072
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| S1B | C1B | sing | 1.84Å | 1.82Å | |
| S1B | C2A | sing | 1.84Å | 1.83Å | |
| C1A | C1B | sing | 1.52Å | 1.62Å | |
| C1A | O1A | doub | 1.21Å | 1.27Å | |
| C1A | N3A | sing | 1.33Å | 1.41Å | |
| C1B | C1C | sing | 1.53Å | 1.61Å | |
| C1B | H1B | sing | 1.09Å | 1.12Å | |
| C1C | C1D | sing | 1.51Å | 1.64Å | |
| C1C | H1C1 | sing | 1.09Å | 1.12Å | |
| C1C | H1C2 | sing | 1.09Å | 1.12Å | |
| C1D | O1D | doub | 1.21Å | 1.24Å | |
| C1D | N4A | sing | 1.35Å | 1.45Å | |
| C2A | C2B | sing | 1.53Å | 1.60Å | |
| C2A | N3A | sing | 1.48Å | 1.54Å | |
| C2A | H2A | sing | 1.09Å | 1.12Å | |
| C2B | C2C | sing | 1.53Å | 1.59Å | |
| C2B | H2B1 | sing | 1.09Å | 1.12Å | |
| C2B | H2B2 | sing | 1.09Å | 1.11Å | |
| C2C | C2D | sing | 1.53Å | 1.61Å | |
| C2C | H2C1 | sing | 1.09Å | 1.11Å | |
| C2C | H2C2 | sing | 1.09Å | 1.11Å | |
| C2D | C2E | sing | 1.53Å | 1.62Å | |
| C2D | H2D1 | sing | 1.09Å | 1.12Å | |
| C2D | H2D2 | sing | 1.09Å | 1.12Å | |
| C2E | C2F | sing | 1.53Å | 1.62Å | |
| C2E | H2E1 | sing | 1.09Å | 1.11Å | |
| C2E | H2E2 | sing | 1.09Å | 1.12Å | |
| C2F | C2G | sing | 1.53Å | 1.59Å | |
| C2F | H2F1 | sing | 1.09Å | 1.11Å | |
| C2F | H2F2 | sing | 1.09Å | 1.11Å | |
| C2G | C2H | sing | 1.53Å | 1.57Å | |
| C2G | H2G1 | sing | 1.09Å | 1.12Å | |
| C2G | H2G2 | sing | 1.09Å | 1.11Å | |
| C2H | H2H1 | sing | 1.09Å | 1.11Å | |
| C2H | H2H2 | sing | 1.09Å | 1.11Å | |
| C2H | H2H3 | sing | 1.09Å | 1.12Å | |
| N3A | C3B | sing | 1.46Å | 1.60Å | |
| C3B | C3C | sing | 1.53Å | 1.60Å | |
| C3B | H3B1 | sing | 1.09Å | 1.12Å | |
| C3B | H3B2 | sing | 1.09Å | 1.11Å | |
| C3C | C3D | sing | 1.53Å | 1.56Å | |
| C3C | H3C1 | sing | 1.09Å | 1.12Å | |
| C3C | H3C2 | sing | 1.09Å | 1.11Å | |
| C3D | C3E | sing | 1.53Å | 1.62Å | |
| C3D | H3D1 | sing | 1.09Å | 1.12Å | |
| C3D | H3D2 | sing | 1.09Å | 1.12Å | |
| C3E | C3F | sing | 1.51Å | 1.60Å | |
| C3E | H3E1 | sing | 1.09Å | 1.11Å | |
| C3E | H3E2 | sing | 1.09Å | 1.11Å | |
| C3F | C3G | doub | 1.38Å | 1.48Å | Aromatic |
| C3F | C3H | sing | 1.38Å | 1.46Å | Aromatic |
| C3G | C3I | sing | 1.38Å | 1.46Å | Aromatic |
| C3G | H3G | sing | 1.08Å | 1.10Å | |
| C3H | C3J | doub | 1.38Å | 1.47Å | Aromatic |
| C3H | H3H | sing | 1.08Å | 1.10Å | |
| C3I | C3K | doub | 1.40Å | 1.47Å | Aromatic |
| C3I | H3I | sing | 1.08Å | 1.10Å | |
| C3J | C3K | sing | 1.40Å | 1.48Å | Aromatic |
| C3J | H3J | sing | 1.08Å | 1.10Å | |
| C3K | C3L | sing | 1.48Å | 1.48Å | |
| C3L | O3M | sing | 1.35Å | 1.28Å | |
| C3L | O3N | doub | 1.21Å | 1.26Å | |
| O3M | HOM3 | sing | 0.97Å | 0.95Å | |
| N4A | C4B | sing | 1.47Å | 1.58Å | |
| N4A | C5B | sing | 1.46Å | 1.58Å | |
| C4B | C4C | sing | 1.51Å | 1.63Å | |
| C4B | H4B1 | sing | 1.09Å | 1.11Å | |
| C4B | H4B2 | sing | 1.09Å | 1.12Å | |
| C4C | C4E | doub | 1.38Å | 1.47Å | Aromatic |
| C4C | C4D | sing | 1.38Å | 1.47Å | Aromatic |
| C4E | C4G | sing | 1.38Å | 1.46Å | Aromatic |
| C4E | H4E | sing | 1.08Å | 1.10Å | |
| C4D | C4F | doub | 1.38Å | 1.45Å | Aromatic |
| C4D | H4D | sing | 1.08Å | 1.10Å | |
| C4G | C4H | doub | 1.38Å | 1.44Å | Aromatic |
