2B | O2B | HO2A | 67.7° | 180.0° |
| C2B | C1B | N9A | H1B | 117.9° | 122.9° |
| C2B | C1B | N9A | C8A | 54.5° | 90.6° |
| C2B | C1B | N9A | C4A | 130.9° | 89.1° |
| H2B | C2B | O2B | HO2A | 56.2° | 56.4° |
| H2B | C2B | C1B | N9A | 35.3° | 37.4° |
| H2B | C2B | C1B | H1B | 155.6° | 160.3° |
| C1B | N9A | C8A | C4A | 175.5° | 179.8° |
| C1B | N9A | C8A | N7A | 176.9° | 180.0° |
| C1B | N9A | C8A | H8A | 3.0° | 0.1° |
| C1B | N9A | C4A | C5A | 176.0° | 179.8° |
| C1B | N9A | C4A | N3A | 2.0° | 0.7° |
| H1B | C1B | N9A | C8A | 172.4° | 146.4° |
| H1B | C1B | N9A | C4A | 12.9° | 33.8° |
| N9A | C8A | N7A | H8A | 180.0° | 180.0° |
| N9A | C8A | N7A | C5A | 2.1° | 0.0° |
| C8A | N9A | C4A | C5A | 0.2° | 0.4° |
| C8A | N9A | C4A | N3A | 177.8° | 179.5° |
| C4A | N9A | C8A | N7A | 1.4° | 0.2° |
| C4A | N9A | C8A | H8A | 178.6° | 179.7° |
| N9A | C4A | C5A | N7A | 1.0° | 0.4° |
| N9A | C4A | C5A | C6A | 179.3° | 179.9° |
| N9A | C4A | C5A | N3A | 178.2° | 179.3° |
| N9A | C4A | N3A | C2A | 177.9° | 179.6° |
| C8A | N7A | C5A | C6A | 178.5° | 179.9° |
| C8A | N7A | C5A | C4A | 1.8° | 0.2° |
| H8A | C8A | N7A | C5A | 177.9° | 180.0° |
| N7A | C5A | C6A | C4A | 179.6° | 179.7° |
| N7A | C5A | C6A | N6A | 1.4° | 0.0° |
| N7A | C5A | C6A | N1A | 179.4° | 180.0° |
| N7A | C5A | C4A | N3A | 179.2° | 179.7° |
| C5A | C6A | N6A | N1A | 179.1° | 180.0° |
| C5A | C6A | N6A | H61A | 180.0° | 0.0° |
| C5A | C6A | N6A | H62A | 54.8° | 179.9° |
| C5A | C6A | N1A | C2A | 2.8° | 0.1° |
| C6A | C5A | C4A | N3A | 1.1° | 0.6° |
| C4A | C5A | C6A | N6A | 179.1° | 179.7° |
| C4A | C5A | C6A | N1A | 0.1° | 0.3° |
| C5A | C4A | N3A | C2A | 0.1° | 0.6° |
| C6A | N6A | H61A | H62A | 125.3° | 179.9° |
| N6A | C6A | N1A | C2A | 176.5° | 180.0° |
| N1A | C6A | N6A | H61A | 0.9° | 180.0° |
| N1A | C6A | N6A | H62A | 126.1° | 0.0° |
| C6A | N1A | C2A | N3A | 4.1° | 0.0° |
| C6A | N1A | C2A | H2A | 175.9° | 180.0° |
| N1A | C2A | N3A | H2A | 180.0° | 179.9° |
| N1A | C2A | N3A | C4A | 2.4° | 0.3° |
| H2A | C2A | N3A | C4A | 177.6° | 179.8° |
| O3 | PN | O1N | O2N | 127.2° | 120.0° |
| O3 | PN | O1N | O5D | 110.2° | 120.0° |
| O3 | PN | O2N | O5D | 108.3° | 120.1° |
| O3 | PN | O5D | C5D | 53.4° | 175.0° |
| O1N | PN | O2N | O5D | 124.9° | 120.0° |
| O1N | PN | O5D | C5D | 60.8° | 65.0° |
| O2N | PN | O5D | C5D | 166.6° | 55.0° |
| PN | O5D | C5D | C4D | 135.1° | 180.0° |
| PN | O5D | C5D | H51N | 9.8° | 60.0° |
| PN | O5D | C5D | H52N | 99.6° | 59.9° |
