G4X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAD | CAE | sing | 1.53Å | 1.55Å | |
| CAD | CAC | sing | 1.53Å | 1.55Å | |
| CAE | CAF | sing | 1.53Å | 1.53Å | |
| CAB | CAC | sing | 1.53Å | 1.55Å | |
| CAB | CAA | sing | 1.53Å | 1.50Å | |
| CAF | CAG | sing | 1.53Å | 1.53Å | |
| CAG | CAH | sing | 1.53Å | 1.50Å | |
| CAH | CAI | sing | 1.53Å | 1.52Å | |
| CAI | CAJ | sing | 1.53Å | 1.50Å | |
| CAJ | CAK | sing | 1.53Å | 1.51Å | |
| SAQ | CAP | doub | 1.60Å | 1.63Å | |
| CAM | CAN | sing | 1.53Å | 1.52Å | |
| CAM | CAL | sing | 1.53Å | 1.51Å | |
| CAK | CAL | sing | 1.53Å | 1.52Å | |
| CAO | CAN | sing | 1.53Å | 1.50Å | |
| CAO | CAP | sing | 1.51Å | 1.49Å | |
| CAP | H1 | sing | 1.08Å | 1.08Å | |
| CAO | H2 | sing | 1.09Å | 1.10Å | |
| CAO | H3 | sing | 1.09Å | 1.10Å | |
| CAN | H4 | sing | 1.09Å | 1.10Å | |
| CAN | H5 | sing | 1.09Å | 1.10Å | |
| CAM | H6 | sing | 1.09Å | 1.10Å | |
| CAM | H7 | sing | 1.09Å | 1.10Å | |
| CAL | H8 | sing | 1.09Å | 1.10Å | |
| CAL | H9 | sing | 1.09Å | 1.10Å | |
| CAK | H10 | sing | 1.09Å | 1.10Å | |
| CAK | H11 | sing | 1.09Å | 1.10Å | |
| CAJ | H12 | sing | 1.09Å | 1.10Å | |
| CAJ | H13 | sing | 1.09Å | 1.10Å | |
| CAI | H14 | sing | 1.09Å | 1.10Å | |
| CAI | H15 | sing | 1.09Å | 1.10Å | |
| CAH | H16 | sing | 1.09Å | 1.10Å | |
| CAH | H17 | sing | 1.09Å | 1.10Å | |
| CAG | H18 | sing | 1.09Å | 1.10Å | |
| CAG | H19 | sing | 1.09Å | 1.10Å | |
| CAF | H20 | sing | 1.09Å | 1.10Å | |
| CAF | H21 | sing | 1.09Å | 1.10Å | |
| CAE | H22 | sing | 1.09Å | 1.10Å | |
| CAE | H23 | sing | 1.09Å | 1.10Å | |
| CAD | H24 | sing | 1.09Å | 1.10Å | |
| CAD | H25 | sing | 1.09Å | 1.10Å | |
| CAC | H26 | sing | 1.09Å | 1.10Å | |
| CAC | H27 | sing | 1.09Å | 1.10Å | |
| CAB | H28 | sing | 1.09Å | 1.10Å | |
| CAB | H29 | sing | 1.09Å | 1.10Å | |
| CAA | H30 | sing | 1.09Å | 1.10Å | |
| CAA | H31 | sing | 1.09Å | 1.10Å | |
| CAA | H32 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAE | CAD | CAC | 107.1° | 109.5° |
| CAD | CAE | CAF | 111.7° | 109.5° |
| CAD | CAE | H22 | 108.9° | 109.5° |
| CAD | CAE | H23 | 108.9° | 109.5° |
| CAE | CAD | H24 | 110.1° | 109.4° |
| CAE | CAD | H25 | 110.1° | 109.5° |
| CAD | CAC | CAB | 107.5° | 109.5° |
| CAC | CAD | H24 | 110.1° | 109.5° |
| CAC | CAD | H25 | 110.1° | 109.5° |
