ZHB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAD | CAS | sing | 1.36Å | 1.34Å | |
| OAB | CAQ | doub | 1.22Å | 1.23Å | |
| CAS | CAH | doub | 1.38Å | 1.37Å | Aromatic |
| CAS | CAU | sing | 1.41Å | 1.40Å | Aromatic |
| CAH | CAR | sing | 1.39Å | 1.39Å | Aromatic |
| CAA | CAV | sing | 1.53Å | 1.51Å | |
| CAQ | CAU | sing | 1.47Å | 1.42Å | |
| CAQ | OAP | sing | 1.35Å | 1.37Å | |
| CAU | CAT | doub | 1.41Å | 1.43Å | Aromatic |
| CAR | OAC | sing | 1.36Å | 1.35Å | |
| CAR | CAI | doub | 1.39Å | 1.36Å | Aromatic |
| CAV | OAP | sing | 1.45Å | 1.46Å | |
| CAV | CAM | sing | 1.53Å | 1.54Å | |
| CAT | CAI | sing | 1.40Å | 1.41Å | Aromatic |
| CAT | CAG | sing | 1.47Å | 1.42Å | |
| CAM | CAL | sing | 1.53Å | 1.52Å | |
| CAG | CAF | doub | 1.32Å | 1.40Å | |
| CAL | CAO | sing | 1.53Å | 1.50Å | |
| CAF | CAJ | sing | 1.51Å | 1.39Å | |
| CAO | CAW | sing | 1.53Å | 1.57Å | |
| CAJ | CAK | sing | 1.53Å | 1.52Å | |
| CAW | CAN | sing | 1.53Å | 1.57Å | |
| CAW | OAE | sing | 1.43Å | 1.46Å | |
| CAN | CAK | sing | 1.53Å | 1.51Å | |
| CAO | H1 | sing | 1.09Å | 1.10Å | |
| CAO | H2 | sing | 1.09Å | 1.10Å | |
| CAL | H3 | sing | 1.09Å | 1.10Å | |
| CAL | H4 | sing | 1.09Å | 1.10Å | |
| CAM | H5 | sing | 1.09Å | 1.10Å | |
| CAM | H6 | sing | 1.09Å | 1.10Å | |
| CAV | H7 | sing | 1.09Å | 1.10Å | |
| CAA | H8 | sing | 1.09Å | 1.10Å | |
| CAA | H9 | sing | 1.09Å | 1.10Å | |
| CAA | H10 | sing | 1.09Å | 1.10Å | |
| OAD | H11 | sing | 0.97Å | 0.95Å | |
| CAH | H12 | sing | 1.08Å | 1.08Å | |
| OAC | H13 | sing | 0.97Å | 0.95Å | |
| CAI | H14 | sing | 1.08Å | 1.08Å | |
| CAG | H15 | sing | 1.09Å | 1.08Å | |
| CAF | H16 | sing | 1.08Å | 1.08Å | |
| CAJ | H17 | sing | 1.09Å | 1.10Å | |
| CAJ | H18 | sing | 1.09Å | 1.10Å | |
| CAK | H19 | sing | 1.09Å | 1.10Å | |
| CAK | H20 | sing | 1.09Å | 1.10Å | |
| CAN | H21 | sing | 1.09Å | 1.10Å | |
| CAN | H22 | sing | 1.09Å | 1.10Å | |
| CAW | H23 | sing | 1.09Å | 1.10Å | |
| OAE | H24 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAD | CAS | CAH | 117.3° | 119.9° |
| OAD | CAS | CAU | 119.9° | 119.9° |
| CAS | OAD | H11 | 109.5° | 114.0° |
| OAB | CAQ | CAU | 120.6° | 120.6° |
| OAB | CAQ | OAP | 121.4° | 120.6° |
| CAH | CAS | CAU | 122.7° | 120.2° |
| CAS | CAH | CAR | 120.4° | 120.2° |
| CAS | CAH | H12 | 119.8° | 119.9° |
| CAS | CAU | CAQ | 117.7° | 119.0° |
| CAS | CAU | CAT | 116.8° | 119.5° |
| CAH | CAR | OAC | 118.5° | 119.8° |
| CAH | CAR | CAI | 119.5° | 120.5° |
| CAR | CAH | H12 | 119.8° | 119.9° |
