AAO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1A | C2A | sing | 1.53Å | 1.55Å | |
| C1A | O5A | sing | 1.43Å | 1.44Å | |
| C1A | O4B | sing | 1.43Å | 1.44Å | |
| C1A | H1A | sing | 1.09Å | 1.11Å | |
| C2A | C3A | sing | 1.53Å | 1.54Å | |
| C2A | O2A | sing | 1.43Å | 1.41Å | |
| C2A | H2A | sing | 1.09Å | 1.12Å | |
| C3A | C4A | sing | 1.53Å | 1.53Å | |
| C3A | O3A | sing | 1.43Å | 1.41Å | |
| C3A | H3A | sing | 1.09Å | 1.11Å | |
| C4A | C5A | sing | 1.53Å | 1.56Å | |
| C4A | O4A | sing | 1.43Å | 1.42Å | |
| C4A | H4A | sing | 1.09Å | 1.11Å | |
| C5A | C6A | sing | 1.53Å | 1.55Å | |
| C5A | O5A | sing | 1.43Å | 1.44Å | |
| C5A | H5A | sing | 1.09Å | 1.12Å | |
| C6A | O6A | sing | 1.43Å | 1.41Å | |
| C6A | H6A1 | sing | 1.09Å | 1.11Å | |
| C6A | H6A2 | sing | 1.09Å | 1.11Å | |
| O2A | H11 | sing | 0.97Å | 0.95Å | |
| O3A | H10 | sing | 0.97Å | 0.95Å | |
| O4A | H9 | sing | 0.97Å | 0.95Å | |
| O6A | H6A | sing | 0.97Å | 0.95Å | |
| C1B | C2B | sing | 1.53Å | 1.55Å | |
| C1B | O5B | sing | 1.43Å | 1.45Å | |
| C1B | O4H | sing | 1.43Å | 1.42Å | |
| C1B | H1B | sing | 1.09Å | 1.11Å | |
| C2B | C3B | sing | 1.53Å | 1.54Å | |
| C2B | O2B | sing | 1.43Å | 1.42Å | |
| C2B | H2B | sing | 1.09Å | 1.12Å | |
| C3B | C4B | sing | 1.53Å | 1.54Å | |
| C3B | O3B | sing | 1.43Å | 1.42Å | |
| C3B | H3B | sing | 1.09Å | 1.11Å | |
| C4B | C5B | sing | 1.53Å | 1.56Å | |
| C4B | O4B | sing | 1.43Å | 1.43Å | |
| C4B | H4B | sing | 1.09Å | 1.11Å | |
| C5B | C6B | sing | 1.53Å | 1.54Å | |
| C5B | O5B | sing | 1.43Å | 1.43Å | |
| C5B | H5B | sing | 1.09Å | 1.12Å | |
| C6B | O6B | sing | 1.43Å | 1.41Å | |
| C6B | H6B1 | sing | 1.09Å | 1.11Å | |
| C6B | H6B2 | sing | 1.09Å | 1.11Å | |
| O2B | H13 | sing | 0.97Å | 0.95Å | |
| O3B | H12 | sing | 0.97Å | 0.95Å | |
| O6B | H6B | sing | 0.97Å | 0.95Å | |
| C1C | C2C | sing | 1.53Å | 1.56Å | |
| C1C | O5C | sing | 1.43Å | 1.44Å | |
| C1C | O4G | sing | 1.43Å | 1.43Å | |
| C1C | H1C | sing | 1.09Å | 1.11Å | |
| C2C | C3C | sing | 1.53Å | 1.55Å | |
| C2C | O2C | sing | 1.43Å | 1.42Å | |
| C2C | H2C | sing | 1.09Å | 1.11Å | |
| C3C | C4C | sing | 1.53Å | 1.54Å | |
| C3C | O3C | sing | 1.43Å | 1.41Å | |
| C3C | H3C | sing | 1.09Å | 1.11Å | |
| C4C | C5C | sing | 1.53Å | 1.55Å | |
| C4C | N4C | sing | 1.47Å | 1.50Å | |
| C4C | H4C | sing | 1.09Å | 1.12Å | |
| C5C | C6C | sing | 1.53Å | 1.53Å | |
| C5C | O5C | sing | 1.43Å | 1.46Å | |
| C5C | H5C | sing | 1.09Å | 1.12Å | |
| C6C | H6C1 | sing | 1.09Å | 1.11Å | |
| C6C | H6C2 | sing | 1.09Å | 1.12Å | |
| C6C | H6C3 | sing | 1.09Å | 1.11Å | |
| O2C | H6 | sing | 0.97Å | 0.95Å | |
| O3C | H7 | sing | 0.97Å | 0.95Å | |
| N4C | C1H | sing | 1.47Å | 1.50Å | |
| N4C | H8 | sing | 1.01Å | 1.02Å | |
| C1H | C2H | sing | 1.53Å | 1.53Å | |
| C1H | C6H | sing | 1.50Å | 1.54Å | |
| C1H | H1H | sing | 1.09Å | 1.11Å | |
| C2H | C3H | sing | 1.53Å | 1.55Å | |
| C2H | O2H | sing | 1.43Å | 1.44Å | |
| C2H | H2H | sing | 1.09Å | 1.11Å | |
| C3H | C4H | sing | 1.53Å | 1.58Å | |
| C3H | O3H | sing | 1.43Å | 1.41Å | |
| C3H | H3H | sing | 1.09Å | 1.11Å | |
| C4H | C5H | sing | 1.50Å | 1.57Å | |
| C4H | O4H | sing | 1.43Å | 1.42Å | |
| C4H | H4H | sing | 1.09Å | 1.12Å | |
| C5H | C6H | doub | 1.29Å | 1.35Å | |
| C5H | C7H | sing | 1.51Å | 1.53Å | |
| C6H | H6H | sing | 1.08Å | 1.10Å | |
| C7H | O7H | sing | 1.43Å | 1.42Å | |
| C7H | H7H1 | sing | 1.09Å | 1.12Å | |
| C7H | H7H2 | sing | 1.09Å | 1.11Å | |
| O2H | H15 | sing | 0.97Å | 0.95Å | |
| O3H | H14 | sing | 0.97Å | 0.95Å | |
| O7H | H7H | sing | 0.97Å | 0.95Å | |
| C1G | C2G | sing | 1.53Å | 1.54Å | |
| C1G | O1G | sing | 1.43Å | 1.42Å | |
| C1G | O5G | sing | 1.43Å | 1.44Å | |
| C1G | H1G | sing | 1.09Å | 1.12Å | |
| C2G | C3G | sing | 1.53Å | 1.53Å | |
| C2G | O2G | sing | 1.43Å | 1.42Å | |
| C2G | H2G | sing | 1.09Å | 1.12Å | |
| C3G | C4G | sing | 1.53Å | 1.54Å | |
| C3G | O3G | sing | 1.43Å | 1.41Å | |
| C3G | H3G | sing | 1.09Å | 1.11Å | |
| C4G | C5G | sing | 1.53Å | 1.57Å | |
| C4G | O4G | sing | 1.43Å | 1.43Å | |
| C4G | H4G | sing | 1.09Å | 1.11Å | |
| C5G | C6G | sing | 1.53Å | 1.55Å | |
| C5G | O5G | sing | 1.43Å | 1.45Å | |
| C5G | H5G | sing | 1.09Å | 1.12Å | |
| C6G | O6G | sing | 1.43Å | 1.42Å | |
| C6G | H6G1 | sing | 1.09Å | 1.11Å | |
| C6G | H6G2 | sing | 1.09Å | 1.11Å | |
| O1G | C4T | sing | 1.43Å | 1.42Å | |
| O2G | H2 | sing | 0.97Å | 0.95Å | |
| O3G | H1 | sing | 0.97Å | 0.95Å | |
| O6G | H6G | sing | 0.97Å | 0.95Å | |
| C1T | C2T | sing | 1.53Å | 1.55Å | |
| C1T | O1T | sing | 1.43Å | 1.42Å | |
| C1T | O5T | sing | 1.43Å | 1.44Å | |
| C1T | H1T | sing | 1.09Å | 1.11Å | |
| C2T | C3T | sing | 1.53Å | 1.54Å | |
| C2T | O2T | sing | 1.43Å | 1.42Å | |
| C2T | H2T | sing | 1.09Å | 1.11Å | |
| C3T | C4T | sing | 1.53Å | 1.54Å | |