| C4G | H4G | sing | 1.08Å | 1.10Å | |
| C4F | C4H | sing | 1.38Å | 1.44Å | Aromatic |
| C4F | H4F | sing | 1.08Å | 1.10Å | |
| C4H | H4H | sing | 1.08Å | 1.10Å | |
| C5B | C5C | sing | 1.51Å | 1.62Å | |
| C5B | H5B1 | sing | 1.09Å | 1.11Å | |
| C5B | H5B2 | sing | 1.09Å | 1.12Å | |
| C5C | C5D | doub | 1.38Å | 1.46Å | Aromatic |
| C5C | C5E | sing | 1.38Å | 1.46Å | Aromatic |
| C5D | C5F | sing | 1.38Å | 1.45Å | Aromatic |
| C5D | H5D | sing | 1.08Å | 1.10Å | |
| C5E | C5G | doub | 1.38Å | 1.45Å | Aromatic |
| C5E | H5E | sing | 1.08Å | 1.10Å | |
| C5F | C5H | doub | 1.38Å | 1.46Å | Aromatic |
| C5F | H5F | sing | 1.08Å | 1.10Å | |
| C5G | C5H | sing | 1.38Å | 1.45Å | Aromatic |
| C5G | H5G | sing | 1.08Å | 1.10Å | |
| C5H | H5H | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1B | S1B | C2A | 92.5° | 96.4° |
| S1B | C1B | C1A | 107.9° | 100.5° |
| S1B | C1B | C1C | 108.8° | 111.2° |
| S1B | C1B | H1B | 114.8° | 111.2° |
| S1B | C2A | C2B | 107.1° | 111.0° |
| S1B | C2A | N3A | 112.8° | 101.3° |
| S1B | C2A | H2A | 114.2° | 111.0° |
| C1B | C1A | O1A | 121.0° | 121.2° |
| C1B | C1A | N3A | 114.4° | 117.6° |
| C1A | C1B | C1C | 118.6° | 111.3° |
| C1A | C1B | H1B | 104.0° | 111.2° |
| O1A | C1A | N3A | 124.6° | 121.2° |
| C1A | N3A | C2A | 111.1° | 119.2° |
| C1A | N3A | C3B | 119.7° | 120.4° |
| C1C | C1B | H1B | 103.0° | 111.0° |
| C1B | C1C | C1D | 125.0° | 109.5° |
| C1B | C1C | H1C1 | 106.8° | 109.4° |
| C1B | C1C | H1C2 | 106.7° | 109.5° |
| C1D | C1C | H1C1 | 106.7° | 109.5° |
| C1D | C1C | H1C2 | 106.7° | 109.5° |
| C1C | C1D | O1D | 111.5° | 120.0° |
| C1C | C1D | N4A | 131.1° | 120.0° |
| H1C1 | C1C | H1C2 | 102.8° | 109.4° |
| O1D | C1D | N4A | 117.4° | 120.0° |
| C1D | N4A | C4B | 119.2° | 120.0° |
| C1D | N4A | C5B | 123.1° | 120.0° |
| C2B | C2A | N3A | 121.1° | 111.1° |
| C2B | C2A | H2A | 104.2° | 111.0° |
| C2A | C2B | C2C | 120.5° | 109.5° |
| C2A | C2B | H2B1 | 108.2° | 109.4° |
| C2A | C2B | H2B2 | 108.2° | 109.5° |
| N3A | C2A | H2A | 97.1° | 111.1° |
| C2A | N3A | C3B | 126.9° | 120.4° |
| C2C | C2B | H2B1 | 108.3° | 109.5° |
| C2C | C2B | H2B2 | 108.3° | 109.5° |
| C2B | C2C | C2D | 122.9° | 109.6° |
| C2B | C2C | H2C1 | 107.4° | 109.5° |
| C2B | C2C | H2C2 | 107.4° | 109.5° |
| H2B1 | C2B | H2B2 | 101.7° | 109.4° |
| C2D | C2C | H2C1 | 107.4° | 109.4° |
| C2D | C2C | H2C2 | 107.4° | 109.5° |
| C2C | C2D | C2E | 121.2° | 109.5° |
| C2C | C2D | H2D1 | 108.0° | 109.4° |
| C2C | C2D | H2D2 | 108.0° | 109.5° |
| H2C1 | C2C | H2C2 | 102.4° | 109.4° |
| C2E | C2D | H2D1 | 108.0° | 109.4° |
| C2E | C2D | H2D2 | 108.1° | 109.5° |
| C2D | C2E | C2F | 123.8° | 109.5° |
| C2D | C2E | H2E1 | 107.1° | 109.4° |
| C2D | C2E | H2E2 | 107.1° | 109.5° |
| H2D1 | C2D | H2D2 | 101.8° | 109.5° |
| C2F | C2E | H2E1 | 107.2° | 109.4° |
| C2F | C2E | H2E2 | 107.1° | 109.5° |
| C2E | C2F | C2G | 122.1° | 109.6° |
| C2E | C2F | H2F1 | 107.7° | 109.5° |
| C2E | C2F | H2F2 | 107.7° | 109.5° |
| H2E1 | C2E | H2E2 | 102.6° | 109.5° |
| C2G | C2F | H2F1 | 107.8° | 109.4° |
| C2G | C2F | H2F2 | 107.7° | 109.4° |
| C2F | C2G | C2H | 120.8° | 109.6° |