| CAA | CAV | OAP | 114.9° | 109.5° |
| CAA | CAV | CAM | 107.3° | 109.4° |
| CAA | CAV | H7 | 108.8° | 109.4° |
| CAV | CAA | H8 | 109.5° | 109.5° |
| CAV | CAA | H9 | 109.5° | 109.5° |
| CAV | CAA | H10 | 109.5° | 109.4° |
| CAU | CAQ | OAP | 117.7° | 118.8° |
| CAQ | CAU | CAT | 125.5° | 121.5° |
| CAQ | OAP | CAV | 128.1° | 117.9° |
| CAU | CAT | CAI | 119.2° | 119.4° |
| CAU | CAT | CAG | 122.5° | 121.8° |
| OAC | CAR | CAI | 122.0° | 119.8° |
| CAR | OAC | H13 | 109.5° | 114.0° |
| CAR | CAI | CAT | 121.5° | 120.2° |
| CAR | CAI | H14 | 119.3° | 119.9° |
| OAP | CAV | CAM | 107.8° | 109.8° |
| OAP | CAV | H7 | 109.4° | 109.4° |
| CAV | CAM | CAL | 110.2° | 108.9° |
| CAV | CAM | H5 | 109.3° | 109.6° |
| CAV | CAM | H6 | 109.3° | 109.7° |
| CAM | CAV | H7 | 108.5° | 109.4° |
| CAI | CAT | CAG | 118.4° | 118.7° |
| CAT | CAI | H14 | 119.3° | 119.9° |
| CAT | CAG | CAF | 125.1° | 121.5° |
| CAT | CAG | H15 | 117.5° | 119.2° |
| CAM | CAL | CAO | 113.4° | 109.6° |
| CAM | CAL | H3 | 108.5° | 109.4° |
| CAM | CAL | H4 | 108.5° | 109.4° |
| CAL | CAM | H5 | 109.3° | 109.5° |
| CAL | CAM | H6 | 109.3° | 109.5° |
| CAG | CAF | CAJ | 120.9° | 119.5° |
| CAF | CAG | H15 | 117.4° | 119.3° |
| CAG | CAF | H16 | 119.6° | 120.8° |
| CAL | CAO | CAW | 109.9° | 109.3° |
| CAL | CAO | H1 | 109.4° | 109.5° |
| CAL | CAO | H2 | 109.4° | 109.5° |
| CAO | CAL | H3 | 108.5° | 109.5° |
| CAO | CAL | H4 | 108.5° | 109.5° |
| CAF | CAJ | CAK | 117.0° | 109.9° |
| CAJ | CAF | H16 | 119.5° | 119.6° |
| CAF | CAJ | H17 | 107.6° | 109.4° |
| CAF | CAJ | H18 | 107.6° | 109.4° |
| CAO | CAW | CAN | 110.7° | 109.4° |
| CAO | CAW | OAE | 107.2° | 109.5° |
| CAW | CAO | H1 | 109.4° | 109.5° |
| CAW | CAO | H2 | 109.4° | 109.5° |
| CAO | CAW | H23 | 108.4° | 109.5° |
| CAJ | CAK | CAN | 111.1° | 109.4° |
| CAK | CAJ | H17 | 107.6° | 109.4° |
| CAK | CAJ | H18 | 107.6° | 109.4° |
| CAJ | CAK | H19 | 109.1° | 109.5° |
| CAJ | CAK | H20 | 109.1° | 109.5° |
| CAN | CAW | OAE | 112.2° | 109.5° |
| CAW | CAN | CAK | 108.4° | 109.7° |
| CAW | CAN | H21 | 109.8° | 109.4° |
| CAW | CAN | H22 | 109.7° | 109.4° |
| CAN | CAW | H23 | 108.4° | 109.5° |
| OAE | CAW | H23 | 109.9° | 109.5° |
| CAW | OAE | H24 | 109.5° | 114.0° |
| CAN | CAK | H19 | 109.0° | 109.5° |
| CAN | CAK | H20 | 109.1° | 109.5° |
| CAK | CAN | H21 | 109.7° | 109.4° |
| CAK | CAN | H22 | 109.7° | 109.5° |
| H1 | CAO | H2 | 109.5° | 109.6° |
| H3 | CAL | H4 | 109.5° | 109.4° |
| H5 | CAM | H6 | 109.4° | 109.6° |
| H8 | CAA | H9 | 109.5° | 109.5° |