| C3T | O3T | sing | 1.43Å | 1.42Å | |
| C3T | H3T | sing | 1.09Å | 1.12Å | |
| C4T | C5T | sing | 1.53Å | 1.56Å | |
| C4T | H4T | sing | 1.09Å | 1.11Å | |
| C5T | C6T | sing | 1.53Å | 1.54Å | |
| C5T | O5T | sing | 1.43Å | 1.44Å | |
| C5T | H5T | sing | 1.09Å | 1.12Å | |
| C6T | O6T | sing | 1.43Å | 1.41Å | |
| C6T | H6T1 | sing | 1.09Å | 1.12Å | |
| C6T | H6T2 | sing | 1.09Å | 1.12Å | |
| O1T | H5 | sing | 0.97Å | 0.95Å | |
| O2T | H4 | sing | 0.97Å | 0.95Å | |
| O3T | H3 | sing | 0.97Å | 0.95Å | |
| O6T | H6T | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2A | C1A | O5A | 109.9° | 109.7° |
| C2A | C1A | O4B | 111.5° | 109.4° |
| C2A | C1A | H1A | 107.9° | 109.4° |
| C1A | C2A | C3A | 109.9° | 109.1° |
| C1A | C2A | O2A | 109.9° | 109.6° |
| C1A | C2A | H2A | 109.3° | 109.6° |
| O5A | C1A | O4B | 109.6° | 109.4° |
| O5A | C1A | H1A | 109.8° | 109.4° |
| C1A | O5A | C5A | 115.1° | 107.6° |
| O4B | C1A | H1A | 108.1° | 109.5° |
| C1A | O4B | C4B | 112.8° | 106.8° |
| C3A | C2A | O2A | 110.9° | 109.6° |
| C3A | C2A | H2A | 108.4° | 109.5° |
| C2A | C3A | C4A | 108.0° | 108.6° |
| C2A | C3A | O3A | 109.6° | 109.8° |
| C2A | C3A | H3A | 110.3° | 109.6° |
| O2A | C2A | H2A | 108.4° | 109.6° |
| C2A | O2A | H11 | 109.9° | 106.8° |
| C4A | C3A | O3A | 109.3° | 109.6° |
| C4A | C3A | H3A | 110.6° | 109.6° |
| C3A | C4A | C5A | 109.6° | 109.0° |
| C3A | C4A | O4A | 110.1° | 109.6° |
| C3A | C4A | H4A | 109.3° | 109.5° |
| O3A | C3A | H3A | 109.0° | 109.6° |
| C3A | O3A | H10 | 109.6° | 106.8° |
| C5A | C4A | O4A | 110.3° | 109.6° |
| C5A | C4A | H4A | 109.0° | 109.6° |
| C4A | C5A | C6A | 109.9° | 109.4° |
| C4A | C5A | O5A | 109.7° | 109.8° |
| C4A | C5A | H5A | 108.6° | 109.4° |
| O4A | C4A | H4A | 108.5° | 109.5° |
| C4A | O4A | H9 | 110.1° | 106.9° |
| C6A | C5A | O5A | 108.3° | 109.5° |
| C6A | C5A | H5A | 110.0° | 109.4° |
| C5A | C6A | O6A | 110.2° | 109.5° |
| C5A | C6A | H6A1 | 112.0° | 109.5° |
| C5A | C6A | H6A2 | 112.0° | 109.5° |
| O5A | C5A | H5A | 110.2° | 109.4° |
| O6A | C6A | H6A1 | 111.9° | 109.5° |
| O6A | C6A | H6A2 | 111.9° | 109.4° |
| C6A | O6A | H6A | 110.2° | 106.8° |
| H6A1 | C6A | H6A2 | 98.5° | 109.5° |
| C2B | C1B | O5B | 113.6° | 109.8° |
| C2B | C1B | O4H | 109.9° | 109.4° |
| C2B | C1B | H1B | 106.7° | 109.4° |
| C1B | C2B | C3B | 111.5° | 109.1° |
| C1B | C2B | O2B | 109.3° | 109.6° |
| C1B | C2B | H2B | 108.0° | 109.6° |
| O5B | C1B | O4H | 110.3° | 109.4° |
| O5B | C1B | H1B | 106.1° | 109.4° |
| C1B | O5B | C5B | 117.4° | 107.6° |
| O4H | C1B | H1B | 110.1° | 109.4° |
| C1B | O4H | C4H | 113.9° | 106.8° |
| C3B | C2B | O2B | 108.9° | 109.5° |
| C3B | C2B | H2B | 108.5° | 109.5° |
| C2B | C3B | C4B | 110.8° | 108.6° |
| C2B | C3B | O3B | 109.0° | 109.8° |
| C2B | C3B | H3B | 109.2° | 109.7° |
| O2B | C2B | H2B | 110.7° | 109.5° |
| C2B | O2B | H13 | 109.2° | 106.8° |
| C4B | C3B | O3B | 110.2° | 109.6° |
| C4B | C3B | H3B | 107.9° | 109.5° |
| C3B | C4B | C5B | 107.9° | 109.0° |
| C3B | C4B | O4B | 109.8° | 109.6° |
| C3B | C4B | H4B | 111.0° | 109.5° |
| O3B | C3B | H3B | 109.8° | 109.6° |
| C3B | O3B | H12 | 109.0° | 106.7° |
| C5B | C4B | O4B | 111.4° | 109.5° |
| C5B | C4B | H4B | 109.4° | 109.6° |
| C4B | C5B | C6B | 112.1° | 109.4° |
| C4B | C5B | O5B | 108.8° | 109.8° |
| C4B | C5B | H5B | 107.8° | 109.4° |
| O4B | C4B | H4B | 107.4° | 109.6° |
| C6B | C5B | O5B | 108.4° | 109.4° |
| C6B | C5B | H5B | 108.2° | 109.4° |
| C5B | C6B | O6B | 110.8° | 109.5° |
| C5B | C6B | H6B1 | 111.7° | 109.5° |
| C5B | C6B | H6B2 | 111.7° | 109.4° |
| O5B | C5B | H5B | 111.5° | 109.4° |
| O6B | C6B | H6B1 | 111.7° | 109.5° |
| O6B | C6B | H6B2 | 111.7° | 109.4° |
| C6B | O6B | H6B | 110.8° | 106.8° |
| H6B1 | C6B | H6B2 | 98.7° | 109.5° |
| C2C | C1C | O5C | 112.3° | 109.8° |
| C2C | C1C | O4G | 111.2° | 109.4° |
| C2C | C1C | H1C | 106.2° | 109.4° |
| C1C | C2C | C3C | 112.4° | 109.0° |
| C1C | C2C | O2C | 109.6° | 109.6° |
| C1C | C2C | H2C | 107.1° | 109.5° |
| O5C | C1C | O4G | 109.1° | 109.4° |
| O5C | C1C | H1C | 108.5° | 109.5° |
| C1C | O5C | C5C | 116.4° | 107.6° |
| O4G | C1C | H1C | 109.5° | 109.4° |
| C1C | O4G | C4G | 113.8° | 106.8° |
| C3C | C2C | O2C | 108.7° | 109.6° |
| C3C | C2C | H2C | 108.0° | 109.6° |
| C2C | C3C | C4C | 111.3° | 108.6° |
| C2C | C3C | O3C | 108.8° | 109.6° |
| C2C | C3C | H3C | 108.7° | 109.6° |
| O2C | C2C | H2C | 110.9° | 109.5° |
| C2C | O2C | H6 | 109.6° | 106.8° |
| C4C | C3C | O3C | 109.6° | 109.7° |
| C4C | C3C | H3C | 107.9° | 109.6° |
| C3C | C4C | C5C | 108.8° | 109.0° |
| C3C | C4C | N4C | 110.0° | 109.6° |
| C3C | C4C | H4C | 110.4° | 109.5° |
| O3C | C3C | H3C | 110.5° | 109.6° |
| C3C | O3C | H7 | 108.8° | 106.8° |
| C5C | C4C | N4C | 112.0° | 109.5° |
| C5C | C4C | H4C | 108.4° | 109.6° |