| C2F | C2G | H2G1 | 108.1° | 109.5° |
| C2F | C2G | H2G2 | 108.2° | 109.4° |
| H2F1 | C2F | H2F2 | 102.1° | 109.4° |
| C2H | C2G | H2G1 | 108.2° | 109.5° |
| C2H | C2G | H2G2 | 108.2° | 109.4° |
| C2G | C2H | H2H1 | 120.8° | 109.6° |
| C2G | C2H | H2H2 | 108.2° | 109.4° |
| C2G | C2H | H2H3 | 108.1° | 109.4° |
| H2G1 | C2G | H2G2 | 101.8° | 109.4° |
| H2H1 | C2H | H2H2 | 108.2° | 109.5° |
| H2H1 | C2H | H2H3 | 108.2° | 109.5° |
| H2H2 | C2H | H2H3 | 101.8° | 109.4° |
| N3A | C3B | C3C | 126.9° | 109.5° |
| N3A | C3B | H3B1 | 106.1° | 109.5° |
| N3A | C3B | H3B2 | 106.1° | 109.5° |
| C3C | C3B | H3B1 | 106.1° | 109.4° |
| C3C | C3B | H3B2 | 106.1° | 109.5° |
| C3B | C3C | C3D | 125.7° | 109.5° |
| C3B | C3C | H3C1 | 106.4° | 109.5° |
| C3B | C3C | H3C2 | 106.5° | 109.5° |
| H3B1 | C3B | H3B2 | 103.3° | 109.4° |
| C3D | C3C | H3C1 | 106.5° | 109.5° |
| C3D | C3C | H3C2 | 106.5° | 109.5° |
| C3C | C3D | C3E | 126.0° | 109.5° |
| C3C | C3D | H3D1 | 106.4° | 109.5° |
| C3C | C3D | H3D2 | 106.3° | 109.5° |
| H3C1 | C3C | H3C2 | 103.1° | 109.5° |
| C3E | C3D | H3D1 | 106.4° | 109.5° |
| C3E | C3D | H3D2 | 106.4° | 109.5° |
| C3D | C3E | C3F | 128.7° | 109.4° |
| C3D | C3E | H3E1 | 105.5° | 109.5° |
| C3D | C3E | H3E2 | 105.4° | 109.5° |
| H3D1 | C3D | H3D2 | 103.1° | 109.5° |
| C3F | C3E | H3E1 | 105.5° | 109.5° |
| C3F | C3E | H3E2 | 105.5° | 109.5° |
| C3E | C3F | C3G | 121.3° | 119.9° |
| C3E | C3F | C3H | 121.0° | 119.8° |
| H3E1 | C3E | H3E2 | 103.8° | 109.5° |
| C3G | C3F | C3H | 117.3° | 120.3° |
| C3F | C3G | C3I | 121.5° | 120.1° |
| C3F | C3G | H3G | 120.1° | 119.9° |
| C3F | C3H | C3J | 121.4° | 120.1° |
| C3F | C3H | H3H | 119.1° | 119.9° |
| C3I | C3G | H3G | 118.4° | 120.0° |
| C3G | C3I | C3K | 120.6° | 119.9° |
| C3G | C3I | H3I | 119.4° | 120.1° |
| C3J | C3H | H3H | 119.4° | 119.9° |
| C3H | C3J | C3K | 120.5° | 119.9° |
| C3H | C3J | H3J | 119.2° | 120.1° |
| C3K | C3I | H3I | 120.1° | 120.0° |
| C3I | C3K | C3J | 117.8° | 119.7° |
| C3I | C3K | C3L | 119.2° | 120.1° |
| C3K | C3J | H3J | 120.4° | 120.1° |
| C3J | C3K | C3L | 122.3° | 120.2° |
| C3K | C3L | O3M | 120.4° | 120.0° |
| C3K | C3L | O3N | 118.2° | 120.0° |
| O3M | C3L | O3N | 121.3° | 120.0° |
| C3L | O3M | HOM3 | 120.3° | 120.0° |
| C4B | N4A | C5B | 116.4° | 120.0° |
| N4A | C4B | C4C | 122.1° | 109.5° |
| N4A | C4B | H4B1 | 107.7° | 109.4° |
| N4A | C4B | H4B2 | 107.7° | 109.5° |
| N4A | C5B | C5C | 119.2° | 109.4° |
| N4A | C5B | H5B1 | 108.8° | 109.5° |
| N4A | C5B | H5B2 | 108.8° | 109.5° |
| C4C | C4B | H4B1 | 107.8° | 109.4° |
| C4C | C4B | H4B2 | 107.7° | 109.5° |
| C4B | C4C | C4E | 121.4° | 120.0° |
| C4B | C4C | C4D | 123.5° | 119.9° |
| H4B1 | C4B | H4B2 | 102.1° | 109.5° |
| C4E | C4C | C4D | 115.1° | 120.0° |
| C4C | C4E | C4G | 122.2° | 120.0° |
| C4C | C4E | H4E | 119.2° | 120.0° |
| C4C | C4D | C4F | 122.9° | 120.0° |
| C4C | C4D | H4D | 119.2° | 120.0° |
| C4G | C4E | H4E | 118.6° | 119.9° |
| C4E | C4G | C4H | 119.7° | 119.9° |
| C4E | C4G | H4G | 120.8° | 120.0° |
| C4F | C4D | H4D | 117.8° | 120.0° |
| C4D | C4F | C4H | 119.5° | 120.0° |
