TF8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O07 | C01 | doub | 1.21Å | 1.28Å | |
| O08 | C02 | sing | 1.43Å | 1.39Å | |
| C01 | C02 | sing | 1.51Å | 1.53Å | |
| C01 | O12 | sing | 1.34Å | 1.27Å | |
| O09 | C03 | sing | 1.43Å | 1.41Å | |
| C02 | C03 | sing | 1.53Å | 1.53Å | |
| C03 | C04 | sing | 1.53Å | 1.56Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C04 | O10 | sing | 1.43Å | 1.39Å | |
| C05 | C06 | sing | 1.53Å | 1.56Å | |
| C05 | O11 | sing | 1.43Å | 1.42Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H063 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| O08 | H081 | sing | 0.97Å | 0.95Å | |
| O09 | H091 | sing | 0.97Å | 0.95Å | |
| O10 | H101 | sing | 0.97Å | 0.95Å | |
| O11 | H111 | sing | 0.97Å | 0.95Å | |
| O12 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O07 | C01 | C02 | 116.4° | 120.0° |
| O07 | C01 | O12 | 120.9° | 120.0° |
| O08 | C02 | C01 | 108.0° | 109.5° |
| O08 | C02 | C03 | 119.3° | 109.4° |
| O08 | C02 | H021 | 110.5° | 109.4° |
| C02 | O08 | H081 | 109.5° | 114.0° |
| C02 | C01 | O12 | 122.6° | 120.0° |
| C01 | C02 | C03 | 101.3° | 109.5° |
| C01 | C02 | H021 | 108.6° | 109.5° |
| C01 | O12 | H1 | 109.5° | 117.0° |
| O09 | C03 | C02 | 106.5° | 109.5° |
| O09 | C03 | C04 | 112.2° | 109.5° |
| O09 | C03 | H031 | 108.1° | 109.4° |
| C03 | O09 | H091 | 109.5° | 114.0° |
| C02 | C03 | C04 | 116.5° | 109.5° |
| C03 | C02 | H021 | 108.5° | 109.5° |
| C02 | C03 | H031 | 106.7° | 109.5° |
| C03 | C04 | C05 | 108.0° | 109.5° |
| C03 | C04 | O10 | 103.3° | 109.5° |
| C04 | C03 | H031 | 106.4° | 109.5° |
| C03 | C04 | H041 | 108.4° | 109.5° |
| C05 | C04 | O10 | 117.2° | 109.5° |
| C04 | C05 | C06 | 109.2° | 109.4° |
| C04 | C05 | O11 | 118.5° | 109.4° |
| C05 | C04 | H041 | 108.8° | 109.5° |
| C04 | C05 | H051 | 107.8° | 109.5° |
| O10 | C04 | H041 | 110.7° | 109.5° |
| C04 | O10 | H101 | 109.5° | 114.0° |
| C06 | C05 | O11 | 104.3° | 109.5° |
| C06 | C05 | H051 | 107.4° | 109.5° |
| C05 | C06 | H063 | 109.5° | 109.5° |
| C05 | C06 | H061 | 109.5° | 109.5° |
| C05 | C06 | H062 | 109.5° | 109.5° |
| O11 | C05 | H051 | 109.2° | 109.5° |
| C05 | O11 | H111 | 109.5° | 113.9° |
| H063 | C06 | H061 | 109.5° | 109.4° |
| H063 | C06 | H062 | 109.5° | 109.5° |
| H061 | C06 | H062 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O07 | C01 | C02 | O08 | 17.1° | 5.3° |
| O07 | C01 | C02 | O12 | 177.2° | 179.7° |
| O07 | C01 | C02 | C03 | 108.9° | 114.7° |
| O07 | C01 | C02 | H021 | 137.0° | 125.3° |
| O07 | C01 | O12 | H1 | 0.0° | 0.3° |
| O08 | C02 | C01 | C03 | 126.1° | 120.0° |
| O08 | C02 | C01 | H021 | 119.8° | 120.0° |
| O08 | C02 | C01 | O12 | 165.7° | 175.0° |
| O08 | C02 | C03 | O09 | 30.2° | 65.1° |
| O08 | C02 | C03 | H021 | 127.6° | 119.9° |
| O08 | C02 | C03 | C04 | 95.9° | 55.0° |
| O08 | C02 | C03 | H031 | 145.5° | 175.0° |
