6OR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O13 | S10 | doub | 1.42Å | 1.51Å | |
| O12 | S10 | doub | 1.42Å | 1.51Å | |
| O11 | S10 | sing | 1.52Å | 1.51Å | |
| S10 | C02 | sing | 1.76Å | 1.77Å | |
| C02 | C01 | doub | 1.38Å | 1.39Å | Aromatic |
| C02 | C03 | sing | 1.38Å | 1.39Å | Aromatic |
| C01 | C06 | sing | 1.38Å | 1.38Å | Aromatic |
| C03 | C04 | doub | 1.38Å | 1.39Å | Aromatic |
| C06 | CL7 | sing | 1.74Å | 1.73Å | |
| C06 | C05 | doub | 1.39Å | 1.38Å | Aromatic |
| C04 | C05 | sing | 1.39Å | 1.38Å | Aromatic |
| C04 | CL9 | sing | 1.74Å | 1.73Å | |
| C05 | O08 | sing | 1.36Å | 1.38Å | |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| O08 | H081 | sing | 0.97Å | 0.95Å | |
| O11 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O13 | S10 | O12 | 111.3° | 123.1° |
| O13 | S10 | O11 | 110.8° | 106.4° |
| O13 | S10 | C02 | 110.9° | 106.4° |
| O12 | S10 | O11 | 100.6° | 106.4° |
| O12 | S10 | C02 | 111.7° | 106.4° |
| O11 | S10 | C02 | 111.2° | 107.3° |
| S10 | O11 | H1 | 109.5° | 114.0° |
| S10 | C02 | C01 | 120.3° | 119.9° |
| S10 | C02 | C03 | 120.2° | 119.9° |
| C01 | C02 | C03 | 119.5° | 120.1° |
| C02 | C01 | C06 | 120.2° | 120.1° |
| C02 | C01 | H011 | 119.9° | 119.9° |
| C02 | C03 | C04 | 120.1° | 120.1° |
| C02 | C03 | H031 | 119.9° | 120.0° |
| C01 | C06 | CL7 | 120.6° | 120.0° |
| C01 | C06 | C05 | 120.2° | 119.9° |
| C06 | C01 | H011 | 119.9° | 120.0° |
| C03 | C04 | C05 | 119.9° | 119.9° |
| C03 | C04 | CL9 | 121.3° | 120.0° |
| C04 | C03 | H031 | 120.0° | 119.9° |
| CL7 | C06 | C05 | 119.2° | 120.0° |
| C06 | C05 | C04 | 120.1° | 119.9° |
| C06 | C05 | O08 | 120.0° | 120.1° |
| C05 | C04 | CL9 | 118.8° | 120.0° |
| C04 | C05 | O08 | 120.0° | 120.1° |
| C05 | O08 | H081 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O13 | S10 | O12 | O11 | 117.4° | 122.9° |
| O13 | S10 | O12 | C02 | 124.5° | 122.9° |
| O13 | S10 | O11 | C02 | 123.8° | 113.6° |
| O13 | S10 | C02 | C01 | 73.9° | 23.6° |
| O13 | S10 | C02 | C03 | 106.0° | 156.4° |
| O13 | S10 | O11 | H1 | 117.8° | 66.4° |
| O12 | S10 | O11 | C02 | 118.4° | 113.6° |
| O12 | S10 | C02 | C01 | 50.9° | 156.5° |
| O12 | S10 | C02 | C03 | 129.3° | 23.6° |
| O12 | S10 | O11 | H1 | 0.0° | 66.4° |
| O11 | S10 | C02 | C01 | 162.3° | 90.0° |
| O11 | S10 | C02 | C03 | 17.8° | 90.0° |
| S10 | C02 | C01 | C03 | 179.9° | 180.0° |
| S10 | C02 | C01 | C06 | 179.9° | 180.0° |
| S10 | C02 | C03 | C04 | 179.9° | 180.0° |
| S10 | C02 | C01 | H011 | 0.1° | 0.2° |
| S10 | C02 | C03 | H031 | 0.1° | 0.1° |
| C02 | S10 | O11 | H1 | 118.4° | 180.0° |
| C02 | C01 | C06 | H011 | 180.0° | 179.8° |
| C01 | C02 | C03 | C04 | 0.3° | 0.0° |
| C02 | C01 | C06 | CL7 | 179.8° | 179.8° |
| C02 | C01 | C06 | C05 | 0.2° | 0.0° |
| C01 | C02 | C03 | H031 | 179.8° | 180.0° |
| C03 | C02 | C01 | C06 | 0.1° | 0.0° |
| C02 | C03 | C04 | H031 | 180.0° | 180.0° |
| C02 | C03 | C04 | C05 | 0.1° | 0.0° |
| C02 | C03 | C04 | CL9 | 179.8° | 179.9° |
| C03 | C02 | C01 | H011 | 179.9° | 179.8° |
| C01 | C06 | CL7 | C05 | 180.0° | 179.8° |
| C01 | C06 | C05 | C04 | 0.4° | 0.0° |
| C01 | C06 | C05 | O08 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 0.2° | 0.0° |
| C03 | C04 | C05 | CL9 | 180.0° | 179.9° |
| C03 | C04 | C05 | O08 | 179.8° | 180.0° |
| CL7 | C06 | C05 | C04 | 179.7° | 179.8° |
| CL7 | C06 | C05 | O08 | 0.0° | 0.3° |
| CL7 | C06 | C01 | H011 | 0.2° | 0.0° |
| C06 | C05 | C04 | O08 | 179.6° | 180.0° |
| C06 | C05 | C04 | CL9 | 179.9° | 179.9° |
| C05 | C06 | C01 | H011 | 179.7° | 179.8° |
| C06 | C05 | O08 | H081 | 180.0° | 90.0° |
| C05 | C04 | C03 | H031 | 179.9° | 180.0° |
| C04 | C05 | O08 | H081 | 0.3° | 90.0° |
| CL9 | C04 | C05 | O08 | 0.2° | 0.0° |
| CL9 | C04 | C03 | H031 | 0.2° | 0.0° |