| H8 | CAA | H10 | 109.5° | 109.5° |
| H9 | CAA | H10 | 109.4° | 109.5° |
| H17 | CAJ | H18 | 109.5° | 109.4° |
| H19 | CAK | H20 | 109.5° | 109.5° |
| H21 | CAN | H22 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAD | CAS | CAH | CAU | 177.8° | 180.0° |
| OAD | CAS | CAH | CAR | 178.7° | 180.0° |
| OAD | CAS | CAU | CAQ | 4.0° | 2.2° |
| OAD | CAS | CAU | CAT | 176.9° | 177.9° |
| OAD | CAS | CAH | H12 | 1.3° | 0.2° |
| OAB | CAQ | CAU | CAS | 10.8° | 174.3° |
| OAB | CAQ | CAU | OAP | 173.5° | 180.0° |
| OAB | CAQ | CAU | CAT | 170.1° | 5.8° |
| OAB | CAQ | OAP | CAV | 37.3° | 2.7° |
| CAS | CAH | CAR | H12 | 180.0° | 179.9° |
| CAH | CAS | CAU | CAQ | 178.3° | 177.7° |
| CAH | CAS | CAU | CAT | 0.8° | 2.1° |
| CAS | CAH | CAR | OAC | 178.6° | 178.7° |
| CAS | CAH | CAR | CAI | 2.2° | 1.1° |
| CAH | CAS | OAD | H11 | 176.9° | 90.0° |
| CAU | CAS | CAH | CAR | 1.0° | 0.0° |
| CAS | CAU | CAQ | CAT | 179.0° | 179.9° |
| CAS | CAU | CAQ | OAP | 162.7° | 5.6° |
| CAS | CAU | CAT | CAI | 1.4° | 3.2° |
| CAS | CAU | CAT | CAG | 179.7° | 174.5° |
| CAU | CAS | OAD | H11 | 0.9° | 90.0° |
| CAU | CAS | CAH | H12 | 179.0° | 179.8° |
| CAH | CAR | OAC | CAI | 179.2° | 179.9° |
| CAH | CAR | CAI | CAT | 1.6° | 0.0° |
| CAH | CAR | OAC | H13 | 180.0° | 89.9° |
| CAH | CAR | CAI | H14 | 178.4° | 179.9° |
| CAA | CAV | OAP | CAQ | 1.8° | 88.2° |
| CAA | CAV | OAP | CAM | 119.5° | 120.1° |
| CAA | CAV | OAP | H7 | 122.7° | 119.9° |
| CAA | CAV | CAM | H7 | 117.4° | 119.8° |
| CAA | CAV | CAM | CAL | 123.7° | 18.6° |
| CAA | CAV | CAM | H5 | 3.5° | 138.4° |
| CAA | CAV | CAM | H6 | 116.2° | 101.2° |
| CAV | CAA | H8 | H9 | 120.0° | 120.0° |
| CAV | CAA | H8 | H10 | 120.0° | 119.9° |
| CAV | CAA | H9 | H10 | 120.0° | 119.9° |
| CAU | CAQ | OAP | CAV | 136.1° | 177.3° |
| CAQ | CAU | CAT | CAI | 177.6° | 176.7° |
| CAQ | CAU | CAT | CAG | 1.3° | 5.6° |
| OAP | CAQ | CAU | CAT | 16.4° | 174.2° |
| CAQ | OAP | CAV | CAM | 121.3° | 31.9° |
| CAQ | OAP | CAV | H7 | 120.9° | 152.0° |
| CAU | CAT | CAI | CAR | 0.2° | 2.2° |
| CAU | CAT | CAI | CAG | 179.0° | 177.8° |
| CAU | CAT | CAG | CAF | 162.4° | 31.0° |
| CAU | CAT | CAI | H14 | 179.8° | 177.9° |
| CAU | CAT | CAG | H15 | 17.6° | 148.3° |
| OAC | CAR | CAI | CAT | 179.3° | 179.8° |
| OAC | CAR | CAH | H12 | 1.4° | 1.4° |
| OAC | CAR | CAI | H14 | 0.7° | 0.2° |
| CAR | CAI | CAT | H14 | 180.0° | 179.9° |
| CAR | CAI | CAT | CAG | 179.2° | 175.6° |
| CAI | CAR | CAH | H12 | 177.8° | 178.7° |