| C4C | C5C | C6C | 111.0° | 109.4° |
| C4C | C5C | O5C | 109.9° | 109.7° |
| C4C | C5C | H5C | 107.9° | 109.4° |
| N4C | C4C | H4C | 107.2° | 109.5° |
| C4C | N4C | C1H | 116.7° | 106.7° |
| C4C | N4C | H8 | 109.6° | 106.7° |
| C6C | C5C | O5C | 108.6° | 109.4° |
| C6C | C5C | H5C | 109.2° | 109.4° |
| C5C | C6C | H6C1 | 111.7° | 109.5° |
| C5C | C6C | H6C2 | 111.0° | 109.5° |
| C5C | C6C | H6C3 | 111.6° | 109.5° |
| O5C | C5C | H5C | 110.3° | 109.5° |
| H6C1 | C6C | H6C2 | 111.6° | 109.4° |
| H6C1 | C6C | H6C3 | 98.7° | 109.5° |
| H6C2 | C6C | H6C3 | 111.7° | 109.5° |
| C1H | N4C | H8 | 109.6° | 106.7° |
| N4C | C1H | C2H | 110.3° | 109.3° |
| N4C | C1H | C6H | 108.8° | 109.3° |
| N4C | C1H | H1H | 110.3° | 109.4° |
| C2H | C1H | C6H | 112.1° | 110.0° |
| C2H | C1H | H1H | 106.9° | 109.4° |
| C1H | C2H | C3H | 109.6° | 108.6° |
| C1H | C2H | O2H | 109.7° | 109.7° |
| C1H | C2H | H2H | 109.9° | 109.6° |
| C6H | C1H | H1H | 108.5° | 109.4° |
| C1H | C6H | C5H | 121.4° | 124.1° |
| C1H | C6H | H6H | 125.7° | 117.9° |
| C3H | C2H | O2H | 111.3° | 109.6° |
| C3H | C2H | H2H | 108.2° | 109.6° |
| C2H | C3H | C4H | 110.3° | 108.4° |
| C2H | C3H | O3H | 109.9° | 109.9° |
| C2H | C3H | H3H | 108.7° | 109.7° |
| O2H | C2H | H2H | 108.1° | 109.6° |
| C2H | O2H | H15 | 109.7° | 106.9° |
| C4H | C3H | O3H | 109.7° | 109.7° |
| C4H | C3H | H3H | 109.0° | 109.6° |
| C3H | C4H | C5H | 114.5° | 110.2° |
| C3H | C4H | O4H | 109.5° | 109.3° |
| C3H | C4H | H4H | 105.3° | 109.4° |
| O3H | C3H | H3H | 109.3° | 109.6° |
| C3H | O3H | H14 | 109.9° | 106.8° |
| C5H | C4H | O4H | 107.1° | 109.3° |
| C5H | C4H | H4H | 107.7° | 109.3° |
| C4H | C5H | C6H | 122.5° | 124.0° |
| C4H | C5H | C7H | 120.5° | 118.0° |
| O4H | C4H | H4H | 112.9° | 109.4° |
| C6H | C5H | C7H | 117.0° | 118.0° |
| C5H | C6H | H6H | 113.0° | 117.9° |
| C5H | C7H | O7H | 123.2° | 109.5° |
| C5H | C7H | H7H1 | 107.3° | 109.5° |
| C5H | C7H | H7H2 | 107.3° | 109.5° |
| O7H | C7H | H7H1 | 107.3° | 109.5° |
| O7H | C7H | H7H2 | 107.3° | 109.5° |
| C7H | O7H | H7H | 123.2° | 106.8° |
| H7H1 | C7H | H7H2 | 102.4° | 109.4° |
| C2G | C1G | O1G | 111.4° | 109.4° |
| C2G | C1G | O5G | 110.4° | 109.8° |
| C2G | C1G | H1G | 107.4° | 109.4° |
| C1G | C2G | C3G | 110.1° | 109.0° |
| C1G | C2G | O2G | 110.1° | 109.6° |
| C1G | C2G | H2G | 108.5° | 109.5° |
| O1G | C1G | O5G | 109.3° | 109.3° |
| O1G | C1G | H1G | 108.6° | 109.4° |
| C1G | O1G | C4T | 112.7° | 106.8° |
| O5G | C1G | H1G | 109.6° | 109.5° |
| C1G | O5G | C5G | 116.6° | 107.7° |
| C3G | C2G | O2G | 109.2° | 109.6° |
| C3G | C2G | H2G | 109.4° | 109.6° |
| C2G | C3G | C4G | 110.2° | 108.7° |
| C2G | C3G | O3G | 109.2° | 109.7° |
| C2G | C3G | H3G | 109.5° | 109.6° |
| O2G | C2G | H2G | 109.4° | 109.6° |
| C2G | O2G | H2 | 110.1° | 106.8° |
| C4G | C3G | O3G | 110.3° | 109.6° |
| C4G | C3G | H3G | 108.3° | 109.6° |
| C3G | C4G | C5G | 107.5° | 109.1° |
| C3G | C4G | O4G | 108.5° | 109.6° |
| C3G | C4G | H4G | 111.8° | 109.6° |
| O3G | C3G | H3G | 109.3° | 109.6° |
| C3G | O3G | H1 | 109.2° | 106.8° |
| C5G | C4G | O4G | 110.7° | 109.5° |
| C5G | C4G | H4G | 109.7° | 109.5° |
| C4G | C5G | C6G | 112.4° | 109.5° |
| C4G | C5G | O5G | 109.9° | 109.8° |
| C4G | C5G | H5G | 106.9° | 109.3° |
| O4G | C4G | H4G | 108.7° | 109.6° |
| C6G | C5G | O5G | 108.5° | 109.4° |
| C6G | C5G | H5G | 108.3° | 109.4° |
| C5G | C6G | O6G | 111.1° | 109.5° |
| C5G | C6G | H6G1 | 111.6° | 109.4° |
| C5G | C6G | H6G2 | 111.6° | 109.5° |
| O5G | C5G | H5G | 110.8° | 109.4° |
| O6G | C6G | H6G1 | 111.6° | 109.5° |
| O6G | C6G | H6G2 | 111.6° | 109.5° |
| C6G | O6G | H6G | 111.1° | 106.8° |
| H6G1 | C6G | H6G2 | 98.8° | 109.5° |
| O1G | C4T | C3T | 108.7° | 109.6° |
| O1G | C4T | C5T | 110.6° | 109.5° |
| O1G | C4T | H4T | 108.9° | 109.6° |
| C2T | C1T | O1T | 109.9° | 109.4° |
| C2T | C1T | O5T | 111.5° | 109.8° |
| C2T | C1T | H1T | 107.8° | 109.4° |
| C1T | C2T | C3T | 110.0° | 109.0° |
| C1T | C2T | O2T | 109.6° | 109.6° |
| C1T | C2T | H2T | 109.0° | 109.5° |
| O1T | C1T | O5T | 109.6° | 109.4° |
| O1T | C1T | H1T | 109.8° | 109.4° |
| C1T | O1T | H5 | 109.9° | 106.8° |
| O5T | C1T | H1T | 108.2° | 109.4° |
| C1T | O5T | C5T | 116.2° | 107.7° |
| C3T | C2T | O2T | 109.5° | 109.6° |
| C3T | C2T | H2T | 109.2° | 109.5° |
| C2T | C3T | C4T | 109.8° | 108.7° |
| C2T | C3T | O3T | 109.7° | 109.7° |
| C2T | C3T | H3T | 109.2° | 109.6° |
| O2T | C2T | H2T | 109.5° | 109.6° |
| C2T | O2T | H4 | 109.7° | 106.8° |
| C4T | C3T | O3T | 109.7° | 109.6° |
| C4T | C3T | H3T | 109.2° | 109.6° |
| C3T | C4T | C5T | 108.5° | 109.1° |
| C3T | C4T | H4T | 111.0° | 109.6° |
| O3T | C3T | H3T | 109.2° | 109.6° |
| C3T | O3T | H3 | 109.7° | 106.8° |
| C5T | C4T | H4T | 109.1° | 109.5° |
| C4T | C5T | C6T | 111.3° | 109.5° |