| C4D | C4F | H4F | 120.6° | 120.1° |
| C4H | C4G | H4G | 119.5° | 120.0° |
| C4G | C4H | C4F | 120.1° | 120.0° |
| C4G | C4H | H4H | 120.1° | 120.0° |
| C4H | C4F | H4F | 119.9° | 120.0° |
| C4F | C4H | H4H | 119.9° | 120.0° |
| C5C | C5B | H5B1 | 108.7° | 109.4° |
| C5C | C5B | H5B2 | 108.7° | 109.4° |
| C5B | C5C | C5D | 120.2° | 120.0° |
| C5B | C5C | C5E | 121.7° | 120.0° |
| H5B1 | C5B | H5B2 | 101.3° | 109.5° |
| C5D | C5C | C5E | 117.1° | 120.0° |
| C5C | C5D | C5F | 121.8° | 120.0° |
| C5C | C5D | H5D | 119.4° | 120.0° |
| C5C | C5E | C5G | 121.5° | 120.0° |
| C5C | C5E | H5E | 119.8° | 120.0° |
| C5F | C5D | H5D | 118.8° | 119.9° |
| C5D | C5F | C5H | 119.4° | 120.0° |
| C5D | C5F | H5F | 120.1° | 120.0° |
| C5G | C5E | H5E | 118.6° | 120.0° |
| C5E | C5G | C5H | 120.4° | 120.0° |
| C5E | C5G | H5G | 119.8° | 120.0° |
| C5H | C5F | H5F | 120.4° | 120.0° |
| C5F | C5H | C5G | 119.4° | 120.0° |
| C5F | C5H | H5H | 120.7° | 120.0° |
| C5H | C5G | H5G | 119.8° | 120.0° |
| C5G | C5H | H5H | 119.9° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| S1B | C1B | C1A | C1C | 124.1° | 117.8° |
| S1B | C1B | C1A | H1B | 122.3° | 117.8° |
| S1B | C1B | C1A | O1A | 171.2° | 165.6° |
| S1B | C1B | C1A | N3A | 10.7° | 14.5° |
| S1B | C1B | C1C | H1B | 122.2° | 124.4° |
| S1B | C1B | C1C | C1D | 68.3° | 61.4° |
| S1B | C1B | C1C | H1C1 | 166.4° | 58.6° |
| S1B | C1B | C1C | H1C2 | 56.9° | 178.5° |
| C1B | S1B | C2A | C2B | 144.2° | 137.7° |
| C1B | S1B | C2A | N3A | 8.5° | 19.6° |
| C1B | S1B | C2A | H2A | 101.1° | 98.4° |
| C2A | S1B | C1B | C1A | 10.3° | 19.3° |
| S1B | C2A | N3A | C1A | 3.4° | 14.8° |
| C2A | S1B | C1B | C1C | 119.5° | 98.6° |
| C2A | S1B | C1B | H1B | 125.7° | 137.1° |
| S1B | C2A | C2B | N3A | 131.2° | 111.9° |
| S1B | C2A | C2B | H2A | 121.3° | 124.0° |
| S1B | C2A | N3A | H2A | 120.0° | 118.0° |
| S1B | C2A | C2B | C2C | 119.9° | 64.7° |
| S1B | C2A | C2B | H2B1 | 5.4° | 175.2° |
| S1B | C2A | C2B | H2B2 | 114.8° | 55.3° |
| S1B | C2A | N3A | C3B | 166.1° | 165.2° |
| C1B | C1A | O1A | N3A | 177.9° | 180.0° |
| C1A | C1B | C1C | H1B | 114.1° | 124.5° |
| C1A | C1B | C1C | C1D | 55.3° | 172.6° |
| C1A | C1B | C1C | H1C1 | 69.9° | 52.6° |
| C1A | C1B | C1C | H1C2 | 179.4° | 67.4° |
| C1B | C1A | N3A | C2A | 4.7° | 0.2° |
| C1B | C1A | N3A | C3B | 159.3° | 179.7° |
| O1A | C1A | C1B | C1C | 64.7° | 76.6° |
| O1A | C1A | C1B | H1B | 48.9° | 47.8° |
| O1A | C1A | N3A | C2A | 177.3° | 179.8° |
| O1A | C1A | N3A | C3B | 18.7° | 0.3° |
| N3A | C1A | C1B | C1C | 113.4° | 103.4° |
| N3A | C1A | C1B | H1B | 133.0° | 132.2° |
| C1A | N3A | C2A | C2B | 132.2° | 132.7° |
| C1A | N3A | C2A | C3B | 162.6° | 179.9° |
| C1A | N3A | C2A | H2A | 116.6° | 103.2° |
| C1A | N3A | C3B | C3C | 133.1° | 90.0° |
| C1A | N3A | C3B | H3B1 | 7.8° | 150.0° |
| C1A | N3A | C3B | H3B2 | 101.7° | 30.0° |
| C1B | C1C | C1D | H1C1 | 125.3° | 120.0° |
| C1B | C1C | C1D | H1C2 | 125.3° | 120.0° |
| C1B | C1C | H1C1 | H1C2 | 112.2° | 120.0° |
| C1B | C1C | C1D | O1D | 28.5° | 5.5° |
| C1B | C1C | C1D | N4A | 152.9° | 174.5° |
| H1B | C1B | C1C | C1D | 169.5° | 62.9° |
