H8O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| FAC | CAY | sing | 1.40Å | 1.37Å | |
| FAD | CAY | sing | 1.40Å | 1.37Å | |
| CAY | FAB | sing | 1.40Å | 1.37Å | |
| CAY | CAR | sing | 1.51Å | 1.54Å | |
| OAA | CAW | sing | 1.43Å | 1.40Å | |
| CAK | CAR | doub | 1.39Å | 1.37Å | Aromatic |
| CAK | CAS | sing | 1.37Å | 1.36Å | Aromatic |
| CAR | NAP | sing | 1.31Å | 1.33Å | Aromatic |
| CAW | CAS | sing | 1.51Å | 1.53Å | |
| CAW | CAX | sing | 1.53Å | 1.54Å | |
| CAS | CAU | doub | 1.41Å | 1.39Å | Aromatic |
| NAQ | CAX | sing | 1.47Å | 1.45Å | |
| NAQ | CAN | sing | 1.47Å | 1.44Å | |
| NAP | CAV | doub | 1.34Å | 1.35Å | Aromatic |
| CAO | CAX | sing | 1.53Å | 1.53Å | |
| CAO | CAM | sing | 1.53Å | 1.52Å | |
| CAL | CAN | sing | 1.53Å | 1.54Å | |
| CAL | CAM | sing | 1.53Å | 1.53Å | |
| CAU | CAV | sing | 1.42Å | 1.43Å | Aromatic |
| CAU | CAJ | sing | 1.41Å | 1.40Å | Aromatic |
| CAV | CAT | sing | 1.41Å | 1.40Å | Aromatic |
| FAG | CAZ | sing | 1.40Å | 1.36Å | |
| CAJ | CAH | doub | 1.36Å | 1.37Å | Aromatic |
| CAT | CAZ | sing | 1.51Å | 1.53Å | |
| CAT | CAI | doub | 1.36Å | 1.38Å | Aromatic |
| FAE | CAZ | sing | 1.40Å | 1.36Å | |
| CAZ | FAF | sing | 1.40Å | 1.37Å | |
| CAH | CAI | sing | 1.39Å | 1.37Å | Aromatic |
| CAI | H1 | sing | 1.08Å | 1.08Å | |
| CAH | H2 | sing | 1.08Å | 1.08Å | |
| CAJ | H3 | sing | 1.08Å | 1.08Å | |
| CAK | H4 | sing | 1.08Å | 1.08Å | |
| CAW | H5 | sing | 1.09Å | 1.10Å | |
| OAA | H6 | sing | 0.97Å | 0.95Å | |
| CAX | H7 | sing | 1.09Å | 1.10Å | |
| CAO | H8 | sing | 1.09Å | 1.10Å | |
| CAO | H9 | sing | 1.09Å | 1.10Å | |
| CAM | H10 | sing | 1.09Å | 1.10Å | |
| CAM | H11 | sing | 1.09Å | 1.10Å | |
| CAL | H12 | sing | 1.09Å | 1.10Å | |
| CAL | H13 | sing | 1.09Å | 1.10Å | |
| CAN | H14 | sing | 1.09Å | 1.10Å | |
| CAN | H15 | sing | 1.09Å | 1.10Å | |
| NAQ | H16 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| FAC | CAY | FAD | 109.4° | 109.5° |
| FAC | CAY | FAB | 107.4° | 109.5° |
| FAC | CAY | CAR | 110.0° | 109.5° |
| FAD | CAY | FAB | 109.6° | 109.5° |
| FAD | CAY | CAR | 109.4° | 109.5° |
| FAB | CAY | CAR | 111.1° | 109.5° |
| CAY | CAR | CAK | 117.8° | 119.1° |
| CAY | CAR | NAP | 118.1° | 119.1° |
| OAA | CAW | CAS | 110.1° | 109.5° |
| OAA | CAW | CAX | 110.6° | 109.5° |
| OAA | CAW | H5 | 109.3° | 109.5° |
| CAW | OAA | H6 | 109.5° | 114.0° |