| CAD | CAC | H26 | 110.0° | 109.4° |
| CAD | CAC | H27 | 110.0° | 109.5° |
| CAE | CAF | CAG | 104.9° | 109.5° |
| CAE | CAF | H20 | 110.6° | 109.4° |
| CAE | CAF | H21 | 110.6° | 109.5° |
| CAF | CAE | H22 | 108.9° | 109.5° |
| CAF | CAE | H23 | 108.9° | 109.5° |
| CAC | CAB | CAA | 113.2° | 109.5° |
| CAB | CAC | H26 | 109.9° | 109.4° |
| CAB | CAC | H27 | 110.0° | 109.5° |
| CAC | CAB | H28 | 108.5° | 109.5° |
| CAC | CAB | H29 | 108.5° | 109.5° |
| CAA | CAB | H28 | 108.5° | 109.5° |
| CAA | CAB | H29 | 108.5° | 109.5° |
| CAB | CAA | H30 | 109.5° | 109.4° |
| CAB | CAA | H31 | 109.4° | 109.5° |
| CAB | CAA | H32 | 109.5° | 109.4° |
| CAF | CAG | CAH | 107.0° | 109.5° |
| CAF | CAG | H18 | 110.1° | 109.5° |
| CAF | CAG | H19 | 110.1° | 109.5° |
| CAG | CAF | H20 | 110.6° | 109.4° |
| CAG | CAF | H21 | 110.6° | 109.5° |
| CAG | CAH | CAI | 103.4° | 109.5° |
| CAG | CAH | H16 | 111.0° | 109.4° |
| CAG | CAH | H17 | 111.0° | 109.5° |
| CAH | CAG | H18 | 110.1° | 109.4° |
| CAH | CAG | H19 | 110.1° | 109.5° |
| CAH | CAI | CAJ | 106.2° | 109.5° |
| CAH | CAI | H14 | 110.3° | 109.5° |
| CAH | CAI | H15 | 110.3° | 109.4° |
| CAI | CAH | H16 | 111.0° | 109.4° |
| CAI | CAH | H17 | 110.9° | 109.4° |
| CAI | CAJ | CAK | 102.7° | 109.5° |
| CAI | CAJ | H12 | 111.1° | 109.5° |
| CAI | CAJ | H13 | 111.1° | 109.5° |
| CAJ | CAI | H14 | 110.3° | 109.5° |
| CAJ | CAI | H15 | 110.3° | 109.5° |
| CAJ | CAK | CAL | 105.5° | 109.5° |
| CAJ | CAK | H10 | 110.5° | 109.5° |
| CAJ | CAK | H11 | 110.5° | 109.4° |
| CAK | CAJ | H12 | 111.2° | 109.4° |
| CAK | CAJ | H13 | 111.1° | 109.4° |
| SAQ | CAP | CAO | 117.5° | 120.0° |
| SAQ | CAP | H1 | 121.2° | 120.0° |
| CAN | CAM | CAL | 105.8° | 109.5° |
| CAM | CAN | CAO | 102.9° | 109.5° |
| CAM | CAN | H4 | 111.1° | 109.5° |
| CAM | CAN | H5 | 111.1° | 109.5° |
| CAN | CAM | H6 | 110.4° | 109.5° |
| CAN | CAM | H7 | 110.4° | 109.5° |
| CAM | CAL | CAK | 105.2° | 109.5° |
| CAL | CAM | H6 | 110.4° | 109.5° |
| CAL | CAM | H7 | 110.4° | 109.4° |
| CAM | CAL | H8 | 110.5° | 109.5° |
| CAM | CAL | H9 | 110.5° | 109.4° |
| CAK | CAL | H8 | 110.5° | 109.5° |
| CAK | CAL | H9 | 110.5° | 109.5° |
| CAL | CAK | H10 | 110.4° | 109.5° |
| CAL | CAK | H11 | 110.5° | 109.5° |
| CAN | CAO | CAP | 105.4° | 109.4° |
| CAN | CAO | H2 | 110.5° | 109.5° |