| H1B | C1B | C1C | H1C1 | 44.2° | 177.1° |
| H1B | C1B | C1C | H1C2 | 65.2° | 57.1° |
| C1D | C1C | H1C1 | H1C2 | 112.1° | 120.0° |
| C1C | C1D | O1D | N4A | 178.8° | 180.0° |
| C1C | C1D | N4A | C4B | 155.7° | 174.4° |
| C1C | C1D | N4A | C5B | 11.1° | 5.5° |
| H1C1 | C1C | C1D | O1D | 96.8° | 125.5° |
| H1C1 | C1C | C1D | N4A | 81.8° | 54.5° |
| H1C2 | C1C | C1D | O1D | 153.8° | 114.6° |
| H1C2 | C1C | C1D | N4A | 27.6° | 65.4° |
| O1D | C1D | N4A | C4B | 25.7° | 5.6° |
| O1D | C1D | N4A | C5B | 167.4° | 174.5° |
| C1D | N4A | C4B | C5B | 167.7° | 179.9° |
| C1D | N4A | C4B | C4C | 81.9° | 90.0° |
| C1D | N4A | C4B | H4B1 | 43.5° | 150.1° |
| C1D | N4A | C4B | H4B2 | 152.9° | 30.0° |
| C1D | N4A | C5B | C5C | 77.5° | 95.6° |
| C1D | N4A | C5B | H5B1 | 47.7° | 144.5° |
| C1D | N4A | C5B | H5B2 | 157.2° | 24.4° |
| C2B | C2A | N3A | H2A | 111.3° | 124.0° |
| C2A | C2B | C2C | H2B1 | 125.2° | 120.0° |
| C2A | C2B | C2C | H2B2 | 125.3° | 120.1° |
| C2A | C2B | H2B1 | H2B2 | 113.9° | 120.0° |
| C2A | C2B | C2C | C2D | 77.4° | 180.0° |
| C2A | C2B | C2C | H2C1 | 157.3° | 60.0° |
| C2A | C2B | C2C | H2C2 | 47.8° | 59.9° |
| C2B | C2A | N3A | C3B | 65.2° | 47.2° |
| N3A | C2A | C2B | C2C | 108.9° | 176.7° |
| N3A | C2A | C2B | H2B1 | 125.8° | 63.3° |
| N3A | C2A | C2B | H2B2 | 16.4° | 56.6° |
| C2A | N3A | C3B | C3C | 65.6° | 90.1° |
| C2A | N3A | C3B | H3B1 | 169.1° | 29.9° |
| C2A | N3A | C3B | H3B2 | 59.6° | 149.9° |
| H2A | C2A | C2B | C2C | 1.4° | 59.2° |
| H2A | C2A | C2B | H2B1 | 126.7° | 60.8° |
| H2A | C2A | C2B | H2B2 | 123.9° | 179.3° |
| H2A | C2A | N3A | C3B | 46.1° | 76.9° |
| C2C | C2B | H2B1 | H2B2 | 114.0° | 120.0° |
| C2B | C2C | C2D | H2C1 | 125.3° | 120.0° |
| C2B | C2C | C2D | H2C2 | 125.2° | 120.1° |
| C2B | C2C | H2C1 | H2C2 | 113.0° | 120.0° |
| C2B | C2C | C2D | C2E | 174.9° | 180.0° |
| C2B | C2C | C2D | H2D1 | 49.6° | 60.0° |
| C2B | C2C | C2D | H2D2 | 59.8° | 59.9° |
| H2B1 | C2B | C2C | C2D | 47.8° | 60.0° |
| H2B1 | C2B | C2C | H2C1 | 77.4° | 180.0° |
| H2B1 | C2B | C2C | H2C2 | 173.1° | 60.1° |
| H2B2 | C2B | C2C | C2D | 157.3° | 59.9° |
| H2B2 | C2B | C2C | H2C1 | 32.1° | 60.1° |
| H2B2 | C2B | C2C | H2C2 | 77.4° | 180.0° |
| C2D | C2C | H2C1 | H2C2 | 113.0° | 120.0° |
| C2C | C2D | C2E | H2D1 | 125.3° | 119.9° |
| C2C | C2D | C2E | H2D2 | 125.3° | 120.1° |
| C2C | C2D | H2D1 | H2D2 | 113.6° | 120.0° |
| C2C | C2D | C2E | C2F | 69.8° | 180.0° |
| C2C | C2D | C2E | H2E1 | 55.5° | 60.1° |
| C2C | C2D | C2E | H2E2 | 164.9° | 59.9° |
| H2C1 | C2C | C2D | C2E | 59.9° | 60.0° |
| H2C1 | C2C | C2D | H2D1 | 174.9° | 180.0° |
| H2C1 | C2C | C2D | H2D2 | 65.5° | 60.1° |
| H2C2 | C2C | C2D | C2E | 49.6° | 59.9° |
| H2C2 | C2C | C2D | H2D1 | 75.6° | 60.0° |
| H2C2 | C2C | C2D | H2D2 | 174.9° | 180.0° |
| C2E | C2D | H2D1 | H2D2 | 113.7° | 120.0° |
| C2D | C2E | C2F | H2E1 | 125.3° | 119.9° |
| C2D | C2E | C2F | H2E2 | 125.3° | 120.1° |
| C2D | C2E | H2E1 | H2E2 | 112.6° | 120.0° |
| C2D | C2E | C2F | C2G | 166.5° | 179.9° |
| C2D | C2E | C2F | H2F1 | 68.2° | 60.0° |
| C2D | C2E | C2F | H2F2 | 41.2° | 59.9° |
| H2D1 | C2D | C2E | C2F | 164.9° | 60.1° |
