ZKP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | S1 | sing | 0.00Å | 1.48Å | |
| S1 | FE3 | sing | 0.00Å | 2.23Å | |
| S1 | FE7 | sing | 0.00Å | 2.27Å | |
| S4 | FE3 | sing | 0.00Å | 2.28Å | |
| S4 | FE6 | sing | 0.00Å | 2.23Å | |
| S5 | FE3 | sing | 0.00Å | 2.27Å | |
| S5 | FE6 | sing | 0.00Å | 2.32Å | |
| S5 | FE7 | sing | 0.00Å | 2.26Å | |
| S8 | FE6 | sing | 0.00Å | 2.24Å | |
| S8 | FE7 | sing | 0.00Å | 2.27Å | |
| C2 | H1 | sing | 0.00Å | 1.10Å | |
| C2 | H2 | sing | 0.00Å | 1.10Å | |
| C2 | H3 | sing | 0.00Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | S1 | FE3 | 77.0° | 90.0° |
| C2 | S1 | FE7 | 78.0° | 90.0° |
| S1 | C2 | H1 | 109.5° | 90.0° |
| S1 | C2 | H2 | 109.5° | 90.0° |
| S1 | C2 | H3 | 109.5° | 90.0° |
| FE3 | S1 | FE7 | 75.0° | 90.0° |
| S1 | FE3 | S4 | 111.4° | 90.0° |
| S1 | FE3 | S5 | 103.0° | 90.0° |
| S1 | FE7 | S5 | 102.0° | 90.0° |
| S1 | FE7 | S8 | 110.5° | 90.0° |
| FE3 | S4 | FE6 | 73.1° | 90.0° |
| S4 | FE3 | S5 | 103.6° | 90.0° |
| S4 | FE6 | S5 | 103.6° | 90.0° |
| S4 | FE6 | S8 | 117.5° | 90.0° |
| FE3 | S5 | FE6 | 71.5° | 90.0° |
| FE3 | S5 | FE7 | 74.3° | 90.0° |
| FE6 | S5 | FE7 | 72.5° | 90.0° |
| S5 | FE6 | S8 | 102.3° | 90.0° |
| S5 | FE7 | S8 | 103.2° | 90.0° |
| FE6 | S8 | FE7 | 73.7° | 90.0° |
| H1 | C2 | H2 | 109.5° | 90.0° |
| H1 | C2 | H3 | 109.5° | 90.0° |
| H2 | C2 | H3 | 109.5° | 90.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | S1 | FE3 | FE7 | 80.9° | 90.0° |
| C2 | S1 | FE3 | S4 | 11.4° | 90.0° |
| C2 | S1 | FE3 | S5 | 99.2° | 90.0° |
| C2 | S1 | FE7 | S5 | 97.9° | 90.0° |
| C2 | S1 | FE7 | S8 | 11.3° | 90.0° |
| S1 | C2 | H1 | H2 | 120.0° | 90.0° |
| S1 | C2 | H1 | H3 | 120.0° | 90.0° |
| S1 | C2 | H2 | H3 | 120.0° | 90.0° |
| S1 | FE3 | S4 | S5 | 110.1° | 90.0° |
| S1 | FE3 | S4 | FE6 | 88.0° | 90.0° |
| S1 | FE3 | S5 | FE6 | 94.8° | 90.0° |
| FE3 | S1 | FE7 | S5 | 18.3° | 90.0° |
| FE3 | S1 | FE7 | S8 | 90.9° | 90.0° |
| FE3 | S1 | C2 | H1 | 180.0° | 90.0° |
| FE3 | S1 | C2 | H2 | 60.0° | 90.0° |
| FE3 | S1 | C2 | H3 | 60.0° | 90.0° |
| FE7 | S1 | FE3 | S4 | 92.3° | 90.0° |
| S1 | FE7 | S5 | FE6 | 93.1° | 90.0° |
| S1 | FE7 | S5 | S8 | 114.7° | 90.0° |
| S1 | FE7 | S8 | FE6 | 86.1° | 90.0° |
| FE7 | S1 | C2 | H1 | 102.9° | 90.0° |
| FE7 | S1 | C2 | H2 | 137.1° | 90.0° |
| FE7 | S1 | C2 | H3 | 17.1° | 90.0° |
| FE3 | S4 | FE6 | S5 | 21.6° | 90.0° |
| S4 | FE3 | S5 | FE7 | 97.8° | 90.0° |
| FE3 | S4 | FE6 | S8 | 90.2° | 90.0° |
| S4 | FE6 | S5 | S8 | 122.6° | 90.0° |
| S4 | FE6 | S5 | FE7 | 100.7° | 90.0° |
| S4 | FE6 | S8 | FE7 | 90.9° | 90.0° |
| FE3 | S5 | FE6 | FE7 | 78.8° | 90.0° |
| FE3 | S5 | FE6 | S8 | 100.7° | 90.0° |
| FE3 | S5 | FE7 | S8 | 96.8° | 90.0° |
| FE6 | S5 | FE7 | S8 | 21.7° | 90.0° |
| H1 | C2 | H2 | H3 | 120.0° | 90.0° |