| CAN | CAO | H3 | 110.5° | 109.4° |
| CAO | CAN | H4 | 111.1° | 109.5° |
| CAO | CAN | H5 | 111.1° | 109.4° |
| CAO | CAP | H1 | 121.2° | 120.0° |
| CAP | CAO | H2 | 110.5° | 109.5° |
| CAP | CAO | H3 | 110.5° | 109.5° |
| H2 | CAO | H3 | 109.5° | 109.5° |
| H4 | CAN | H5 | 109.4° | 109.5° |
| H6 | CAM | H7 | 109.5° | 109.5° |
| H8 | CAL | H9 | 109.5° | 109.5° |
| H10 | CAK | H11 | 109.5° | 109.5° |
| H12 | CAJ | H13 | 109.5° | 109.5° |
| H14 | CAI | H15 | 109.5° | 109.5° |
| H16 | CAH | H17 | 109.5° | 109.5° |
| H18 | CAG | H19 | 109.5° | 109.5° |
| H20 | CAF | H21 | 109.5° | 109.5° |
| H22 | CAE | H23 | 109.5° | 109.4° |
| H24 | CAD | H25 | 109.5° | 109.5° |
| H26 | CAC | H27 | 109.5° | 109.5° |
| H28 | CAB | H29 | 109.5° | 109.5° |
| H30 | CAA | H31 | 109.5° | 109.5° |
| H30 | CAA | H32 | 109.5° | 109.5° |
| H31 | CAA | H32 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAE | CAD | CAC | H24 | 119.6° | 120.0° |
| CAE | CAD | CAC | H25 | 119.6° | 120.0° |
| CAD | CAE | CAF | H22 | 120.3° | 120.0° |
| CAD | CAE | CAF | H23 | 120.4° | 120.1° |
| CAE | CAD | CAC | CAB | 147.6° | 180.0° |
| CAD | CAE | CAF | CAG | 109.8° | 180.0° |
| CAD | CAE | CAF | H20 | 9.5° | 60.1° |
| CAD | CAE | CAF | H21 | 130.9° | 60.0° |
| CAD | CAE | H22 | H23 | 119.0° | 120.0° |
| CAE | CAD | H24 | H25 | 121.1° | 120.0° |
| CAE | CAD | CAC | H26 | 92.7° | 60.1° |
| CAE | CAD | CAC | H27 | 27.9° | 60.0° |
| CAC | CAD | CAE | CAF | 90.0° | 180.0° |
| CAD | CAC | CAB | H26 | 119.7° | 120.0° |
| CAD | CAC | CAB | H27 | 119.7° | 120.0° |
| CAD | CAC | CAB | CAA | 159.4° | 180.0° |
| CAC | CAD | CAE | H22 | 149.7° | 60.0° |
| CAC | CAD | CAE | H23 | 30.3° | 59.9° |
| CAC | CAD | H24 | H25 | 121.1° | 120.0° |
| CAD | CAC | H26 | H27 | 120.9° | 120.0° |
| CAD | CAC | CAB | H28 | 80.0° | 60.0° |
| CAD | CAC | CAB | H29 | 38.9° | 60.0° |
| CAE | CAF | CAG | H20 | 119.3° | 120.0° |
| CAE | CAF | CAG | H21 | 119.3° | 120.0° |
| CAE | CAF | CAG | CAH | 170.9° | 180.0° |
| CAE | CAF | CAG | H18 | 69.4° | 60.0° |
| CAE | CAF | CAG | H19 | 51.3° | 60.0° |
| CAE | CAF | H20 | H21 | 122.1° | 120.0° |
| CAF | CAE | H22 | H23 | 118.9° | 120.0° |
| CAF | CAE | CAD | H24 | 150.4° | 60.0° |
| CAF | CAE | CAD | H25 | 29.6° | 60.0° |
| CAC | CAB | CAA | H28 | 120.6° | 120.0° |