| O5D | C5D | C4D | H51N | 125.3° | 120.0° |
| O5D | C5D | C4D | H52N | 125.3° | 120.0° |
| O5D | C5D | H51N | H52N | 116.6° | 119.9° |
| O5D | C5D | C4D | O4D | 7.8° | 66.4° |
| O5D | C5D | C4D | C3D | 119.5° | 178.1° |
| O5D | C5D | C4D | H4D | 120.4° | 55.8° |
| C4D | C5D | H51N | H52N | 116.5° | 120.0° |
| C5D | C4D | O4D | C3D | 124.7° | 119.0° |
| C5D | C4D | O4D | H4D | 116.1° | 122.2° |
| C5D | C4D | C3D | H4D | 116.7° | 122.2° |
| C5D | C4D | O4D | C1D | 126.8° | 159.5° |
| C5D | C4D | C3D | O3D | 155.7° | 98.3° |
| C5D | C4D | C3D | C2D | 88.1° | 143.0° |
| C5D | C4D | C3D | H3D | 33.5° | 24.3° |
| H51N | C5D | C4D | O4D | 117.5° | 173.5° |
| H51N | C5D | C4D | C3D | 5.8° | 58.0° |
| H51N | C5D | C4D | H4D | 114.3° | 64.2° |
| H52N | C5D | C4D | O4D | 133.1° | 53.5° |
| H52N | C5D | C4D | C3D | 115.2° | 61.9° |
| H52N | C5D | C4D | H4D | 4.9° | 175.8° |
| O4D | C4D | C3D | H4D | 127.9° | 118.8° |
| O4D | C4D | C3D | O3D | 88.9° | 142.8° |
| O4D | C4D | C3D | C2D | 27.3° | 24.0° |
| O4D | C4D | C3D | H3D | 148.9° | 94.7° |
| C4D | O4D | C1D | C2D | 31.9° | 40.5° |
| C4D | O4D | C1D | N1N | 158.8° | 159.4° |
| C4D | O4D | C1D | H1D | 85.0° | 78.5° |
| C3D | C4D | O4D | C1D | 2.0° | 40.5° |
| C4D | C3D | O3D | C2D | 111.2° | 114.7° |
| C4D | C3D | O3D | H3D | 126.2° | 122.6° |
| C4D | C3D | C2D | H3D | 126.4° | 118.6° |
| C4D | C3D | O3D | HO3N | 180.0° | 180.0° |
| C4D | C3D | C2D | O2D | 158.1° | 118.8° |
| C4D | C3D | C2D | C1D | 43.6° | 0.1° |
| C4D | C3D | C2D | H2D | 82.4° | 118.6° |
| H4D | C4D | O4D | C1D | 117.1° | 78.3° |
| H4D | C4D | C3D | O3D | 38.9° | 23.9° |
| H4D | C4D | C3D | C2D | 155.1° | 94.8° |
| H4D | C4D | C3D | H3D | 83.2° | 146.5° |
| O4D | C1D | C2D | C3D | 46.7° | 23.9° |
| O4D | C1D | C2D | O2D | 162.9° | 142.6° |
| O4D | C1D | C2D | N1N | 121.9° | 118.9° |
| O4D | C1D | C2D | H1D | 122.4° | 119.0° |
| O4D | C1D | C2D | H2D | 77.9° | 94.6° |
| O4D | C1D | N1N | H1D | 122.4° | 122.2° |
| O4D | C1D | N1N | C2N | 54.9° | 142.7° |
| O4D | C1D | N1N | C6N | 130.1° | 37.1° |
| O3D | C3D | C2D | H3D | 123.2° | 122.6° |
| O3D | C3D | C2D | O2D | 47.7° | 0.1° |
| O3D | C3D | C2D | C1D | 66.8° | 118.8° |
| O3D | C3D | C2D | H2D | 167.2° | 122.7° |
| C2D | C3D | O3D | HO3N | 68.8° | 65.3° |
| C3D | C2D | O2D | C1D | 105.3° | 114.6° |
| C3D | C2D | O2D | H2D | 126.8° | 122.6° |
| C3D | C2D | C1D | H2D | 124.6° | 118.5° |
| C3D | C2D | O2D | HO2N | 179.9° | 61.5° |