| CAI | CAR | OAC | H13 | 0.8° | 89.9° |
| OAP | CAV | CAM | H7 | 118.4° | 120.1° |
| OAP | CAV | CAM | CAL | 112.1° | 138.7° |
| OAP | CAV | CAM | H5 | 127.8° | 101.5° |
| OAP | CAV | CAM | H6 | 8.1° | 18.9° |
| OAP | CAV | CAA | H8 | 180.0° | 60.0° |
| OAP | CAV | CAA | H9 | 60.0° | 180.0° |
| OAP | CAV | CAA | H10 | 60.0° | 60.0° |
| CAV | CAM | CAL | H5 | 120.1° | 119.8° |
| CAV | CAM | CAL | H6 | 120.1° | 119.9° |
| CAV | CAM | CAL | CAO | 150.7° | 179.5° |
| CAV | CAM | CAL | H3 | 30.2° | 59.5° |
| CAV | CAM | CAL | H4 | 88.7° | 60.4° |
| CAV | CAM | H5 | H6 | 119.7° | 120.4° |
| CAM | CAV | CAA | H8 | 60.2° | 60.4° |
| CAM | CAV | CAA | H9 | 179.8° | 59.7° |
| CAM | CAV | CAA | H10 | 59.8° | 179.7° |
| CAI | CAT | CAG | CAF | 18.7° | 146.7° |
| CAI | CAT | CAG | H15 | 161.3° | 34.0° |
| CAT | CAG | CAF | H15 | 180.0° | 179.3° |
| CAT | CAG | CAF | CAJ | 175.9° | 179.9° |
| CAG | CAT | CAI | H14 | 0.8° | 4.3° |
| CAT | CAG | CAF | H16 | 4.1° | 1.8° |
| CAM | CAL | CAO | H3 | 120.6° | 120.0° |
| CAM | CAL | CAO | H4 | 120.6° | 120.0° |
| CAM | CAL | CAO | CAW | 90.7° | 106.4° |
| CAM | CAL | CAO | H1 | 149.3° | 13.5° |
| CAM | CAL | CAO | H2 | 29.4° | 133.6° |
| CAM | CAL | H3 | H4 | 118.2° | 119.9° |
| CAL | CAM | H5 | H6 | 119.6° | 120.2° |
| CAL | CAM | CAV | H7 | 6.3° | 101.2° |
| CAG | CAF | CAJ | H16 | 180.0° | 178.3° |
| CAG | CAF | CAJ | CAK | 93.7° | 154.5° |
| CAG | CAF | CAJ | H17 | 145.2° | 85.3° |
| CAG | CAF | CAJ | H18 | 27.4° | 34.5° |
| CAL | CAO | CAW | H1 | 120.0° | 119.9° |
| CAL | CAO | CAW | H2 | 120.1° | 120.0° |
| CAL | CAO | CAW | CAN | 108.9° | 82.7° |
| CAL | CAO | CAW | OAE | 128.5° | 37.3° |
| CAL | CAO | H1 | H2 | 119.8° | 120.2° |
| CAO | CAL | H3 | H4 | 118.2° | 120.0° |
| CAO | CAL | CAM | H5 | 89.1° | 60.6° |
| CAO | CAL | CAM | H6 | 30.6° | 59.6° |
| CAL | CAO | CAW | H23 | 9.9° | 157.3° |
| CAF | CAJ | CAK | H17 | 121.1° | 120.2° |
| CAF | CAJ | CAK | H18 | 121.1° | 120.1° |
| CAF | CAJ | CAK | CAN | 65.9° | 78.9° |
| CAJ | CAF | CAG | H15 | 4.1° | 0.6° |
| CAF | CAJ | H17 | H18 | 116.6° | 119.8° |
| CAF | CAJ | CAK | H19 | 54.3° | 41.1° |
| CAF | CAJ | CAK | H20 | 173.8° | 161.1° |
| CAO | CAW | CAN | OAE | 119.7° | 120.0° |
| CAO | CAW | CAN | H23 | 118.8° | 119.9° |
| CAO | CAW | OAE | H23 | 117.6° | 120.0° |
| CAO | CAW | CAN | CAK | 178.9° | 138.9° |
| CAW | CAO | H1 | H2 | 119.8° | 120.0° |
| CAW | CAO | CAL | H3 | 29.9° | 13.6° |
| CAW | CAO | CAL | H4 | 148.7° | 133.5° |
| CAO | CAW | CAN | H21 | 61.3° | 101.0° |