| C4T | C5T | O5T | 109.4° | 109.8° |
| C4T | C5T | H5T | 108.2° | 109.3° |
| C6T | C5T | O5T | 109.1° | 109.4° |
| C6T | C5T | H5T | 108.5° | 109.4° |
| C5T | C6T | O6T | 110.2° | 109.5° |
| C5T | C6T | H6T1 | 112.0° | 109.5° |
| C5T | C6T | H6T2 | 112.0° | 109.5° |
| O5T | C5T | H5T | 110.4° | 109.4° |
| O6T | C6T | H6T1 | 112.0° | 109.4° |
| O6T | C6T | H6T2 | 111.9° | 109.5° |
| C6T | O6T | H6T | 110.2° | 106.8° |
| H6T1 | C6T | H6T2 | 98.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2A | C1A | O5A | O4B | 122.9° | 120.1° |
| C2A | C1A | O5A | H1A | 118.5° | 120.0° |
| C2A | C1A | O4B | H1A | 118.4° | 119.8° |
| C1A | C2A | C3A | O2A | 121.7° | 119.9° |
| C1A | C2A | C3A | H2A | 119.4° | 119.9° |
| C1A | C2A | O2A | H2A | 119.4° | 120.2° |
| C1A | C2A | C3A | C4A | 58.3° | 53.7° |
| C1A | C2A | C3A | O3A | 177.4° | 173.6° |
| C1A | C2A | C3A | H3A | 62.6° | 66.0° |
| C2A | C1A | O5A | C5A | 57.6° | 67.6° |
| C1A | C2A | O2A | H11 | 180.0° | 60.4° |
| C2A | C1A | O4B | C4B | 119.2° | 164.4° |
| O5A | C1A | O4B | H1A | 119.6° | 119.9° |
| O5A | C1A | C2A | C3A | 56.7° | 61.3° |
| O5A | C1A | C2A | O2A | 179.0° | 178.8° |
| O5A | C1A | C2A | H2A | 62.2° | 58.5° |
| C1A | O5A | C5A | C4A | 57.8° | 67.6° |
| C1A | O5A | C5A | C6A | 177.8° | 172.3° |
| C1A | O5A | C5A | H5A | 61.7° | 52.4° |
| O5A | C1A | O4B | C4B | 118.8° | 75.3° |
| O4B | C1A | C2A | C3A | 65.1° | 58.8° |
| O4B | C1A | C2A | O2A | 57.2° | 61.1° |
| O4B | C1A | C2A | H2A | 176.1° | 178.6° |
| O4B | C1A | O5A | C5A | 65.3° | 52.5° |
| C1A | O4B | C4B | C3B | 124.6° | 84.7° |
| C1A | O4B | C4B | C5B | 115.9° | 155.7° |
| C1A | O4B | C4B | H4B | 3.8° | 35.5° |
| H1A | C1A | C2A | C3A | 176.4° | 178.7° |
| H1A | C1A | C2A | O2A | 61.4° | 58.8° |
| H1A | C1A | C2A | H2A | 57.5° | 61.5° |
| H1A | C1A | O5A | C5A | 176.0° | 172.4° |
| H1A | C1A | O4B | C4B | 0.8° | 44.6° |
| C3A | C2A | O2A | H2A | 118.8° | 120.1° |
| C2A | C3A | C4A | O3A | 119.2° | 119.9° |
| C2A | C3A | C4A | H3A | 120.8° | 119.8° |
| C2A | C3A | O3A | H3A | 120.8° | 120.4° |
| C2A | C3A | C4A | C5A | 58.5° | 53.7° |
| C2A | C3A | C4A | O4A | 180.0° | 173.6° |
| C2A | C3A | C4A | H4A | 60.9° | 66.2° |
| C3A | C2A | O2A | H11 | 58.3° | 180.0° |
| C2A | C3A | O3A | H10 | 180.0° | 60.8° |
| O2A | C2A | C3A | C4A | 180.0° | 173.7° |
| O2A | C2A | C3A | O3A | 60.9° | 66.5° |
| O2A | C2A | C3A | H3A | 59.1° | 53.9° |
| H2A | C2A | C3A | C4A | 61.1° | 66.1° |
| H2A | C2A | C3A | O3A | 57.9° | 53.7° |
| H2A | C2A | C3A | H3A | 177.9° | 174.1° |
| H2A | C2A | O2A | H11 | 60.5° | 59.9° |
| C4A | C3A | O3A | H3A | 121.0° | 120.3° |
| C3A | C4A | C5A | O4A | 121.4° | 119.9° |
| C3A | C4A | C5A | H4A | 119.6° | 119.9° |
| C3A | C4A | O4A | H4A | 119.6° | 120.2° |
| C3A | C4A | C5A | C6A | 176.3° | 178.6° |
| C3A | C4A | C5A | O5A | 57.3° | 61.2° |
| C3A | C4A | C5A | H5A | 63.3° | 58.8° |
| C4A | C3A | O3A | H10 | 61.8° | 180.0° |
| C3A | C4A | O4A | H9 | 180.0° | 60.4° |
| O3A | C3A | C4A | C5A | 177.7° | 173.6° |
| O3A | C3A | C4A | O4A | 60.8° | 66.4° |
| O3A | C3A | C4A | H4A | 58.3° | 53.7° |
| H3A | C3A | C4A | C5A | 62.3° | 66.0° |
| H3A | C3A | C4A | O4A | 59.2° | 53.9° |
| H3A | C3A | C4A | H4A | 178.3° | 174.1° |
| H3A | C3A | O3A | H10 | 59.2° | 59.6° |
| C5A | C4A | O4A | H4A | 119.4° | 120.2° |
| C4A | C5A | C6A | O5A | 119.9° | 120.3° |
| C4A | C5A | C6A | H5A | 119.6° | 119.8° |
| C4A | C5A | O5A | H5A | 119.6° | 120.0° |
| C4A | C5A | C6A | O6A | 109.9° | 174.7° |
| C4A | C5A | C6A | H6A1 | 124.8° | 54.7° |
| C4A | C5A | C6A | H6A2 | 15.3° | 65.3° |
| C5A | C4A | O4A | H9 | 58.9° | 180.0° |
| O4A | C4A | C5A | C6A | 62.3° | 58.7° |
| O4A | C4A | C5A | O5A | 178.7° | 178.8° |
| O4A | C4A | C5A | H5A | 58.1° | 61.1° |
| H4A | C4A | C5A | C6A | 56.7° | 61.5° |
| H4A | C4A | C5A | O5A | 62.3° | 58.6° |
| H4A | C4A | C5A | H5A | 177.2° | 178.7° |
| H4A | C4A | O4A | H9 | 60.4° | 59.8° |
| C6A | C5A | O5A | H5A | 120.4° | 119.9° |
| C5A | C6A | O6A | H6A1 | 125.3° | 120.0° |
| C5A | C6A | O6A | H6A2 | 125.3° | 120.0° |
| C5A | C6A | H6A1 | H6A2 | 117.9° | 120.0° |
| C5A | C6A | O6A | H6A | 180.0° | 180.0° |
| O5A | C5A | C6A | O6A | 130.2° | 65.0° |
| O5A | C5A | C6A | H6A1 | 4.9° | 175.0° |
| O5A | C5A | C6A | H6A2 | 104.6° | 55.0° |
| H5A | C5A | C6A | O6A | 9.7° | 54.9° |
| H5A | C5A | C6A | H6A1 | 115.6° | 65.1° |
| H5A | C5A | C6A | H6A2 | 134.9° | 174.9° |
| O6A | C6A | H6A1 | H6A2 | 117.8° | 120.0° |
| H6A1 | C6A | O6A | H6A | 54.7° | 60.0° |
| H6A2 | C6A | O6A | H6A | 54.7° | 60.0° |
| C2B | C1B | O5B | O4H | 123.8° | 120.1° |
| C2B | C1B | O5B | H1B | 116.9° | 120.1° |
| C2B | C1B | O4H | H1B | 117.2° | 119.9° |
| C1B | C2B | C3B | O2B | 120.6° | 119.9° |
| C1B | C2B | C3B | H2B | 118.8° | 119.9° |
| C1B | C2B | O2B | H2B | 118.9° | 120.2° |