| CAR | CAK | CAS | 118.7° | 119.9° |
| CAK | CAR | NAP | 124.1° | 121.8° |
| CAR | CAK | H4 | 120.6° | 120.1° |
| CAK | CAS | CAW | 120.3° | 120.9° |
| CAK | CAS | CAU | 120.2° | 118.1° |
| CAS | CAK | H4 | 120.6° | 120.0° |
| CAR | NAP | CAV | 118.3° | 121.4° |
| CAS | CAW | CAX | 111.4° | 109.5° |
| CAW | CAS | CAU | 119.5° | 121.0° |
| CAS | CAW | H5 | 107.7° | 109.5° |
| CAW | CAX | NAQ | 111.7° | 109.4° |
| CAW | CAX | CAO | 106.7° | 109.5° |
| CAX | CAW | H5 | 107.6° | 109.4° |
| CAW | CAX | H7 | 108.6° | 109.4° |
| CAS | CAU | CAV | 117.4° | 119.1° |
| CAS | CAU | CAJ | 124.6° | 121.4° |
| CAX | NAQ | CAN | 110.5° | 111.2° |
| NAQ | CAX | CAO | 111.1° | 109.5° |
| NAQ | CAX | H7 | 110.0° | 109.5° |
| CAX | NAQ | H16 | 109.2° | 111.0° |
| NAQ | CAN | CAL | 111.5° | 109.5° |
| NAQ | CAN | H14 | 109.0° | 109.4° |
| NAQ | CAN | H15 | 109.0° | 109.5° |
| CAN | NAQ | H16 | 109.2° | 111.0° |
| NAP | CAV | CAU | 121.2° | 119.8° |
| NAP | CAV | CAT | 119.6° | 121.1° |
| CAX | CAO | CAM | 113.6° | 109.3° |
| CAO | CAX | H7 | 108.8° | 109.5° |
| CAX | CAO | H8 | 108.4° | 109.5° |
| CAX | CAO | H9 | 108.4° | 109.5° |
| CAO | CAM | CAL | 112.4° | 109.2° |
| CAM | CAO | H8 | 108.4° | 109.5° |
| CAM | CAO | H9 | 108.4° | 109.5° |
| CAO | CAM | H10 | 108.8° | 109.5° |
| CAO | CAM | H11 | 108.8° | 109.5° |
| CAN | CAL | CAM | 112.4° | 109.3° |
| CAN | CAL | H12 | 108.7° | 109.6° |
| CAN | CAL | H13 | 108.7° | 109.5° |
| CAL | CAN | H14 | 109.0° | 109.4° |
| CAL | CAN | H15 | 109.0° | 109.5° |
| CAL | CAM | H10 | 108.7° | 109.6° |
| CAL | CAM | H11 | 108.7° | 109.6° |
| CAM | CAL | H12 | 108.7° | 109.5° |
| CAM | CAL | H13 | 108.7° | 109.5° |
| CAV | CAU | CAJ | 118.0° | 119.5° |
| CAU | CAV | CAT | 119.2° | 119.1° |
| CAU | CAJ | CAH | 121.2° | 119.7° |
| CAU | CAJ | H3 | 119.4° | 120.1° |
| CAV | CAT | CAZ | 120.6° | 120.1° |
| CAV | CAT | CAI | 119.9° | 119.8° |
| FAG | CAZ | CAT | 107.8° | 109.5° |
| FAG | CAZ | FAE | 110.5° | 109.5° |
| FAG | CAZ | FAF | 108.2° | 109.5° |
| CAJ | CAH | CAI | 120.5° | 120.9° |
| CAJ | CAH | H2 | 119.7° | 119.6° |
| CAH | CAJ | H3 | 119.4° | 120.2° |
| CAZ | CAT | CAI | 119.5° | 120.1° |
| CAT | CAZ | FAE | 110.5° | 109.4° |
| CAT | CAZ | FAF | 110.4° | 109.5° |
| CAT | CAI | CAH | 121.2° | 121.1° |
| CAT | CAI | H1 | 119.4° | 119.5° |
| FAE | CAZ | FAF | 109.4° | 109.5° |