| CAC | CAB | CAA | H29 | 120.5° | 120.0° |
| CAB | CAC | CAD | H24 | 28.0° | 60.0° |
| CAB | CAC | CAD | H25 | 92.8° | 60.0° |
| CAB | CAC | H26 | H27 | 120.9° | 120.0° |
| CAC | CAB | H28 | H29 | 118.3° | 120.0° |
| CAC | CAB | CAA | H30 | 180.0° | 60.0° |
| CAC | CAB | CAA | H31 | 60.0° | 60.0° |
| CAC | CAB | CAA | H32 | 60.0° | 180.0° |
| CAA | CAB | CAC | H26 | 39.7° | 60.0° |
| CAA | CAB | CAC | H27 | 80.8° | 60.0° |
| CAA | CAB | H28 | H29 | 118.3° | 120.0° |
| CAB | CAA | H30 | H31 | 120.0° | 120.0° |
| CAB | CAA | H30 | H32 | 120.0° | 120.0° |
| CAB | CAA | H31 | H32 | 120.0° | 120.0° |
| CAF | CAG | CAH | H18 | 119.6° | 120.0° |
| CAF | CAG | CAH | H19 | 119.6° | 120.0° |
| CAF | CAG | CAH | CAI | 99.1° | 180.0° |
| CAF | CAG | CAH | H16 | 19.9° | 60.0° |
| CAF | CAG | CAH | H17 | 141.9° | 60.0° |
| CAF | CAG | H18 | H19 | 121.2° | 120.1° |
| CAG | CAF | H20 | H21 | 122.1° | 120.0° |
| CAG | CAF | CAE | H22 | 129.9° | 60.0° |
| CAG | CAF | CAE | H23 | 10.6° | 59.9° |
| CAG | CAH | CAI | H16 | 119.0° | 120.0° |
| CAG | CAH | CAI | H17 | 119.0° | 120.0° |
| CAG | CAH | CAI | CAJ | 178.9° | 180.0° |
| CAG | CAH | CAI | H14 | 61.6° | 60.0° |
| CAG | CAH | CAI | H15 | 59.4° | 60.0° |
| CAG | CAH | H16 | H17 | 122.8° | 120.1° |
| CAH | CAG | H18 | H19 | 121.1° | 120.0° |
| CAH | CAG | CAF | H20 | 51.7° | 60.0° |
| CAH | CAG | CAF | H21 | 69.8° | 60.0° |
| CAH | CAI | CAJ | H14 | 119.5° | 120.0° |
| CAH | CAI | CAJ | H15 | 119.5° | 120.0° |
| CAH | CAI | CAJ | CAK | 156.3° | 180.0° |
| CAH | CAI | CAJ | H12 | 84.8° | 60.1° |
| CAH | CAI | CAJ | H13 | 37.4° | 60.0° |
| CAH | CAI | H14 | H15 | 121.5° | 119.9° |
| CAI | CAH | H16 | H17 | 122.8° | 120.0° |
| CAI | CAH | CAG | H18 | 141.3° | 60.0° |
| CAI | CAH | CAG | H19 | 20.5° | 60.0° |
| CAI | CAJ | CAK | H12 | 118.9° | 120.0° |
| CAI | CAJ | CAK | H13 | 118.9° | 120.0° |
| CAI | CAJ | CAK | CAL | 156.9° | 180.0° |
| CAI | CAJ | CAK | H10 | 83.7° | 60.0° |
| CAI | CAJ | CAK | H11 | 37.5° | 60.0° |
| CAI | CAJ | H12 | H13 | 123.1° | 120.1° |
| CAJ | CAI | H14 | H15 | 121.5° | 120.1° |
| CAJ | CAI | CAH | H16 | 59.9° | 60.0° |
| CAJ | CAI | CAH | H17 | 62.0° | 60.0° |
| CAJ | CAK | CAL | CAM | 95.8° | 180.0° |
| CAJ | CAK | CAL | H10 | 119.4° | 120.0° |
| CAJ | CAK | CAL | H11 | 119.4° | 120.0° |