| H2D1 | C2D | C2E | H2E1 | 69.8° | NaN° |
| H2D1 | C2D | C2E | H2E2 | 39.7° | 60.0° |
| H2D2 | C2D | C2E | C2F | 55.5° | 59.9° |
| H2D2 | C2D | C2E | H2E1 | 179.2° | 60.0° |
| H2D2 | C2D | C2E | H2E2 | 69.8° | 180.0° |
| C2F | C2E | H2E1 | H2E2 | 112.6° | 120.0° |
| C2E | C2F | C2G | H2F1 | 125.2° | 120.1° |
| C2E | C2F | C2G | H2F2 | 125.2° | 120.1° |
| C2E | C2F | H2F1 | H2F2 | 113.2° | 120.0° |
| C2E | C2F | C2G | C2H | 81.2° | 180.0° |
| C2E | C2F | C2G | H2G1 | 44.0° | 59.9° |
| C2E | C2F | C2G | H2G2 | 153.5° | 59.9° |
| H2E1 | C2E | C2F | C2G | 41.2° | 60.0° |
| H2E1 | C2E | C2F | H2F1 | 166.5° | 180.0° |
| H2E1 | C2E | C2F | H2F2 | 84.0° | 60.0° |
| H2E2 | C2E | C2F | C2G | 68.2° | 60.0° |
| H2E2 | C2E | C2F | H2F1 | 57.0° | 60.1° |
| H2E2 | C2E | C2F | H2F2 | 166.5° | 180.0° |
| C2G | C2F | H2F1 | H2F2 | 113.3° | 119.9° |
| C2F | C2G | C2H | H2G1 | 125.2° | 120.1° |
| C2F | C2G | C2H | H2G2 | 125.3° | 120.0° |
| C2F | C2G | H2G1 | H2G2 | 113.8° | 119.9° |
| C2F | C2G | C2H | H2H1 | 180.0° | 180.0° |
| C2F | C2G | C2H | H2H2 | 54.7° | 60.0° |
| C2F | C2G | C2H | H2H3 | 54.7° | 59.9° |
| H2F1 | C2F | C2G | C2H | 153.5° | 59.9° |
| H2F1 | C2F | C2G | H2G1 | 81.2° | 180.0° |
| H2F1 | C2F | C2G | H2G2 | 28.2° | 60.1° |
| H2F2 | C2F | C2G | C2H | 44.0° | 60.0° |
| H2F2 | C2F | C2G | H2G1 | 169.3° | 60.2° |
| H2F2 | C2F | C2G | H2G2 | 81.3° | 180.0° |
| C2H | C2G | H2G1 | H2G2 | 113.8° | 119.9° |
| C2G | C2H | H2H1 | H2H2 | 125.3° | 120.0° |
| C2G | C2H | H2H1 | H2H3 | 125.2° | 120.0° |
| C2G | C2H | H2H2 | H2H3 | 113.7° | 119.9° |
| H2G1 | C2G | C2H | H2H1 | 54.8° | 59.9° |
| H2G1 | C2G | C2H | H2H2 | 179.9° | 60.1° |
| H2G1 | C2G | C2H | H2H3 | 70.5° | 180.0° |
| H2G2 | C2G | C2H | H2H1 | 54.8° | 60.0° |
| H2G2 | C2G | C2H | H2H2 | 70.6° | NaN° |
| H2G2 | C2G | C2H | H2H3 | 180.0° | 60.1° |
| H2H1 | C2H | H2H2 | H2H3 | 113.8° | 120.0° |
| N3A | C3B | C3C | H3B1 | 125.3° | 120.0° |
| N3A | C3B | C3C | H3B2 | 125.3° | 120.0° |
| N3A | C3B | H3B1 | H3B2 | 111.4° | 120.0° |
| N3A | C3B | C3C | C3D | 91.5° | 180.0° |
| N3A | C3B | C3C | H3C1 | 143.3° | 60.1° |
| N3A | C3B | C3C | H3C2 | 33.8° | 60.0° |
| C3C | C3B | H3B1 | H3B2 | 111.4° | 120.0° |
| C3B | C3C | C3D | H3C1 | 125.2° | 120.0° |
| C3B | C3C | C3D | H3C2 | 125.3° | 120.0° |
| C3B | C3C | H3C1 | H3C2 | 111.9° | 120.0° |
| C3B | C3C | C3D | C3E | 164.1° | 180.0° |
| C3B | C3C | C3D | H3D1 | 38.8° | 60.0° |
| C3B | C3C | C3D | H3D2 | 70.5° | 60.0° |
| H3B1 | C3B | C3C | C3D | 33.8° | 60.0° |
| H3B1 | C3B | C3C | H3C1 | 91.5° | 180.0° |
| H3B1 | C3B | C3C | H3C2 | 159.0° | 60.0° |
| H3B2 | C3B | C3C | C3D | 143.2° | 60.0° |
| H3B2 | C3B | C3C | H3C1 | 18.0° | 60.0° |
| H3B2 | C3B | C3C | H3C2 | 91.5° | 180.0° |
| C3D | C3C | H3C1 | H3C2 | 111.9° | 120.0° |
| C3C | C3D | C3E | H3D1 | 125.3° | 120.0° |
| C3C | C3D | C3E | H3D2 | 125.3° | 120.0° |
| C3C | C3D | H3D1 | H3D2 | 111.7° | 120.0° |
| C3C | C3D | C3E | C3F | 94.9° | 180.0° |
| C3C | C3D | C3E | H3E1 | 30.3° | 60.0° |
| C3C | C3D | C3E | H3E2 | 139.8° | 60.0° |
| H3C1 | C3C | C3D | C3E | 70.6° | 60.0° |
| H3C1 | C3C | C3D | H3D1 | 164.0° | 180.0° |
