2FT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O01 | C02 | sing | 1.34Å | 1.39Å | |
| C02 | O03 | doub | 1.21Å | 1.19Å | |
| C02 | C04 | sing | 1.51Å | 1.53Å | |
| C04 | C05 | sing | 1.53Å | 1.51Å | |
| C05 | C06 | sing | 1.53Å | 1.53Å | |
| C06 | F07 | sing | 1.40Å | 1.36Å | |
| C06 | F08 | sing | 1.40Å | 1.36Å | |
| C06 | C09 | sing | 1.51Å | 1.53Å | |
| C09 | O10 | doub | 1.21Å | 1.18Å | |
| C09 | O11 | sing | 1.34Å | 1.39Å | |
| O01 | HO01 | sing | 0.97Å | 0.95Å | |
| C04 | H04 | sing | 1.09Å | 1.10Å | |
| C04 | H04A | sing | 1.09Å | 1.10Å | |
| C05 | H05 | sing | 1.09Å | 1.10Å | |
| C05 | H05A | sing | 1.09Å | 1.10Å | |
| O11 | HO11 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C02 | O03 | 115.3° | 120.0° |
| O01 | C02 | C04 | 116.8° | 120.0° |
| C02 | O01 | HO01 | 109.5° | 117.1° |
| O03 | C02 | C04 | 116.8° | 120.0° |
| C02 | C04 | C05 | 114.8° | 109.5° |
| C02 | C04 | H04 | 107.7° | 109.5° |
| C02 | C04 | H04A | 107.7° | 109.5° |
| C04 | C05 | C06 | 105.0° | 109.5° |
| C05 | C04 | H04 | 107.7° | 109.5° |
| C05 | C04 | H04A | 107.7° | 109.5° |
| C04 | C05 | H05 | 111.0° | 109.5° |
| C04 | C05 | H05A | 111.0° | 109.5° |
| C05 | C06 | F07 | 108.9° | 109.5° |
| C05 | C06 | F08 | 108.4° | 109.5° |
| C05 | C06 | C09 | 113.6° | 109.5° |
| C06 | C05 | H05 | 111.0° | 109.5° |
| C06 | C05 | H05A | 111.0° | 109.4° |
| F07 | C06 | F08 | 103.8° | 109.5° |
| F07 | C06 | C09 | 110.1° | 109.5° |
| F08 | C06 | C09 | 111.6° | 109.5° |
| C06 | C09 | O10 | 119.7° | 120.0° |
| C06 | C09 | O11 | 117.6° | 120.0° |
| O10 | C09 | O11 | 120.1° | 120.0° |
| C09 | O11 | HO11 | 109.5° | 117.0° |
| H04 | C04 | H04A | 111.2° | 109.5° |
| H05 | C05 | H05A | 107.9° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C02 | O03 | C04 | 143.1° | 180.0° |
| O01 | C02 | C04 | C05 | 3.8° | 180.0° |
| O01 | C02 | C04 | H04 | 123.8° | 60.0° |
| O01 | C02 | C04 | H04A | 116.2° | 60.0° |
| O03 | C02 | C04 | C05 | 138.7° | 0.0° |
| O03 | C02 | O01 | HO01 | 0.0° | 0.0° |
| O03 | C02 | C04 | H04 | 18.7° | 120.0° |
| O03 | C02 | C04 | H04A | 101.3° | 120.0° |
| C02 | C04 | C05 | H04 | 120.0° | 120.0° |
| C02 | C04 | C05 | H04A | 120.0° | 120.0° |
| C02 | C04 | C05 | C06 | 81.5° | 180.0° |
| C04 | C02 | O01 | HO01 | 143.1° | 180.0° |
| C02 | C04 | H04 | H04A | 117.8° | 120.0° |
| C02 | C04 | C05 | H05 | 38.5° | 60.0° |
| C02 | C04 | C05 | H05A | 158.5° | 60.0° |
| C04 | C05 | C06 | H05 | 120.0° | 120.0° |
| C04 | C05 | C06 | H05A | 120.0° | 120.0° |
| C04 | C05 | C06 | F07 | 53.6° | 60.0° |
| C04 | C05 | C06 | F08 | 58.7° | 60.0° |
| C04 | C05 | C06 | C09 | 176.6° | 180.0° |
| C05 | C04 | H04 | H04A | 117.8° | 120.0° |
| C04 | C05 | H05 | H05A | 121.8° | 120.0° |
| C05 | C06 | F07 | F08 | 115.3° | 120.0° |
| C05 | C06 | F07 | C09 | 125.1° | 120.0° |
| C05 | C06 | F08 | C09 | 125.8° | 120.0° |
| C05 | C06 | C09 | O10 | 74.5° | 25.0° |
| C05 | C06 | C09 | O11 | 123.7° | 155.0° |
| C06 | C05 | C04 | H04 | 158.5° | 60.0° |
| C06 | C05 | C04 | H04A | 38.5° | 60.0° |
| C06 | C05 | H05 | H05A | 121.8° | 120.0° |
| F07 | C06 | F08 | C09 | 118.5° | 120.0° |
| F07 | C06 | C09 | O10 | 47.9° | 95.0° |
| F07 | C06 | C09 | O11 | 113.9° | 85.0° |
| F07 | C06 | C05 | H05 | 66.4° | 180.0° |
| F07 | C06 | C05 | H05A | 173.5° | 60.0° |
| F08 | C06 | C09 | O10 | 162.5° | 145.0° |
| F08 | C06 | C09 | O11 | 0.7° | 35.0° |
| F08 | C06 | C05 | H05 | 178.7° | 60.0° |
| F08 | C06 | C05 | H05A | 61.3° | 180.0° |
| C06 | C09 | O10 | O11 | 161.3° | 180.0° |
| C09 | C06 | C05 | H05 | 56.6° | 60.0° |
| C09 | C06 | C05 | H05A | 63.4° | 60.0° |
| C06 | C09 | O11 | HO11 | 161.7° | 180.0° |
| O10 | C09 | O11 | HO11 | 0.0° | 0.1° |
| H04 | C04 | C05 | H05 | 81.5° | 180.0° |
| H04 | C04 | C05 | H05A | 38.5° | 60.0° |
| H04A | C04 | C05 | H05 | 158.5° | 60.0° |
| H04A | C04 | C05 | H05A | 81.5° | 180.0° |
