VQ8
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O10 | FE5 | sing | 0.00Å | 1.99Å | |
O10 | FE7 | sing | 0.00Å | 1.80Å | |
O8 | FE6 | sing | 0.00Å | 2.03Å | |
O8 | FE8 | sing | 0.00Å | 2.06Å | |
O9 | FE7 | sing | 0.00Å | 2.02Å | |
O9 | FE8 | sing | 0.00Å | 2.01Å | |
S5 | FE5 | sing | 0.00Å | 2.29Å | |
S5 | FE6 | sing | 0.00Å | 2.29Å | |
S6 | FE5 | sing | 0.00Å | 2.30Å | |
S6 | FE6 | sing | 0.00Å | 2.29Å | |
S6 | FE8 | sing | 0.00Å | 2.51Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
FE5 | O10 | FE7 | 159.4° | 90.0° |
O10 | FE5 | S5 | 106.3° | 90.0° |
O10 | FE5 | S6 | 104.8° | 90.0° |
O10 | FE7 | O9 | 87.9° | 90.0° |
FE6 | O8 | FE8 | 93.7° | 90.0° |
O8 | FE6 | S5 | 105.2° | 90.0° |
O8 | FE6 | S6 | 97.9° | 90.0° |
O8 | FE8 | O9 | 89.3° | 90.0° |
O8 | FE8 | S6 | 90.8° | 90.0° |
FE7 | O9 | FE8 | 113.9° | 90.0° |
O9 | FE8 | S6 | 145.1° | 90.0° |
FE5 | S5 | FE6 | 75.1° | 90.0° |
S5 | FE5 | S6 | 103.4° | 90.0° |
S5 | FE6 | S6 | 103.7° | 90.0° |
FE5 | S6 | FE6 | 75.0° | 90.0° |
FE5 | S6 | FE8 | 85.0° | 90.0° |
FE6 | S6 | FE8 | 76.8° | 90.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
FE5 | O10 | FE7 | O9 | 81.4° | 90.0° |
O10 | FE5 | S5 | S6 | 110.1° | 90.0° |
O10 | FE5 | S5 | FE6 | 97.4° | 90.0° |
O10 | FE5 | S6 | FE6 | 98.5° | 90.0° |
O10 | FE5 | S6 | FE8 | 20.9° | 90.0° |
O10 | FE7 | O9 | FE8 | 1.1° | 90.0° |
FE7 | O10 | FE5 | S5 | 6.6° | 90.0° |
FE7 | O10 | FE5 | S6 | 102.5° | 90.0° |
FE6 | O8 | FE8 | O9 | 137.8° | 90.0° |
O8 | FE6 | S5 | FE5 | 89.6° | 90.0° |
O8 | FE6 | S5 | S6 | 102.3° | 90.0° |
O8 | FE6 | S6 | FE5 | 95.2° | 90.0° |
FE6 | O8 | FE8 | S6 | 7.3° | 90.0° |
O8 | FE8 | O9 | FE7 | 98.9° | 90.0° |
O8 | FE8 | O9 | S6 | 90.3° | 90.0° |
FE8 | O8 | FE6 | S5 | 98.5° | 90.0° |
O8 | FE8 | S6 | FE5 | 82.4° | 90.0° |
FE7 | O9 | FE8 | S6 | 8.6° | 90.0° |
O9 | FE8 | S6 | FE5 | 7.4° | 90.0° |
O9 | FE8 | S6 | FE6 | 83.2° | 90.0° |
FE5 | S5 | FE6 | S6 | 12.7° | 90.0° |
S5 | FE5 | S6 | FE8 | 90.3° | 90.0° |
S5 | FE6 | S6 | FE8 | 101.0° | 90.0° |
FE5 | S6 | FE6 | FE8 | 88.3° | 90.0° |