| H3C1 | C3C | C3D | H3D2 | 54.7° | 60.0° |
| H3C2 | C3C | C3D | C3E | 38.9° | 60.0° |
| H3C2 | C3C | C3D | H3D1 | 86.4° | 60.0° |
| H3C2 | C3C | C3D | H3D2 | 164.2° | 180.0° |
| C3E | C3D | H3D1 | H3D2 | 111.8° | 120.0° |
| C3D | C3E | C3F | H3E1 | 125.3° | 120.0° |
| C3D | C3E | C3F | H3E2 | 125.2° | 120.0° |
| C3D | C3E | H3E1 | H3E2 | 110.6° | 120.0° |
| C3D | C3E | C3F | C3G | 59.6° | 90.0° |
| C3D | C3E | C3F | C3H | 127.9° | 90.3° |
| H3D1 | C3D | C3E | C3F | 139.8° | 60.0° |
| H3D1 | C3D | C3E | H3E1 | 94.9° | 180.0° |
| H3D1 | C3D | C3E | H3E2 | 14.5° | 60.0° |
| H3D2 | C3D | C3E | C3F | 30.3° | 60.0° |
| H3D2 | C3D | C3E | H3E1 | 155.6° | 60.0° |
| H3D2 | C3D | C3E | H3E2 | 94.9° | 180.0° |
| C3F | C3E | H3E1 | H3E2 | 110.8° | 120.0° |
| C3E | C3F | C3G | C3H | 172.8° | 179.7° |
| C3E | C3F | C3G | C3I | 179.4° | 180.0° |
| C3E | C3F | C3G | H3G | 0.6° | 0.0° |
| C3E | C3F | C3H | C3J | 176.5° | 179.7° |
| C3E | C3F | C3H | H3H | 3.5° | 0.3° |
| H3E1 | C3E | C3F | C3G | 175.2° | 30.0° |
| H3E1 | C3E | C3F | C3H | 2.7° | 149.7° |
| H3E2 | C3E | C3F | C3G | 65.6° | 150.0° |
| H3E2 | C3E | C3F | C3H | 106.9° | 29.7° |
| C3F | C3G | C3I | H3G | 180.0° | 180.0° |
| C3G | C3F | C3H | C3J | 3.7° | 0.6° |
| C3G | C3F | C3H | H3H | 176.3° | 180.0° |
| C3F | C3G | C3I | C3K | 10.2° | 0.0° |
| C3F | C3G | C3I | H3I | 169.8° | 180.0° |
| C3H | C3F | C3G | C3I | 6.6° | 0.3° |
| C3H | C3F | C3G | H3G | 173.4° | 179.7° |
| C3F | C3H | C3J | H3H | 180.0° | 179.5° |
| C3F | C3H | C3J | C3K | 4.3° | 0.6° |
| C3F | C3H | C3J | H3J | 175.6° | 179.8° |
| C3G | C3I | C3K | H3I | 180.0° | 180.0° |
| C3G | C3I | C3K | C3J | 10.3° | 0.0° |
| C3G | C3I | C3K | C3L | 160.2° | 180.0° |
| H3G | C3G | C3I | C3K | 169.8° | 180.0° |
| H3G | C3G | C3I | H3I | 10.2° | 0.0° |
| C3H | C3J | C3K | C3I | 7.5° | 0.3° |
| C3H | C3J | C3K | H3J | 180.0° | 179.7° |
| C3H | C3J | C3K | C3L | 162.8° | 179.8° |
| H3H | C3H | C3J | C3K | 175.7° | 180.0° |
| H3H | C3H | C3J | H3J | 4.4° | 0.3° |
| C3I | C3K | C3J | C3L | 170.2° | 180.0° |
| C3I | C3K | C3J | H3J | 172.5° | 180.0° |
| C3I | C3K | C3L | O3M | 99.1° | 180.0° |
| C3I | C3K | C3L | O3N | 77.0° | 0.0° |
| H3I | C3I | C3K | C3J | 169.7° | 180.0° |
| H3I | C3I | C3K | C3L | 19.8° | 0.0° |
| C3J | C3K | C3L | O3M | 71.1° | 0.1° |
| C3J | C3K | C3L | O3N | 112.9° | 180.0° |
| H3J | C3J | C3K | C3L | 17.2° | 0.1° |
| C3K | C3L | O3M | O3N | 176.0° | 179.9° |
| C3K | C3L | O3M | HOM3 | 180.0° | 180.0° |
| O3N | C3L | O3M | HOM3 | 4.0° | 0.1° |
| N4A | C4B | C4C | H4B1 | 125.3° | 119.9° |
| N4A | C4B | C4C | H4B2 | 125.2° | 120.1° |
| N4A | C4B | H4B1 | H4B2 | 113.2° | 120.1° |
| N4A | C4B | C4C | C4E | 169.7° | 89.9° |
| N4A | C4B | C4C | C4D | 11.6° | 90.3° |
| C4B | N4A | C5B | C5C | 115.3° | 84.5° |
| C4B | N4A | C5B | H5B1 | 119.4° | 35.5° |
| C4B | N4A | C5B | H5B2 | 10.0° | 155.6° |
| C5B | N4A | C4B | C4C | 85.8° | 89.9° |
| C5B | N4A | C4B | H4B1 | 148.8° | 30.0° |
| C5B | N4A | C4B | H4B2 | 39.4° | 150.0° |
| N4A | C5B | C5C | H5B1 | 125.3° | 120.0° |
| N4A | C5B | C5C | H5B2 | 125.3° | 120.0° |