| CAH | CAI | H1 | 119.4° | 119.5° |
| CAI | CAH | H2 | 119.8° | 119.6° |
| H8 | CAO | H9 | 109.5° | 109.5° |
| H10 | CAM | H11 | 109.5° | 109.5° |
| H12 | CAL | H13 | 109.5° | 109.5° |
| H14 | CAN | H15 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| FAC | CAY | FAD | FAB | 117.4° | 120.0° |
| FAC | CAY | FAD | CAR | 120.5° | 120.0° |
| FAC | CAY | FAB | CAR | 120.4° | 120.0° |
| FAC | CAY | CAR | CAK | 50.3° | 54.9° |
| FAC | CAY | CAR | NAP | 130.0° | 125.0° |
| FAD | CAY | FAB | CAR | 121.0° | 120.0° |
| FAD | CAY | CAR | CAK | 69.8° | 65.0° |
| FAD | CAY | CAR | NAP | 109.8° | 115.0° |
| FAB | CAY | CAR | CAK | 169.1° | 175.0° |
| FAB | CAY | CAR | NAP | 11.3° | 5.0° |
| CAY | CAR | CAK | NAP | 179.6° | 179.9° |
| CAY | CAR | CAK | CAS | 179.5° | 179.5° |
| CAY | CAR | NAP | CAV | 179.8° | 180.0° |
| CAY | CAR | CAK | H4 | 0.5° | 0.1° |
| OAA | CAW | CAS | CAK | 20.4° | 25.0° |
| OAA | CAW | CAS | CAX | 123.1° | 120.0° |
| OAA | CAW | CAS | H5 | 119.2° | 120.0° |
| OAA | CAW | CAX | H5 | 119.3° | 119.9° |
| OAA | CAW | CAS | CAU | 158.6° | 154.0° |
| OAA | CAW | CAX | NAQ | 58.5° | 60.1° |
| OAA | CAW | CAX | CAO | 63.0° | 60.0° |
| OAA | CAW | CAX | H7 | 179.9° | 180.0° |
| CAR | CAK | CAS | H4 | 180.0° | 179.4° |
| CAR | CAK | CAS | CAW | 180.0° | 180.0° |
| CAR | CAK | CAS | CAU | 0.9° | 0.9° |
| CAK | CAR | NAP | CAV | 0.6° | 0.1° |
| CAS | CAK | CAR | NAP | 0.1° | 0.6° |
| CAK | CAS | CAW | CAU | 179.1° | 179.0° |
| CAK | CAS | CAW | CAX | 102.7° | 95.0° |
| CAK | CAS | CAU | CAV | 1.0° | 0.9° |
| CAK | CAS | CAU | CAJ | 179.6° | 179.6° |
| CAK | CAS | CAW | H5 | 139.6° | 145.0° |
| CAR | NAP | CAV | CAU | 0.5° | 0.0° |
| CAR | NAP | CAV | CAT | 179.8° | 179.5° |
| NAP | CAR | CAK | H4 | 179.9° | 180.0° |
| CAS | CAW | CAX | H5 | 117.8° | 120.0° |
| CAS | CAW | CAX | NAQ | 64.3° | 60.0° |
| CAS | CAW | CAX | CAO | 174.1° | 180.0° |
| CAW | CAS | CAU | CAV | 180.0° | 179.9° |
| CAW | CAS | CAU | CAJ | 0.6° | 0.5° |
| CAW | CAS | CAK | H4 | 0.0° | 0.5° |
| CAS | CAW | OAA | H6 | 180.0° | 60.0° |
| CAS | CAW | CAX | H7 | 57.1° | 60.0° |
| CAX | CAW | CAS | CAU | 78.3° | 85.9° |
| CAW | CAX | NAQ | CAO | 119.0° | 120.0° |
| CAW | CAX | NAQ | H7 | 120.6° | 119.9° |
| CAW | CAX | NAQ | CAN | 178.9° | 178.2° |
| CAW | CAX | CAO | H7 | 117.0° | 120.0° |
| CAW | CAX | CAO | CAM | 174.0° | 179.2° |