| C3D | C2D | C1D | N1N | 168.6° | 142.8° |
| C3D | C2D | C1D | H1D | 75.7° | 95.1° |
| H3D | C3D | O3D | HO3N | 53.7° | 57.4° |
| H3D | C3D | C2D | O2D | 75.5° | 122.6° |
| H3D | C3D | C2D | C1D | 170.0° | 118.5° |
| H3D | C3D | C2D | H2D | 44.0° | 0.0° |
| O2D | C2D | C1D | H2D | 119.2° | 122.8° |
| O2D | C2D | C1D | N1N | 75.1° | 98.6° |
| O2D | C2D | C1D | H1D | 40.5° | 23.6° |
| C1D | C2D | O2D | HO2N | 74.8° | 176.1° |
| C2D | C1D | N1N | H1D | 116.3° | 122.2° |
| C2D | C1D | N1N | C2N | 66.3° | 101.8° |
| C2D | C1D | N1N | C6N | 108.6° | 78.4° |
| H2D | C2D | O2D | HO2N | 53.1° | 61.1° |
| H2D | C2D | C1D | N1N | 44.1° | 24.2° |
| H2D | C2D | C1D | H1D | 159.7° | 146.4° |
| C1D | N1N | C2N | C6N | 174.3° | 179.8° |
| C1D | N1N | C2N | C3N | 172.9° | 179.6° |
| C1D | N1N | C2N | H2N | 7.1° | 0.3° |
| C1D | N1N | C6N | C5N | 174.1° | 179.9° |
| C1D | N1N | C6N | H6N | 5.8° | 0.0° |
| H1D | C1D | N1N | C2N | 177.3° | 20.5° |
| H1D | C1D | N1N | C6N | 7.7° | 159.3° |
| N1N | C2N | C3N | H2N | 180.0° | 179.4° |
| N1N | C2N | C3N | C7N | 178.1° | 179.7° |
| N1N | C2N | C3N | C4N | 1.0° | 0.6° |
| C2N | N1N | C6N | C5N | 0.5° | 0.3° |
| C2N | N1N | C6N | H6N | 179.6° | 179.7° |
| C6N | N1N | C2N | C3N | 1.4° | 0.6° |
| C6N | N1N | C2N | H2N | 178.7° | 180.0° |
| N1N | C6N | C5N | C4N | 0.8° | 0.0° |
| N1N | C6N | C5N | H6N | 179.9° | 180.0° |
| N1N | C6N | C5N | H5N | 179.2° | 179.9° |
| C2N | C3N | C7N | C4N | 179.2° | 179.7° |
| C2N | C3N | C7N | O7N | 178.4° | 0.3° |
| C2N | C3N | C7N | N7N | 1.0° | 179.7° |
| C2N | C3N | C4N | C5N | 0.1° | 0.2° |
| C2N | C3N | C4N | H4N | 179.9° | 179.7° |
| H2N | C2N | C3N | C7N | 1.8° | 0.3° |
| H2N | C2N | C3N | C4N | 179.0° | 179.9° |
| C3N | C7N | O7N | N7N | 177.1° | 180.0° |
| C3N | C7N | N7N | H71N | 2.9° | 180.0° |
| C3N | C7N | N7N | H72N | 179.9° | 0.3° |
| C7N | C3N | C4N | C5N | 179.2° | 180.0° |
| C7N | C3N | C4N | H4N | 0.8° | 0.0° |
| C4N | C3N | C7N | O7N | 2.4° | 180.0° |
| C4N | C3N | C7N | N7N | 179.8° | 0.0° |
| C3N | C4N | C5N | H4N | 180.0° | 179.9° |
| C3N | C4N | C5N | C6N | 1.1° | 0.0° |
| C3N | C4N | C5N | H5N | 178.9° | 180.0° |
| O7N | C7N | N7N | H71N | 180.0° | 0.0° |
| O7N | C7N | N7N | H72N | 2.9° | 179.8° |
| C7N | N7N | H71N | H72N | 177.0° | 179.8° |
| C4N | C5N | C6N | H5N | 180.0° | 179.9° |
| C4N | C5N | C6N | H6N | 179.1° | 179.9° |
| H4N | C4N | C5N | C6N | 178.9° | 180.0° |
| H4N | C4N | C5N | H5N | 1.1° | 0.1° |
| H5N | C5N | C6N | H6N | 0.9° | 0.0° |