| CAJ | CAK | CAL | H8 | 144.8° | 60.0° |
| CAJ | CAK | CAL | H9 | 23.5° | 60.0° |
| CAJ | CAK | H10 | H11 | 121.8° | 119.9° |
| CAK | CAJ | H12 | H13 | 123.1° | 120.0° |
| CAK | CAJ | CAI | H14 | 36.8° | 60.0° |
| CAK | CAJ | CAI | H15 | 84.2° | 60.0° |
| SAQ | CAP | CAO | CAN | 84.3° | 125.0° |
| SAQ | CAP | CAO | H1 | 180.0° | 179.8° |
| SAQ | CAP | CAO | H2 | 156.4° | 115.0° |
| SAQ | CAP | CAO | H3 | 35.0° | 5.1° |
| CAN | CAM | CAL | H6 | 119.4° | 120.0° |
| CAN | CAM | CAL | H7 | 119.4° | 120.0° |
| CAN | CAM | CAL | CAK | 171.7° | 180.0° |
| CAM | CAN | CAO | H4 | 119.0° | 120.0° |
| CAM | CAN | CAO | H5 | 118.9° | 120.0° |
| CAM | CAN | CAO | CAP | 165.8° | 180.0° |
| CAM | CAN | CAO | H2 | 74.9° | 60.0° |
| CAM | CAN | CAO | H3 | 46.4° | 60.0° |
| CAM | CAN | H4 | H5 | 123.0° | 120.0° |
| CAN | CAM | H6 | H7 | 121.7° | 120.0° |
| CAN | CAM | CAL | H8 | 52.4° | 60.0° |
| CAN | CAM | CAL | H9 | 69.0° | 60.0° |
| CAM | CAL | CAK | H8 | 119.3° | 120.0° |
| CAM | CAL | CAK | H9 | 119.3° | 119.9° |
| CAL | CAM | CAN | CAO | 138.0° | 180.0° |
| CAL | CAM | CAN | H4 | 103.1° | 60.0° |
| CAL | CAM | CAN | H5 | 19.0° | 60.1° |
| CAL | CAM | H6 | H7 | 121.7° | 119.9° |
| CAM | CAL | H8 | H9 | 122.0° | 119.9° |
| CAM | CAL | CAK | H10 | 144.8° | 60.0° |
| CAM | CAL | CAK | H11 | 23.5° | 60.1° |
| CAK | CAL | CAM | H6 | 68.9° | 60.0° |
| CAK | CAL | CAM | H7 | 52.3° | 60.0° |
| CAK | CAL | H8 | H9 | 122.0° | 120.0° |
| CAL | CAK | H10 | H11 | 121.8° | 120.0° |
| CAL | CAK | CAJ | H12 | 38.0° | 60.0° |
| CAL | CAK | CAJ | H13 | 84.2° | 60.0° |
| CAN | CAO | CAP | H2 | 119.3° | 120.0° |
| CAN | CAO | CAP | H3 | 119.4° | 119.9° |
| CAN | CAO | CAP | H1 | 95.7° | 54.8° |
| CAN | CAO | H2 | H3 | 121.9° | 119.9° |
| CAO | CAN | H4 | H5 | 123.1° | 119.9° |
| CAO | CAN | CAM | H6 | 102.6° | 60.0° |
| CAO | CAN | CAM | H7 | 18.6° | 60.1° |
| CAP | CAO | H2 | H3 | 121.9° | 120.1° |
| CAP | CAO | CAN | H4 | 46.8° | 59.9° |
| CAP | CAO | CAN | H5 | 75.3° | 60.0° |
| H1 | CAP | CAO | H2 | 23.6° | 65.2° |
| H1 | CAP | CAO | H3 | 144.9° | 174.7° |
| H2 | CAO | CAN | H4 | 166.1° | 180.0° |
| H2 | CAO | CAN | H5 | 44.0° | 60.0° |
| H3 | CAO | CAN | H4 | 72.6° | 60.0° |
| H3 | CAO | CAN | H5 | 165.3° | 180.0° |
| H4 | CAN | CAM | H6 | 16.3° | 180.0° |
