A1EBD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O09 | S07 | doub | 1.42Å | 1.51Å | |
| O08 | S07 | doub | 1.42Å | 1.51Å | |
| S07 | O10 | sing | 1.52Å | 1.51Å | |
| S07 | C06 | sing | 1.81Å | 1.81Å | |
| C06 | C01 | sing | 1.53Å | 1.48Å | |
| C06 | C05 | sing | 1.53Å | 1.48Å | |
| C01 | C02 | sing | 1.53Å | 1.53Å | |
| C05 | C04 | sing | 1.53Å | 1.53Å | |
| C02 | N03 | sing | 1.47Å | 1.48Å | |
| C04 | N03 | sing | 1.47Å | 1.48Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C02 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C04 | H5 | sing | 1.09Å | 1.10Å | |
| C04 | H6 | sing | 1.09Å | 1.10Å | |
| C05 | H7 | sing | 1.09Å | 1.10Å | |
| C05 | H8 | sing | 1.09Å | 1.10Å | |
| C06 | H9 | sing | 1.09Å | 1.10Å | |
| N03 | H10 | sing | 1.01Å | 1.00Å | |
| O10 | H11 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O09 | S07 | O08 | 101.2° | 121.0° |
| O09 | S07 | O10 | 111.3° | 104.3° |
| O09 | S07 | C06 | 111.5° | 110.5° |
| O08 | S07 | O10 | 111.4° | 104.3° |
| O08 | S07 | C06 | 110.9° | 110.6° |
| O10 | S07 | C06 | 110.3° | 104.4° |
| S07 | O10 | H11 | 109.5° | 114.0° |
| S07 | C06 | C01 | 108.5° | 109.5° |
| S07 | C06 | C05 | 108.8° | 109.5° |
| S07 | C06 | H9 | 106.6° | 109.6° |
| C01 | C06 | C05 | 111.9° | 109.2° |
| C06 | C01 | C02 | 112.1° | 109.3° |
| C06 | C01 | H1 | 108.8° | 109.5° |
| C06 | C01 | H2 | 108.8° | 109.5° |
| C01 | C06 | H9 | 110.4° | 109.5° |
| C06 | C05 | C04 | 111.9° | 109.3° |
| C06 | C05 | H7 | 108.9° | 109.5° |
| C06 | C05 | H8 | 108.9° | 109.5° |
| C05 | C06 | H9 | 110.4° | 109.5° |
| C01 | C02 | N03 | 111.6° | 109.5° |
| C02 | C01 | H1 | 108.8° | 109.5° |
| C02 | C01 | H2 | 108.8° | 109.5° |
| C01 | C02 | H3 | 108.9° | 109.5° |
| C01 | C02 | H4 | 108.9° | 109.5° |
| C05 | C04 | N03 | 112.2° | 109.5° |
| C05 | C04 | H5 | 108.8° | 109.5° |
| C05 | C04 | H6 | 108.8° | 109.4° |
| C04 | C05 | H7 | 108.9° | 109.5° |
| C04 | C05 | H8 | 108.9° | 109.5° |
| C02 | N03 | C04 | 111.8° | 111.2° |
| N03 | C02 | H3 | 108.9° | 109.5° |
| N03 | C02 | H4 | 109.0° | 109.4° |
| C02 | N03 | H10 | 108.9° | 111.0° |
| N03 | C04 | H5 | 108.8° | 109.5° |
| N03 | C04 | H6 | 108.8° | 109.5° |
| C04 | N03 | H10 | 108.9° | 111.0° |
| H1 | C01 | H2 | 109.4° | 109.5° |
| H3 | C02 | H4 | 109.5° | 109.5° |
| H5 | C04 | H6 | 109.5° | 109.4° |
| H7 | C05 | H8 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O09 | S07 | O08 | O10 | 118.4° | 116.7° |
| O09 | S07 | O08 | C06 | 118.4° | 131.5° |