| CAX | CAW | OAA | H6 | 56.4° | 60.1° |
| CAW | CAX | CAO | H8 | 53.4° | 59.2° |
| CAW | CAX | CAO | H9 | 65.4° | 60.9° |
| CAW | CAX | NAQ | H16 | 58.8° | 54.1° |
| CAS | CAU | CAV | NAP | 0.3° | 0.4° |
| CAS | CAU | CAV | CAJ | 179.4° | 179.6° |
| CAS | CAU | CAV | CAT | 179.5° | 180.0° |
| CAS | CAU | CAJ | CAH | 179.6° | 179.8° |
| CAS | CAU | CAJ | H3 | 0.4° | 0.3° |
| CAU | CAS | CAK | H4 | 179.1° | 179.6° |
| CAU | CAS | CAW | H5 | 39.5° | 34.0° |
| CAX | NAQ | CAN | H16 | 120.2° | 124.1° |
| NAQ | CAX | CAO | H7 | 121.1° | 120.0° |
| NAQ | CAX | CAO | CAM | 52.1° | 59.2° |
| CAX | NAQ | CAN | CAL | 63.0° | 61.8° |
| NAQ | CAX | CAW | H5 | 177.8° | 180.0° |
| NAQ | CAX | CAO | H8 | 68.5° | 60.7° |
| NAQ | CAX | CAO | H9 | 172.7° | 179.2° |
| CAX | NAQ | CAN | H14 | 57.3° | 178.3° |
| CAX | NAQ | CAN | H15 | 176.7° | 58.2° |
| CAN | NAQ | CAX | CAO | 62.1° | 61.8° |
| NAQ | CAN | CAL | H14 | 120.3° | 119.9° |
| NAQ | CAN | CAL | H15 | 120.3° | 120.1° |
| NAQ | CAN | CAL | CAM | 53.1° | 59.2° |
| CAN | NAQ | CAX | H7 | 58.3° | 58.3° |
| NAQ | CAN | CAL | H12 | 173.5° | 60.7° |
| NAQ | CAN | CAL | H13 | 67.4° | 179.2° |
| NAQ | CAN | H14 | H15 | 119.1° | 120.1° |
| NAP | CAV | CAU | CAT | 179.7° | 179.5° |
| NAP | CAV | CAU | CAJ | 179.7° | 180.0° |
| NAP | CAV | CAT | CAZ | 1.0° | 0.3° |
| NAP | CAV | CAT | CAI | 179.9° | 179.9° |
| CAX | CAO | CAM | H8 | 120.6° | 119.9° |
| CAX | CAO | CAM | H9 | 120.6° | 119.9° |
| CAX | CAO | CAM | CAL | 42.4° | 57.6° |
| CAO | CAX | CAW | H5 | 56.3° | 60.0° |
| CAX | CAO | H8 | H9 | 118.1° | 120.1° |
| CAX | CAO | CAM | H10 | 162.9° | 177.6° |
| CAX | CAO | CAM | H11 | 78.0° | 62.3° |
| CAO | CAX | NAQ | H16 | 177.7° | 174.2° |
| CAO | CAM | CAL | CAN | 42.5° | 57.7° |
| CAO | CAM | CAL | H10 | 120.5° | 119.9° |
| CAO | CAM | CAL | H11 | 120.4° | 119.9° |
| CAM | CAO | CAX | H7 | 69.1° | 60.9° |
| CAM | CAO | H8 | H9 | 118.1° | 120.1° |
| CAO | CAM | H10 | H11 | 118.7° | 120.1° |
| CAO | CAM | CAL | H12 | 163.0° | 62.3° |
| CAO | CAM | CAL | H13 | 77.9° | 177.6° |
| CAN | CAL | CAM | H12 | 120.4° | 120.0° |
| CAN | CAL | CAM | H13 | 120.4° | 119.9° |
| CAN | CAL | CAM | H10 | 163.0° | 177.6° |
| CAN | CAL | CAM | H11 | 77.9° | 62.2° |
| CAN | CAL | H12 | H13 | 118.7° | 120.1° |
| CAL | CAN | H14 | H15 | 119.1° | 120.0° |
| CAL | CAN | NAQ | H16 | 176.8° | 174.1° |