| C1B | C2B | C3B | C4B | 50.2° | 53.8° |
| C1B | C2B | C3B | O3B | 171.6° | 173.6° |
| C1B | C2B | C3B | H3B | 68.5° | 65.9° |
| C2B | C1B | O5B | C5B | 48.8° | 67.5° |
| C1B | C2B | O2B | H13 | 180.0° | 60.3° |
| C2B | C1B | O4H | C4H | 151.0° | 145.9° |
| O5B | C1B | O4H | H1B | 116.8° | 119.8° |
| O5B | C1B | C2B | C3B | 42.9° | 61.3° |
| O5B | C1B | C2B | O2B | 163.3° | 178.8° |
| O5B | C1B | C2B | H2B | 76.2° | 58.6° |
| C1B | O5B | C5B | C4B | 57.9° | 67.5° |
| C1B | O5B | C5B | C6B | 180.0° | 172.4° |
| C1B | O5B | C5B | H5B | 60.9° | 52.5° |
| O5B | C1B | O4H | C4H | 83.1° | 93.8° |
| O4H | C1B | C2B | C3B | 81.2° | 58.8° |
| O4H | C1B | C2B | O2B | 39.2° | 61.1° |
| O4H | C1B | C2B | H2B | 159.8° | 178.7° |
| O4H | C1B | O5B | C5B | 75.0° | 52.6° |
| C1B | O4H | C4H | C3H | 88.0° | 108.1° |
| C1B | O4H | C4H | C5H | 147.3° | 131.2° |
| C1B | O4H | C4H | H4H | 28.9° | 11.5° |
| H1B | C1B | C2B | C3B | 159.5° | 178.6° |
| H1B | C1B | C2B | O2B | 80.1° | 58.8° |
| H1B | C1B | C2B | H2B | 40.4° | 61.4° |
| H1B | C1B | O5B | C5B | 165.7° | 172.4° |
| H1B | C1B | O4H | C4H | 33.8° | 26.0° |
| C3B | C2B | O2B | H2B | 119.1° | 120.2° |
| C2B | C3B | C4B | O3B | 120.7° | 119.9° |
| C2B | C3B | C4B | H3B | 119.4° | 119.7° |
| C2B | C3B | O3B | H3B | 119.5° | 120.5° |
| C2B | C3B | C4B | C5B | 59.4° | 53.7° |
| C2B | C3B | C4B | O4B | 179.1° | 173.6° |
| C2B | C3B | C4B | H4B | 60.4° | 66.2° |
| C3B | C2B | O2B | H13 | 58.0° | 180.0° |
| C2B | C3B | O3B | H12 | 180.0° | 60.8° |
| O2B | C2B | C3B | C4B | 170.8° | 173.7° |
| O2B | C2B | C3B | O3B | 67.8° | 66.5° |
| O2B | C2B | C3B | H3B | 52.1° | 54.0° |
| H2B | C2B | C3B | C4B | 68.6° | 66.2° |
| H2B | C2B | C3B | O3B | 52.8° | 53.6° |
| H2B | C2B | C3B | H3B | 172.7° | 174.2° |
| H2B | C2B | O2B | H13 | 61.1° | 59.9° |
| C4B | C3B | O3B | H3B | 118.7° | 120.3° |
| C3B | C4B | C5B | O4B | 120.6° | 119.9° |
| C3B | C4B | C5B | H4B | 120.8° | 119.9° |
| C3B | C4B | O4B | H4B | 120.8° | 120.2° |
| C3B | C4B | C5B | C6B | 178.7° | 178.7° |
| C3B | C4B | C5B | O5B | 61.4° | 61.2° |
| C3B | C4B | C5B | H5B | 59.7° | 58.8° |
| C4B | C3B | O3B | H12 | 58.2° | 180.0° |
| O3B | C3B | C4B | C5B | 179.9° | 173.6° |
| O3B | C3B | C4B | O4B | 58.4° | 66.5° |
| O3B | C3B | C4B | H4B | 60.3° | 53.8° |
| H3B | C3B | C4B | C5B | 60.1° | 66.0° |
| H3B | C3B | C4B | O4B | 61.5° | 53.9° |
| H3B | C3B | C4B | H4B | 179.9° | 174.1° |
| H3B | C3B | O3B | H12 | 60.5° | 59.8° |
| C5B | C4B | O4B | H4B | 119.8° | 120.2° |
| C4B | C5B | C6B | O5B | 120.2° | 120.3° |
| C4B | C5B | C6B | H5B | 118.7° | 119.8° |
| C4B | C5B | O5B | H5B | 118.8° | 120.1° |
| C4B | C5B | C6B | O6B | 56.3° | 176.6° |
| C4B | C5B | C6B | H6B1 | 69.0° | 56.5° |
| C4B | C5B | C6B | H6B2 | 178.4° | 63.5° |
| O4B | C4B | C5B | C6B | 58.1° | 58.7° |
| O4B | C4B | C5B | O5B | 178.1° | 178.8° |
| O4B | C4B | C5B | H5B | 60.9° | 61.1° |
| H4B | C4B | C5B | C6B | 60.5° | 61.5° |
| H4B | C4B | C5B | O5B | 59.4° | 58.6° |
| H4B | C4B | C5B | H5B | 179.5° | 178.7° |
| C6B | C5B | O5B | H5B | 119.0° | 119.9° |
| C5B | C6B | O6B | H6B1 | 125.3° | 120.0° |
| C5B | C6B | O6B | H6B2 | 125.3° | 119.9° |
| C5B | C6B | H6B1 | H6B2 | 117.6° | 120.0° |
| C5B | C6B | O6B | H6B | 180.0° | 175.1° |
| O5B | C5B | C6B | O6B | 63.9° | 63.1° |
| O5B | C5B | C6B | H6B1 | 170.9° | 176.8° |
| O5B | C5B | C6B | H6B2 | 61.4° | 56.8° |
| H5B | C5B | C6B | O6B | 175.0° | 56.7° |
| H5B | C5B | C6B | H6B1 | 49.8° | 63.4° |
| H5B | C5B | C6B | H6B2 | 59.7° | 176.6° |
| O6B | C6B | H6B1 | H6B2 | 117.6° | 120.0° |
| H6B1 | C6B | O6B | H6B | 54.7° | 55.0° |
| H6B2 | C6B | O6B | H6B | 54.7° | 65.0° |
| C2C | C1C | O5C | O4G | 123.7° | 120.0° |
| C2C | C1C | O5C | H1C | 117.0° | 120.1° |
| C2C | C1C | O4G | H1C | 117.1° | 119.8° |
| C1C | C2C | C3C | O2C | 121.6° | 119.9° |
| C1C | C2C | C3C | H2C | 118.0° | 119.9° |
| C1C | C2C | O2C | H2C | 118.1° | 120.2° |
| C1C | C2C | C3C | C4C | 49.2° | 53.7° |
| C1C | C2C | C3C | O3C | 170.1° | 173.7° |
| C1C | C2C | C3C | H3C | 69.6° | 66.0° |
| C2C | C1C | O5C | C5C | 51.4° | 67.6° |
| C1C | C2C | O2C | H6 | 180.0° | 60.0° |
| C2C | C1C | O4G | C4G | 116.4° | 171.0° |
| O5C | C1C | O4G | H1C | 118.6° | 119.9° |
| O5C | C1C | C2C | C3C | 45.3° | 61.2° |
| O5C | C1C | C2C | O2C | 166.4° | 178.8° |
| O5C | C1C | C2C | H2C | 73.2° | 58.7° |
| C1C | O5C | C5C | C4C | 58.8° | 67.7° |
| C1C | O5C | C5C | C6C | 179.6° | 172.3° |
| C1C | O5C | C5C | H5C | 60.0° | 52.5° |
| O5C | C1C | O4G | C4G | 119.2° | 68.7° |
| O4G | C1C | C2C | C3C | 77.2° | 58.8° |
| O4G | C1C | C2C | O2C | 43.9° | 61.1° |
| O4G | C1C | C2C | H2C | 164.3° | 178.7° |
| O4G | C1C | O5C | C5C | 72.3° | 52.4° |
| C1C | O4G | C4G | C3G | 133.7° | 80.8° |
| C1C | O4G | C4G | C5G | 108.5° | 159.6° |