| CAO | CAW | CAN | H22 | 59.1° | 18.9° |
| CAO | CAW | OAE | H24 | 180.0° | 180.0° |
| CAJ | CAK | CAN | CAW | 80.4° | 170.1° |
| CAJ | CAK | CAN | H19 | 120.2° | 120.0° |
| CAJ | CAK | CAN | H20 | 120.3° | 120.0° |
| CAK | CAJ | CAF | H16 | 86.3° | 27.2° |
| CAK | CAJ | H17 | H18 | 116.6° | 119.8° |
| CAJ | CAK | H19 | H20 | 119.3° | 120.0° |
| CAJ | CAK | CAN | H21 | 159.7° | 69.9° |
| CAJ | CAK | CAN | H22 | 39.4° | 50.1° |
| CAN | CAW | OAE | H23 | 120.7° | 120.1° |
| CAW | CAN | CAK | H21 | 119.9° | 120.0° |
| CAW | CAN | CAK | H22 | 119.8° | 120.0° |
| CAN | CAW | CAO | H1 | 131.1° | 37.2° |
| CAN | CAW | CAO | H2 | 11.2° | 157.3° |
| CAW | CAN | CAK | H19 | 159.3° | 50.1° |
| CAW | CAN | CAK | H20 | 39.8° | 69.9° |
| CAW | CAN | H21 | H22 | 120.5° | 119.9° |
| CAN | CAW | OAE | H24 | 58.2° | 60.1° |
| OAE | CAW | CAN | CAK | 61.4° | 19.0° |
| OAE | CAW | CAO | H1 | 8.4° | 157.2° |
| OAE | CAW | CAO | H2 | 111.5° | 82.7° |
| OAE | CAW | CAN | H21 | 58.4° | 139.0° |
| OAE | CAW | CAN | H22 | 178.8° | 101.1° |
| CAN | CAK | CAJ | H17 | 173.0° | 161.0° |
| CAN | CAK | CAJ | H18 | 55.2° | 41.2° |
| CAN | CAK | H19 | H20 | 119.3° | 120.0° |
| CAK | CAN | H21 | H22 | 120.5° | 119.9° |
| CAK | CAN | CAW | H23 | 60.1° | 101.1° |
| H1 | CAO | CAL | H3 | 90.2° | 133.5° |
| H1 | CAO | CAL | H4 | 28.7° | 106.6° |
| H1 | CAO | CAW | H23 | 110.1° | 82.8° |
| H2 | CAO | CAL | H3 | 149.9° | 106.3° |
| H2 | CAO | CAL | H4 | 91.2° | 13.6° |
| H2 | CAO | CAW | H23 | 130.0° | 37.3° |
| H3 | CAL | CAM | H5 | 150.3° | 179.3° |
| H3 | CAL | CAM | H6 | 89.9° | 60.5° |
| H4 | CAL | CAM | H5 | 31.5° | 59.4° |
| H4 | CAL | CAM | H6 | 151.2° | 179.6° |
| H5 | CAM | CAV | H7 | 113.8° | 18.6° |
| H6 | CAM | CAV | H7 | 126.4° | 139.0° |
| H7 | CAV | CAA | H8 | 57.0° | 179.8° |
| H7 | CAV | CAA | H9 | 63.1° | 60.1° |
| H7 | CAV | CAA | H10 | 177.0° | 59.9° |
| H8 | CAA | H9 | H10 | 120.0° | 120.0° |
| H15 | CAG | CAF | H16 | 175.9° | 178.9° |
| H16 | CAF | CAJ | H17 | 34.8° | 93.0° |
| H16 | CAF | CAJ | H18 | 152.6° | 147.2° |
| H17 | CAJ | CAK | H19 | 66.8° | 79.0° |
| H17 | CAJ | CAK | H20 | 52.7° | 41.0° |
| H18 | CAJ | CAK | H19 | 175.4° | 161.2° |
| H18 | CAJ | CAK | H20 | 65.1° | 78.8° |
| H19 | CAK | CAN | H21 | 39.5° | 170.2° |
| H19 | CAK | CAN | H22 | 80.8° | 69.9° |
| H20 | CAK | CAN | H21 | 80.0° | 50.1° |
| H20 | CAK | CAN | H22 | 159.7° | 170.1° |
| H21 | CAN | CAW | H23 | 179.9° | 18.9° |
| H22 | CAN | CAW | H23 | 59.7° | 138.8° |
| H23 | CAW | OAE | H24 | 62.4° | 60.0° |