| N4A | C5B | H5B1 | H5B2 | 114.5° | 120.1° |
| N4A | C5B | C5C | C5D | 90.8° | 84.6° |
| N4A | C5B | C5C | C5E | 100.9° | 95.7° |
| C4C | C4B | H4B1 | H4B2 | 113.3° | 120.0° |
| C4B | C4C | C4E | C4D | 178.8° | 179.8° |
| C4B | C4C | C4E | C4G | 178.2° | 180.0° |
| C4B | C4C | C4E | H4E | 1.8° | 0.0° |
| C4B | C4C | C4D | C4F | 174.0° | 179.8° |
| C4B | C4C | C4D | H4D | 6.0° | 0.2° |
| H4B1 | C4B | C4C | C4E | 65.0° | 30.0° |
| H4B1 | C4B | C4C | C4D | 113.7° | 149.8° |
| H4B2 | C4B | C4C | C4E | 44.5° | 150.0° |
| H4B2 | C4B | C4C | C4D | 136.8° | 29.8° |
| C4C | C4E | C4G | H4E | 180.0° | 180.0° |
| C4E | C4C | C4D | C4F | 7.2° | 0.4° |
| C4E | C4C | C4D | H4D | 172.8° | 179.9° |
| C4C | C4E | C4G | C4H | 3.8° | 0.0° |
| C4C | C4E | C4G | H4G | 176.2° | 180.0° |
| C4D | C4C | C4E | C4G | 3.0° | 0.2° |
| C4D | C4C | C4E | H4E | 177.0° | 179.8° |
| C4C | C4D | C4F | H4D | 180.0° | 179.6° |
| C4C | C4D | C4F | C4H | 4.5° | 0.4° |
| C4C | C4D | C4F | H4F | 175.4° | 179.8° |
| C4E | C4G | C4H | H4G | 180.0° | 179.9° |
| C4E | C4G | C4H | C4F | 6.8° | 0.0° |
| C4E | C4G | C4H | H4H | 173.2° | 179.9° |
| H4E | C4E | C4G | C4H | 176.2° | 180.0° |
| H4E | C4E | C4G | H4G | 3.8° | 0.1° |
| C4D | C4F | C4H | C4G | 2.8° | 0.2° |
| C4D | C4F | C4H | H4F | 180.0° | 179.8° |
| C4D | C4F | C4H | H4H | 177.2° | 179.8° |
| H4D | C4D | C4F | C4H | 175.5° | 180.0° |
| H4D | C4D | C4F | H4F | 4.6° | 0.2° |
| C4G | C4H | C4F | H4H | 180.0° | 180.0° |
| C4G | C4H | C4F | H4F | 177.3° | 180.0° |
| H4G | C4G | C4H | C4F | 173.2° | 180.0° |
| H4G | C4G | C4H | H4H | 6.8° | 0.0° |
| H4F | C4F | C4H | H4H | 2.8° | 0.0° |
| C5C | C5B | H5B1 | H5B2 | 114.4° | 120.0° |
| C5B | C5C | C5D | C5E | 168.8° | 179.7° |
| C5B | C5C | C5D | C5F | 164.1° | 180.0° |
| C5B | C5C | C5D | H5D | 15.9° | 0.1° |
| C5B | C5C | C5E | C5G | 168.1° | 179.8° |
| C5B | C5C | C5E | H5E | 11.8° | 0.3° |
| H5B1 | C5B | C5C | C5D | 34.5° | 35.4° |
| H5B1 | C5B | C5C | C5E | 133.8° | 144.3° |
| H5B2 | C5B | C5C | C5D | 143.9° | 155.4° |
| H5B2 | C5B | C5C | C5E | 24.4° | 24.3° |
| C5C | C5D | C5F | H5D | 180.0° | 180.0° |
| C5D | C5C | C5E | C5G | 0.5° | 0.6° |
| C5D | C5C | C5E | H5E | 179.5° | 180.0° |
| C5C | C5D | C5F | C5H | 6.5° | 0.0° |
| C5C | C5D | C5F | H5F | 173.5° | 179.9° |
| C5E | C5C | C5D | C5F | 4.7° | 0.3° |
| C5E | C5C | C5D | H5D | 175.3° | 179.7° |
| C5C | C5E | C5G | H5E | 180.0° | 179.5° |
| C5C | C5E | C5G | C5H | 2.0° | 0.5° |
| C5C | C5E | C5G | H5G | 178.1° | 179.6° |
| C5D | C5F | C5H | H5F | 180.0° | 179.9° |
| C5D | C5F | C5H | C5G | 3.8° | 0.1° |
| C5D | C5F | C5H | H5H | 176.2° | 179.9° |
| H5D | C5D | C5F | C5H | 173.5° | 180.0° |
| H5D | C5D | C5F | H5F | 6.5° | 0.1° |
| C5E | C5G | C5H | C5F | 0.3° | 0.2° |
| C5E | C5G | C5H | H5G | 180.0° | 179.9° |
| C5E | C5G | C5H | H5H | 179.7° | 179.8° |
| H5E | C5E | C5G | C5H | 178.0° | 180.0° |
| H5E | C5E | C5G | H5G | 2.0° | 0.2° |
| C5F | C5H | C5G | H5H | 180.0° | 180.0° |
| C5F | C5H | C5G | H5G | 179.8° | 179.9° |
| H5F | C5F | C5H | C5G | 176.1° | 180.0° |
| H5F | C5F | C5H | H5H | 3.8° | 0.0° |
| H5G | C5G | C5H | H5H | 0.3° | 0.0° |