| C1C | O4G | C4G | H4G | 12.0° | 39.5° |
| H1C | C1C | C2C | C3C | 163.7° | 178.6° |
| H1C | C1C | C2C | O2C | 75.2° | 58.7° |
| H1C | C1C | C2C | H2C | 45.2° | 61.5° |
| H1C | C1C | O5C | C5C | 168.5° | 172.3° |
| H1C | C1C | O4G | C4G | 0.7° | 51.2° |
| C3C | C2C | O2C | H2C | 118.7° | 120.2° |
| C2C | C3C | C4C | O3C | 120.4° | 119.8° |
| C2C | C3C | C4C | H3C | 119.2° | 119.8° |
| C2C | C3C | O3C | H3C | 119.3° | 120.3° |
| C2C | C3C | C4C | C5C | 55.6° | 53.8° |
| C2C | C3C | C4C | N4C | 178.7° | 173.7° |
| C2C | C3C | C4C | H4C | 63.2° | 66.1° |
| C3C | C2C | O2C | H6 | 56.7° | 179.6° |
| C2C | C3C | O3C | H7 | 180.0° | 60.0° |
| O2C | C2C | C3C | C4C | 170.8° | 173.6° |
| O2C | C2C | C3C | O3C | 68.4° | 66.4° |
| O2C | C2C | C3C | H3C | 52.0° | 53.9° |
| H2C | C2C | C3C | C4C | 68.8° | 66.1° |
| H2C | C2C | C3C | O3C | 52.1° | 53.8° |
| H2C | C2C | C3C | H3C | 172.5° | 174.1° |
| H2C | C2C | O2C | H6 | 61.9° | 60.2° |
| C4C | C3C | O3C | H3C | 118.8° | 120.4° |
| C3C | C4C | C5C | N4C | 121.9° | 119.9° |
| C3C | C4C | C5C | H4C | 120.1° | 119.9° |
| C3C | C4C | N4C | H4C | 120.1° | 120.2° |
| C3C | C4C | C5C | C6C | 179.0° | 178.6° |
| C3C | C4C | C5C | O5C | 58.9° | 61.4° |
| C3C | C4C | C5C | H5C | 61.4° | 58.8° |
| C4C | C3C | O3C | H7 | 58.1° | 179.2° |
| C3C | C4C | N4C | C1H | 96.0° | 91.9° |
| C3C | C4C | N4C | H8 | 29.3° | 154.3° |
| O3C | C3C | C4C | C5C | 176.1° | 173.6° |
| O3C | C3C | C4C | N4C | 60.9° | 66.5° |
| O3C | C3C | C4C | H4C | 57.2° | 53.7° |
| H3C | C3C | C4C | C5C | 63.6° | 66.0° |
| H3C | C3C | C4C | N4C | 59.4° | 53.9° |
| H3C | C3C | C4C | H4C | 177.6° | 174.1° |
| H3C | C3C | O3C | H7 | 60.7° | 60.3° |
| C5C | C4C | N4C | H4C | 118.7° | 120.2° |
| C4C | C5C | C6C | O5C | 120.9° | 120.2° |
| C4C | C5C | C6C | H5C | 118.8° | 119.9° |
| C4C | C5C | O5C | H5C | 118.8° | 120.1° |
| C4C | C5C | C6C | H6C1 | 54.7° | 170.6° |
| C4C | C5C | C6C | H6C2 | 180.0° | 69.5° |
| C4C | C5C | C6C | H6C3 | 54.8° | 50.6° |
| C5C | C4C | N4C | C1H | 142.8° | 148.6° |
| C5C | C4C | N4C | H8 | 91.9° | 34.8° |
| N4C | C4C | C5C | C6C | 59.1° | 58.7° |
| N4C | C4C | C5C | O5C | 179.3° | 178.7° |
| N4C | C4C | C5C | H5C | 60.5° | 61.1° |
| C4C | N4C | C1H | H8 | 125.3° | 113.8° |
| C4C | N4C | C1H | C2H | 139.4° | 154.4° |
| C4C | N4C | C1H | C6H | 16.1° | 85.1° |
| C4C | N4C | C1H | H1H | 102.8° | 34.7° |
| H4C | C4C | C5C | C6C | 58.9° | 61.5° |
| H4C | C4C | C5C | O5C | 61.2° | 58.5° |
| H4C | C4C | C5C | H5C | 178.5° | 178.7° |
| H4C | C4C | N4C | C1H | 24.1° | 28.3° |
| H4C | C4C | N4C | H8 | 149.3° | 85.5° |
| C6C | C5C | O5C | H5C | 119.6° | 119.9° |
| C5C | C6C | H6C1 | H6C2 | 124.9° | 120.0° |
| C5C | C6C | H6C1 | H6C3 | 117.6° | 120.0° |
| C5C | C6C | H6C2 | H6C3 | 125.2° | 120.0° |
| O5C | C5C | C6C | H6C1 | 66.2° | 50.4° |
| O5C | C5C | C6C | H6C2 | 59.1° | 170.3° |
| O5C | C5C | C6C | H6C3 | 175.7° | 69.7° |
| H5C | C5C | C6C | H6C1 | 173.5° | 69.5° |
| H5C | C5C | C6C | H6C2 | 61.2° | 50.4° |
| H5C | C5C | C6C | H6C3 | 64.0° | 170.4° |
| H6C1 | C6C | H6C2 | H6C3 | 109.5° | 120.0° |
| N4C | C1H | C2H | C6H | 121.4° | 120.1° |
| N4C | C1H | C2H | H1H | 119.9° | 119.8° |
| N4C | C1H | C6H | H1H | 120.0° | 119.7° |
| N4C | C1H | C2H | C3H | 64.5° | 70.7° |
| N4C | C1H | C2H | O2H | 58.0° | 49.2° |
| N4C | C1H | C2H | H2H | 176.7° | 169.6° |
| N4C | C1H | C6H | C5H | 94.8° | 103.1° |
| N4C | C1H | C6H | H6H | 85.2° | 77.0° |
| H8 | N4C | C1H | C2H | 95.3° | 91.7° |
| H8 | N4C | C1H | C6H | 141.4° | 28.7° |
| H8 | N4C | C1H | H1H | 22.5° | 148.5° |
| C2H | C1H | C6H | H1H | 117.8° | 120.2° |
| C1H | C2H | C3H | O2H | 121.5° | 119.9° |
| C1H | C2H | C3H | H2H | 119.9° | 119.8° |
| C1H | C2H | O2H | H2H | 119.8° | 120.4° |
| C1H | C2H | C3H | C4H | 59.8° | 67.5° |
| C1H | C2H | C3H | O3H | 179.2° | 172.7° |
| C1H | C2H | C3H | H3H | 59.6° | 52.2° |
| C2H | C1H | C6H | C5H | 27.4° | 17.0° |
| C2H | C1H | C6H | H6H | 152.6° | 163.0° |
| C1H | C2H | O2H | H15 | 180.0° | 179.1° |
| C6H | C1H | C2H | C3H | 56.9° | 49.4° |
| C6H | C1H | C2H | O2H | 179.4° | 169.3° |
| C6H | C1H | C2H | H2H | 61.9° | 70.3° |
| C1H | C6H | C5H | C4H | 0.5° | 0.4° |
| C1H | C6H | C5H | H6H | 180.0° | 179.9° |
| C1H | C6H | C5H | C7H | 179.2° | 179.5° |
| H1H | C1H | C2H | C3H | 175.6° | 169.6° |
| H1H | C1H | C2H | O2H | 61.9° | 70.6° |
| H1H | C1H | C2H | H2H | 56.8° | 49.8° |
| H1H | C1H | C6H | C5H | 145.2° | 137.1° |
| H1H | C1H | C6H | H6H | 34.8° | 42.8° |
| C3H | C2H | O2H | H2H | 118.7° | 120.4° |
| C2H | C3H | C4H | O3H | 121.1° | 119.9° |
| C2H | C3H | C4H | H3H | 119.3° | 119.7° |
| C2H | C3H | O3H | H3H | 119.2° | 120.6° |
| C2H | C3H | C4H | C5H | 33.3° | 49.4° |
| C2H | C3H | C4H | O4H | 153.6° | 169.6° |
| C2H | C3H | C4H | H4H | 84.8° | 70.8° |