| C01 | C02 | C03 | O09 | 88.0° | 54.9° |
| C01 | C02 | C03 | H021 | 114.1° | 120.1° |
| C01 | C02 | C03 | C04 | 145.8° | 175.0° |
| C01 | C02 | C03 | H031 | 27.3° | 65.0° |
| C01 | C02 | O08 | H081 | 8.3° | 60.0° |
| C02 | C01 | O12 | H1 | 177.1° | 180.0° |
| O12 | C01 | C02 | C03 | 68.2° | 65.0° |
| O12 | C01 | C02 | H021 | 45.9° | 55.0° |
| O09 | C03 | C02 | C04 | 126.1° | 120.0° |
| O09 | C03 | C02 | H031 | 115.3° | 119.9° |
| O09 | C03 | C04 | H031 | 118.0° | 119.9° |
| O09 | C03 | C04 | C05 | 52.1° | 60.0° |
| O09 | C03 | C04 | O10 | 176.8° | 180.0° |
| O09 | C03 | C02 | H021 | 157.8° | 175.0° |
| O09 | C03 | C04 | H041 | 65.7° | 60.0° |
| C02 | C03 | C04 | H031 | 118.7° | 120.0° |
| C02 | C03 | C04 | C05 | 175.3° | 180.0° |
| C02 | C03 | C04 | O10 | 60.0° | 60.0° |
| C02 | C03 | C04 | H041 | 57.6° | 60.0° |
| C03 | C02 | O08 | H081 | 106.4° | 60.0° |
| C02 | C03 | O09 | H091 | 180.0° | 60.0° |
| C03 | C04 | C05 | O10 | 116.0° | 120.0° |
| C03 | C04 | C05 | H041 | 117.5° | 120.0° |
| C03 | C04 | O10 | H041 | 115.9° | 120.0° |
| C03 | C04 | C05 | C06 | 86.1° | 180.0° |
| C03 | C04 | C05 | O11 | 154.8° | 60.0° |
| C04 | C03 | C02 | H021 | 31.7° | 65.0° |
| C03 | C04 | C05 | H051 | 30.2° | 60.0° |
| C04 | C03 | O09 | H091 | 51.3° | 60.0° |
| C03 | C04 | O10 | H101 | 180.0° | 60.0° |
| C05 | C04 | O10 | H041 | 125.6° | 120.0° |
| C04 | C05 | C06 | O11 | 127.5° | 120.0° |
| C04 | C05 | C06 | H051 | 116.6° | 120.0° |
| C04 | C05 | O11 | H051 | 123.8° | 120.0° |
| C05 | C04 | C03 | H031 | 66.0° | 60.0° |
| C04 | C05 | C06 | H063 | 180.0° | 180.0° |
| C04 | C05 | C06 | H061 | 60.0° | 60.0° |
| C04 | C05 | C06 | H062 | 60.0° | 60.0° |
| C05 | C04 | O10 | H101 | 61.4° | 60.0° |
| C04 | C05 | O11 | H111 | 180.0° | 180.0° |
| O10 | C04 | C05 | C06 | 29.9° | 60.0° |
| O10 | C04 | C05 | O11 | 89.2° | 180.0° |
| O10 | C04 | C03 | H031 | 58.8° | 60.0° |
| O10 | C04 | C05 | H051 | 146.2° | 60.0° |
| C06 | C05 | O11 | H051 | 114.5° | 120.0° |
| C06 | C05 | C04 | H041 | 156.4° | 60.0° |
| C05 | C06 | H063 | H061 | 120.0° | 120.0° |
| C05 | C06 | H063 | H062 | 120.0° | 120.0° |
| C05 | C06 | H061 | H062 | 120.0° | 120.0° |
| C06 | C05 | O11 | H111 | 58.4° | 60.0° |
| O11 | C05 | C04 | H041 | 37.3° | 60.0° |
| O11 | C05 | C06 | H063 | 52.5° | 60.0° |
| O11 | C05 | C06 | H061 | 67.6° | 59.9° |
| O11 | C05 | C06 | H062 | 172.5° | 179.9° |
| H021 | C02 | C03 | H031 | 86.9° | 55.1° |
| H021 | C02 | O08 | H081 | 126.9° | 180.0° |
| H031 | C03 | C04 | H041 | 176.3° | 179.9° |
| H031 | C03 | O09 | H091 | 65.7° | 180.0° |
| H041 | C04 | C05 | H051 | 87.3° | NaN° |
| H041 | C04 | O10 | H101 | 64.2° | 180.0° |
| H051 | C05 | C06 | H063 | 63.4° | 60.1° |
| H051 | C05 | C06 | H061 | 176.6° | NaN° |
| H051 | C05 | C06 | H062 | 56.6° | 60.0° |
| H051 | C05 | O11 | H111 | 56.1° | 60.0° |
| H063 | C06 | H061 | H062 | 120.0° | 120.0° |