| CAL | CAM | CAO | H8 | 78.1° | 62.3° |
| CAL | CAM | CAO | H9 | 163.0° | 177.6° |
| CAL | CAM | H10 | H11 | 118.6° | 120.2° |
| CAM | CAL | H12 | H13 | 118.6° | 120.1° |
| CAM | CAL | CAN | H14 | 67.2° | 179.2° |
| CAM | CAL | CAN | H15 | 173.3° | 60.8° |
| CAV | CAU | CAJ | CAH | 0.2° | 0.2° |
| CAU | CAV | CAT | CAZ | 179.2° | 179.8° |
| CAU | CAV | CAT | CAI | 0.1° | 0.5° |
| CAV | CAU | CAJ | H3 | 179.8° | 179.8° |
| CAJ | CAU | CAV | CAT | 0.0° | 0.5° |
| CAU | CAJ | CAH | H3 | 180.0° | 180.0° |
| CAU | CAJ | CAH | CAI | 0.2° | 0.0° |
| CAU | CAJ | CAH | H2 | 179.8° | 180.0° |
| CAV | CAT | CAZ | FAG | 63.5° | 60.3° |
| CAV | CAT | CAZ | CAI | 179.1° | 179.7° |
| CAV | CAT | CAZ | FAE | 57.4° | 179.7° |
| CAV | CAT | CAZ | FAF | 178.6° | 59.7° |
| CAV | CAT | CAI | CAH | 0.2° | 0.4° |
| CAV | CAT | CAI | H1 | 179.9° | 179.7° |
| FAG | CAZ | CAT | FAE | 120.9° | 119.9° |
| FAG | CAZ | CAT | FAF | 117.9° | 120.0° |
| FAG | CAZ | CAT | CAI | 115.6° | 120.0° |
| FAG | CAZ | FAE | FAF | 119.0° | 120.1° |
| CAJ | CAH | CAI | CAT | 0.0° | 0.1° |
| CAJ | CAH | CAI | H2 | 180.0° | 179.9° |
| CAJ | CAH | CAI | H1 | 180.0° | 180.0° |
| CAT | CAZ | FAE | FAF | 121.7° | 120.0° |
| CAZ | CAT | CAI | CAH | 179.3° | 180.0° |
| CAZ | CAT | CAI | H1 | 0.7° | 0.1° |
| CAI | CAT | CAZ | FAE | 123.5° | 0.1° |
| CAI | CAT | CAZ | FAF | 2.3° | 120.0° |
| CAT | CAI | CAH | H1 | 180.0° | 179.9° |
| CAT | CAI | CAH | H2 | 180.0° | 180.0° |
| CAI | CAH | CAJ | H3 | 179.8° | 180.0° |
| H1 | CAI | CAH | H2 | 0.0° | 0.0° |
| H2 | CAH | CAJ | H3 | 0.2° | 0.1° |
| H5 | CAW | OAA | H6 | 61.9° | 180.0° |
| H5 | CAW | CAX | H7 | 60.8° | 60.0° |
| H7 | CAX | CAO | H8 | 170.3° | 179.2° |
| H7 | CAX | CAO | H9 | 51.5° | 59.1° |
| H7 | CAX | NAQ | H16 | 61.8° | 65.8° |
| H8 | CAO | CAM | H10 | 42.3° | 57.6° |
| H8 | CAO | CAM | H11 | 161.4° | 177.7° |
| H9 | CAO | CAM | H10 | 76.5° | 62.5° |
| H9 | CAO | CAM | H11 | 42.6° | 57.6° |
| H10 | CAM | CAL | H12 | 76.6° | 57.6° |
| H10 | CAM | CAL | H13 | 42.6° | 62.5° |
| H11 | CAM | CAL | H12 | 42.5° | 177.8° |
| H11 | CAM | CAL | H13 | 161.7° | 57.7° |
| H12 | CAL | CAN | H14 | 53.2° | 59.2° |
| H12 | CAL | CAN | H15 | 66.2° | 179.2° |
| H13 | CAL | CAN | H14 | 172.3° | 60.9° |
| H13 | CAL | CAN | H15 | 52.9° | 59.1° |
| H14 | CAN | NAQ | H16 | 62.9° | 54.2° |
| H15 | CAN | NAQ | H16 | 56.5° | 65.8° |