| H4 | CAN | CAM | H7 | 137.5° | 60.0° |
| H5 | CAN | CAM | H6 | 138.4° | 59.9° |
| H5 | CAN | CAM | H7 | 100.4° | 180.0° |
| H6 | CAM | CAL | H8 | 171.8° | 180.0° |
| H6 | CAM | CAL | H9 | 50.5° | 60.0° |
| H7 | CAM | CAL | H8 | 67.0° | 60.0° |
| H7 | CAM | CAL | H9 | 171.6° | 180.0° |
| H8 | CAL | CAK | H10 | 25.4° | 180.0° |
| H8 | CAL | CAK | H11 | 95.8° | 60.0° |
| H9 | CAL | CAK | H10 | 95.9° | 59.9° |
| H9 | CAL | CAK | H11 | 142.9° | 180.0° |
| H10 | CAK | CAJ | H12 | 157.4° | 180.0° |
| H10 | CAK | CAJ | H13 | 35.2° | 60.0° |
| H11 | CAK | CAJ | H12 | 81.4° | 60.0° |
| H11 | CAK | CAJ | H13 | 156.4° | 180.0° |
| H12 | CAJ | CAI | H14 | 155.8° | 180.0° |
| H12 | CAJ | CAI | H15 | 34.7° | 59.9° |
| H13 | CAJ | CAI | H14 | 82.1° | 60.0° |
| H13 | CAJ | CAI | H15 | 156.9° | NaN° |
| H14 | CAI | CAH | H16 | 179.4° | 180.0° |
| H14 | CAI | CAH | H17 | 57.4° | 60.0° |
| H15 | CAI | CAH | H16 | 59.6° | 60.0° |
| H15 | CAI | CAH | H17 | 178.5° | 180.0° |
| H16 | CAH | CAG | H18 | 99.7° | 179.9° |
| H16 | CAH | CAG | H19 | 139.5° | 60.0° |
| H17 | CAH | CAG | H18 | 22.3° | 60.0° |
| H17 | CAH | CAG | H19 | 98.5° | 180.0° |
| H18 | CAG | CAF | H20 | 171.3° | 180.0° |
| H18 | CAG | CAF | H21 | 49.9° | 60.0° |
| H19 | CAG | CAF | H20 | 67.9° | 60.0° |
| H19 | CAG | CAF | H21 | 170.6° | 180.0° |
| H20 | CAF | CAE | H22 | 110.9° | 179.9° |
| H20 | CAF | CAE | H23 | 129.8° | 60.0° |
| H21 | CAF | CAE | H22 | 10.6° | 60.0° |
| H21 | CAF | CAE | H23 | 108.8° | 180.0° |
| H22 | CAE | CAD | H24 | 30.1° | 180.0° |
| H22 | CAE | CAD | H25 | 90.7° | 60.0° |
| H23 | CAE | CAD | H24 | 89.3° | 60.1° |
| H23 | CAE | CAD | H25 | 150.0° | 180.0° |
| H24 | CAD | CAC | H26 | 147.7° | 180.0° |
| H24 | CAD | CAC | H27 | 91.7° | 60.0° |
| H25 | CAD | CAC | H26 | 26.9° | 60.0° |
| H25 | CAD | CAC | H27 | 147.5° | NaN° |
| H26 | CAC | CAB | H28 | 160.3° | 180.0° |
| H26 | CAC | CAB | H29 | 80.8° | 60.0° |
| H27 | CAC | CAB | H28 | 39.7° | 60.0° |
| H27 | CAC | CAB | H29 | 158.6° | 180.0° |
| H28 | CAB | CAA | H30 | 59.4° | 180.0° |
| H28 | CAB | CAA | H31 | 179.4° | 60.0° |
| H28 | CAB | CAA | H32 | 60.6° | 60.0° |
| H29 | CAB | CAA | H30 | 59.5° | 60.0° |
| H29 | CAB | CAA | H31 | 60.5° | 180.0° |
| H29 | CAB | CAA | H32 | 179.5° | 60.0° |
| H30 | CAA | H31 | H32 | 120.0° | 120.0° |