| C3H | C2H | O2H | H15 | 58.6° | 59.9° |
| C2H | C3H | O3H | H14 | 180.0° | 61.0° |
| O2H | C2H | C3H | C4H | 178.7° | 172.6° |
| O2H | C2H | C3H | O3H | 57.7° | 52.8° |
| O2H | C2H | C3H | H3H | 61.9° | 67.7° |
| H2H | C2H | C3H | C4H | 60.1° | 52.3° |
| H2H | C2H | C3H | O3H | 60.9° | 67.5° |
| H2H | C2H | C3H | H3H | 179.5° | 171.9° |
| H2H | C2H | O2H | H15 | 60.2° | 60.5° |
| C4H | C3H | O3H | H3H | 119.4° | 120.4° |
| C3H | C4H | C5H | O4H | 121.6° | 120.1° |
| C3H | C4H | C5H | H4H | 116.7° | 120.2° |
| C3H | C4H | O4H | H4H | 116.9° | 119.7° |
| C3H | C4H | C5H | C6H | 3.9° | 17.1° |
| C3H | C4H | C5H | C7H | 175.8° | 162.8° |
| C4H | C3H | O3H | H14 | 58.6° | 180.0° |
| O3H | C3H | C4H | C5H | 154.5° | 169.3° |
| O3H | C3H | C4H | O4H | 85.3° | 70.5° |
| O3H | C3H | C4H | H4H | 36.4° | 49.2° |
| H3H | C3H | C4H | C5H | 86.0° | 70.3° |
| H3H | C3H | C4H | O4H | 34.3° | 49.9° |
| H3H | C3H | C4H | H4H | 155.9° | 169.5° |
| H3H | C3H | O3H | H14 | 60.8° | 59.6° |
| C5H | C4H | O4H | H4H | 118.4° | 119.7° |
| C4H | C5H | C6H | C7H | 179.7° | 179.9° |
| C4H | C5H | C6H | H6H | 179.5° | 179.5° |
| C4H | C5H | C7H | O7H | 79.2° | 172.7° |
| C4H | C5H | C7H | H7H1 | 46.1° | 67.3° |
| C4H | C5H | C7H | H7H2 | 155.5° | 52.7° |
| O4H | C4H | C5H | C6H | 125.5° | 137.2° |
| O4H | C4H | C5H | C7H | 54.2° | 42.7° |
| H4H | C4H | C5H | C6H | 112.8° | 103.1° |
| H4H | C4H | C5H | C7H | 67.5° | 77.0° |
| C6H | C5H | C7H | O7H | 101.1° | 7.4° |
| C6H | C5H | C7H | H7H1 | 133.6° | 112.6° |
| C6H | C5H | C7H | H7H2 | 24.2° | 127.4° |
| C7H | C5H | C6H | H6H | 0.8° | 0.5° |
| C5H | C7H | O7H | H7H1 | 125.3° | 120.0° |
| C5H | C7H | O7H | H7H2 | 125.2° | 120.0° |
| C5H | C7H | H7H1 | H7H2 | 112.8° | 120.0° |
| C5H | C7H | O7H | H7H | 180.0° | 174.1° |
| O7H | C7H | H7H1 | H7H2 | 112.9° | 120.0° |
| H7H1 | C7H | O7H | H7H | 54.7° | 65.9° |
| H7H2 | C7H | O7H | H7H | 54.8° | 54.1° |
| C2G | C1G | O1G | O5G | 122.3° | 120.2° |
| C2G | C1G | O1G | H1G | 118.1° | 119.9° |
| C2G | C1G | O5G | H1G | 118.2° | 120.1° |
| C1G | C2G | C3G | O2G | 121.0° | 119.9° |
| C1G | C2G | C3G | H2G | 119.2° | 119.8° |
| C1G | C2G | O2G | H2G | 119.2° | 120.2° |
| C1G | C2G | C3G | C4G | 57.8° | 53.7° |
| C1G | C2G | C3G | O3G | 179.2° | 173.6° |
| C1G | C2G | C3G | H3G | 61.2° | 66.1° |
| C2G | C1G | O5G | C5G | 55.1° | 67.5° |
| C2G | C1G | O1G | C4T | 139.3° | 156.4° |
| C1G | C2G | O2G | H2 | 180.0° | 60.4° |
| O1G | C1G | O5G | H1G | 118.9° | 119.9° |
| O1G | C1G | C2G | C3G | 68.4° | 58.8° |
| O1G | C1G | C2G | O2G | 52.1° | 61.1° |
| O1G | C1G | C2G | H2G | 171.8° | 178.6° |
| O1G | C1G | O5G | C5G | 67.8° | 52.5° |
| C1G | O1G | C4T | C3T | 119.0° | 83.2° |
| C1G | O1G | C4T | C5T | 122.0° | 157.2° |
| C1G | O1G | C4T | H4T | 2.0° | 37.1° |
| O5G | C1G | C2G | C3G | 53.3° | 61.2° |
| O5G | C1G | C2G | O2G | 173.8° | 178.9° |
| O5G | C1G | C2G | H2G | 66.5° | 58.6° |
| C1G | O5G | C5G | C4G | 57.4° | 67.5° |
| C1G | O5G | C5G | C6G | 179.2° | 172.4° |
| C1G | O5G | C5G | H5G | 60.5° | 52.5° |
| O5G | C1G | O1G | C4T | 98.4° | 83.4° |
| H1G | C1G | C2G | C3G | 172.8° | 178.6° |
| H1G | C1G | C2G | O2G | 66.7° | 58.7° |
| H1G | C1G | C2G | H2G | 53.0° | 61.5° |
| H1G | C1G | O5G | C5G | 173.3° | 172.3° |
| H1G | C1G | O1G | C4T | 21.2° | 36.5° |
| C3G | C2G | O2G | H2G | 119.8° | 120.2° |
| C2G | C3G | C4G | O3G | 120.7° | 119.9° |
| C2G | C3G | C4G | H3G | 119.7° | 119.7° |
| C2G | C3G | O3G | H3G | 119.7° | 120.4° |
| C2G | C3G | C4G | C5G | 58.8° | 53.7° |
| C2G | C3G | C4G | O4G | 178.6° | 173.6° |
| C2G | C3G | C4G | H4G | 61.5° | 66.2° |
| C3G | C2G | O2G | H2 | 59.0° | 180.0° |
| C2G | C3G | O3G | H1 | 180.0° | 60.7° |
| O2G | C2G | C3G | C4G | 178.9° | 173.6° |
| O2G | C2G | C3G | O3G | 59.8° | 66.5° |
| O2G | C2G | C3G | H3G | 59.8° | 53.9° |
| H2G | C2G | C3G | C4G | 61.4° | 66.1° |
| H2G | C2G | C3G | O3G | 60.0° | 53.8° |
| H2G | C2G | C3G | H3G | 179.6° | 174.1° |
| H2G | C2G | O2G | H2 | 60.8° | 59.8° |
| C4G | C3G | O3G | H3G | 119.0° | 120.4° |
| C3G | C4G | C5G | O4G | 118.3° | 119.9° |
| C3G | C4G | C5G | H4G | 121.7° | 119.9° |
| C3G | C4G | O4G | H4G | 121.8° | 120.2° |
| C3G | C4G | C5G | C6G | 177.9° | 178.8° |
| C3G | C4G | C5G | O5G | 56.9° | 61.1° |
| C3G | C4G | C5G | H5G | 63.4° | 58.9° |
| C4G | C3G | O3G | H1 | 58.8° | 180.0° |
| O3G | C3G | C4G | C5G | 179.5° | 173.6° |
| O3G | C3G | C4G | O4G | 60.8° | 66.5° |
| O3G | C3G | C4G | H4G | 59.1° | 53.7° |
| H3G | C3G | C4G | C5G | 60.9° | 66.0° |
| H3G | C3G | C4G | O4G | 58.8° | 53.8° |
| H3G | C3G | C4G | H4G | 178.7° | 174.1° |
| H3G | C3G | O3G | H1 | 60.2° | 59.6° |
| C5G | C4G | O4G | H4G | 120.5° | 120.2° |
| C4G | C5G | C6G | O5G | 121.8° | 120.4° |
| C4G | C5G | C6G | H5G | 117.8° | 119.8° |
| C4G | C5G | O5G | H5G | 117.9° | 120.0° |
| C4G | C5G | C6G | O6G | 59.7° | 177.6° |
| C4G | C5G | C6G | H6G1 | 65.6° | 57.6° |
| C4G | C5G | C6G | H6G2 | 175.1° | 62.4° |
| O4G | C4G | C5G | C6G | 63.7° | 58.9° |
| O4G | C4G | C5G | O5G | 175.2° | 179.0° |
| O4G | C4G | C5G | H5G | 54.9° | 61.0° |
| H4G | C4G | C5G | C6G | 56.2° | 61.3° |
| H4G | C4G | C5G | O5G | 64.8° | 58.8° |
| H4G | C4G | C5G | H5G | 174.8° | 178.8° |
| C6G | C5G | O5G | H5G | 118.8° | 119.8° |
| C5G | C6G | O6G | H6G1 | 125.2° | 120.0° |
| C5G | C6G | O6G | H6G2 | 125.3° | 120.0° |
| C5G | C6G | H6G1 | H6G2 | 117.5° | 120.0° |
| C5G | C6G | O6G | H6G | 180.0° | 180.0° |
| O5G | C5G | C6G | O6G | 62.2° | 62.1° |
| O5G | C5G | C6G | H6G1 | 172.6° | 177.9° |
| O5G | C5G | C6G | H6G2 | 63.1° | 58.0° |
| H5G | C5G | C6G | O6G | 177.5° | 57.8° |
| H5G | C5G | C6G | H6G1 | 52.2° | 62.2° |
| H5G | C5G | C6G | H6G2 | 57.3° | 177.8° |
| O6G | C6G | H6G1 | H6G2 | 117.5° | 120.0° |
| H6G1 | C6G | O6G | H6G | 54.8° | 60.0° |
| H6G2 | C6G | O6G | H6G | 54.7° | 60.0° |
| O1G | C4T | C3T | C2T | 179.2° | 173.6° |
| O1G | C4T | C3T | C5T | 120.3° | 119.9° |
| O1G | C4T | C3T | H4T | 119.8° | 120.2° |
| O1G | C4T | C3T | O3T | 60.2° | 66.5° |
| O1G | C4T | C3T | H3T | 59.5° | 53.8° |
| O1G | C4T | C5T | H4T | 119.8° | 120.1° |
| O1G | C4T | C5T | C6T | 61.6° | 58.8° |
| O1G | C4T | C5T | O5T | 177.8° | 179.0° |
| O1G | C4T | C5T | H5T | 57.5° | 61.0° |
| C2T | C1T | O1T | O5T | 122.8° | 120.3° |
| C2T | C1T | O1T | H1T | 118.5° | 119.8° |
| C2T | C1T | O5T | H1T | 118.4° | 120.1° |
| C1T | C2T | C3T | O2T | 120.6° | 119.9° |
| C1T | C2T | C3T | H2T | 119.6° | 119.8° |
| C1T | C2T | O2T | H2T | 119.6° | 120.2° |
| C1T | C2T | C3T | C4T | 55.1° | 53.7° |
| C1T | C2T | C3T | O3T | 175.8° | 173.6° |
| C1T | C2T | C3T | H3T | 64.5° | 66.1° |
| C2T | C1T | O5T | C5T | 54.9° | 67.6° |
| C2T | C1T | O1T | H5 | 180.0° | 179.9° |
| C1T | C2T | O2T | H4 | 180.0° | 60.5° |
| O1T | C1T | O5T | H1T | 119.7° | 119.9° |
| O1T | C1T | C2T | C3T | 70.3° | 58.8° |
| O1T | C1T | C2T | O2T | 50.1° | 61.1° |
| O1T | C1T | C2T | H2T | 170.0° | 178.6° |
| O1T | C1T | O5T | C5T | 67.0° | 52.5° |
| O5T | C1T | C2T | C3T | 51.4° | 61.2° |
| O5T | C1T | C2T | O2T | 171.8° | 178.8° |
| O5T | C1T | C2T | H2T | 68.3° | 58.5° |
| C1T | O5T | C5T | C4T | 58.4° | 67.4° |
| C1T | O5T | C5T | C6T | 179.7° | 172.4° |
| C1T | O5T | C5T | H5T | 60.5° | 52.5° |
| O5T | C1T | O1T | H5 | 57.2° | 59.7° |
| H1T | C1T | C2T | C3T | 170.0° | 178.7° |
| H1T | C1T | C2T | O2T | 69.6° | 58.7° |
| H1T | C1T | C2T | H2T | 50.3° | 61.5° |
| H1T | C1T | O5T | C5T | 173.3° | 172.4° |
| H1T | C1T | O1T | H5 | 61.5° | 60.1° |
| C3T | C2T | O2T | H2T | 119.7° | 120.2° |
| C2T | C3T | C4T | O3T | 120.6° | 119.9° |
| C2T | C3T | C4T | H3T | 119.7° | 119.7° |
| C2T | C3T | O3T | H3T | 119.7° | 120.4° |
| C2T | C3T | C4T | C5T | 58.8° | 53.7° |
| C2T | C3T | C4T | H4T | 61.1° | 66.2° |
| C3T | C2T | O2T | H4 | 59.2° | 180.0° |
| C2T | C3T | O3T | H3 | 180.0° | 60.7° |
| O2T | C2T | C3T | C4T | 175.7° | 173.6° |
| O2T | C2T | C3T | O3T | 63.6° | 66.5° |
| O2T | C2T | C3T | H3T | 56.0° | 53.9° |
| H2T | C2T | C3T | C4T | 64.4° | 66.1° |
| H2T | C2T | C3T | O3T | 56.2° | 53.8° |
| H2T | C2T | C3T | H3T | 175.9° | 174.1° |
| H2T | C2T | O2T | H4 | 60.5° | 59.8° |
| C4T | C3T | O3T | H3T | 119.6° | 120.4° |
| C3T | C4T | C5T | H4T | 121.0° | 119.9° |
| C3T | C4T | C5T | C6T | 179.3° | 178.8° |
| C3T | C4T | C5T | O5T | 58.7° | 61.1° |
| C3T | C4T | C5T | H5T | 61.6° | 58.9° |
| C4T | C3T | O3T | H3 | 59.3° | 180.0° |
| O3T | C3T | C4T | C5T | 179.5° | 173.6° |
| O3T | C3T | C4T | H4T | 59.6° | 53.7° |
| H3T | C3T | C4T | C5T | 60.8° | 66.1° |
| H3T | C3T | C4T | H4T | 179.3° | 174.1° |
| H3T | C3T | O3T | H3 | 60.3° | 59.7° |
| C4T | C5T | C6T | O5T | 120.8° | 120.4° |
| C4T | C5T | C6T | H5T | 118.9° | 119.8° |
| C4T | C5T | O5T | H5T | 118.9° | 120.0° |
| C4T | C5T | C6T | O6T | 168.5° | 175.5° |
| C4T | C5T | C6T | H6T1 | 66.2° | 55.5° |
| C4T | C5T | C6T | H6T2 | 43.3° | 64.5° |
| H4T | C4T | C5T | C6T | 58.2° | 61.3° |
| H4T | C4T | C5T | O5T | 62.4° | 58.8° |
| H4T | C4T | C5T | H5T | 177.3° | 178.8° |
| C6T | C5T | O5T | H5T | 119.1° | 119.9° |
| C5T | C6T | O6T | H6T1 | 125.3° | 120.0° |
| C5T | C6T | O6T | H6T2 | 125.3° | 120.1° |
| C5T | C6T | H6T1 | H6T2 | 117.9° | 120.0° |
| C5T | C6T | O6T | H6T | 180.0° | 180.0° |
| O5T | C5T | C6T | O6T | 70.7° | 64.1° |
| O5T | C5T | C6T | H6T1 | 54.6° | 175.9° |
| O5T | C5T | C6T | H6T2 | 164.0° | 55.9° |
| H5T | C5T | C6T | O6T | 49.6° | 55.7° |
| H5T | C5T | C6T | H6T1 | 174.9° | 64.3° |
| H5T | C5T | C6T | H6T2 | 75.6° | 175.7° |
| O6T | C6T | H6T1 | H6T2 | 117.8° | 120.0° |
| H6T1 | C6T | O6T | H6T | 54.7° | 59.9° |
| H6T2 | C6T | O6T | H6T | 54.7° | 60.0° |