| O09 | S07 | O10 | C06 | 124.3° | 116.0° |
| O09 | S07 | C06 | C01 | 135.6° | 73.4° |
| O09 | S07 | C06 | C05 | 102.4° | 166.9° |
| O09 | S07 | C06 | H9 | 16.7° | 46.8° |
| O09 | S07 | O10 | H11 | 0.0° | 64.0° |
| O08 | S07 | O10 | C06 | 123.6° | 116.1° |
| O08 | S07 | C06 | C01 | 23.7° | 63.4° |
| O08 | S07 | C06 | C05 | 145.7° | 56.3° |
| O08 | S07 | C06 | H9 | 95.2° | 176.5° |
| O08 | S07 | O10 | H11 | 112.1° | 63.9° |
| O10 | S07 | C06 | C01 | 100.2° | 175.0° |
| O10 | S07 | C06 | C05 | 21.8° | 55.3° |
| O10 | S07 | C06 | H9 | 140.9° | 64.8° |
| S07 | C06 | C01 | C05 | 120.1° | 119.9° |
| S07 | C06 | C01 | H9 | 116.5° | 120.2° |
| S07 | C06 | C05 | H9 | 116.7° | 120.2° |
| S07 | C06 | C01 | C02 | 173.4° | 177.6° |
| S07 | C06 | C05 | C04 | 172.6° | 177.5° |
| S07 | C06 | C01 | H1 | 66.1° | 57.6° |
| S07 | C06 | C01 | H2 | 53.0° | 62.4° |
| S07 | C06 | C05 | H7 | 52.2° | 62.5° |
| S07 | C06 | C05 | H8 | 67.0° | 57.6° |
| C06 | S07 | O10 | H11 | 124.3° | 180.0° |
| C01 | C06 | C05 | H9 | 123.4° | 119.9° |
| C06 | C01 | C02 | H1 | 120.4° | 119.9° |
| C06 | C01 | C02 | H2 | 120.4° | 120.0° |
| C01 | C06 | C05 | C04 | 52.7° | 57.6° |
| C06 | C01 | C02 | N03 | 53.8° | 59.2° |
| C06 | C01 | H1 | H2 | 118.8° | 120.1° |
| C06 | C01 | C02 | H3 | 66.5° | 60.8° |
| C06 | C01 | C02 | H4 | 174.2° | 179.1° |
| C01 | C06 | C05 | H7 | 67.7° | 177.6° |
| C01 | C06 | C05 | H8 | 173.1° | 62.3° |
| C05 | C06 | C01 | C02 | 53.3° | 57.7° |
| C06 | C05 | C04 | H7 | 120.4° | 120.0° |
| C06 | C05 | C04 | H8 | 120.4° | 120.0° |
| C06 | C05 | C04 | N03 | 53.1° | 59.1° |
| C05 | C06 | C01 | H1 | 173.8° | 62.3° |
| C05 | C06 | C01 | H2 | 67.1° | 177.7° |
| C06 | C05 | C04 | H5 | 173.5° | 179.2° |
| C06 | C05 | C04 | H6 | 67.3° | 60.9° |
| C06 | C05 | H7 | H8 | 118.9° | 120.1° |
| C01 | C02 | N03 | H3 | 120.3° | 120.0° |
| C01 | C02 | N03 | H4 | 120.3° | 120.0° |
| C01 | C02 | N03 | C04 | 53.9° | 61.7° |
| C02 | C01 | H1 | H2 | 118.8° | 120.1° |
| C01 | C02 | H3 | H4 | 119.0° | 120.0° |
| C02 | C01 | C06 | H9 | 70.1° | 62.2° |
| C01 | C02 | N03 | H10 | 174.2° | 174.1° |
| C05 | C04 | N03 | C02 | 53.7° | 61.7° |
| C05 | C04 | N03 | H5 | 120.4° | 120.1° |
| C05 | C04 | N03 | H6 | 120.4° | 120.0° |
| C05 | C04 | H5 | H6 | 118.8° | 119.9° |
| C04 | C05 | H7 | H8 | 118.9° | 120.0° |
| C04 | C05 | C06 | H9 | 70.7° | 62.3° |
| C05 | C04 | N03 | H10 | 174.1° | 174.2° |
| C02 | N03 | C04 | H10 | 120.4° | 124.1° |
| N03 | C02 | C01 | H1 | 174.2° | 60.8° |
| N03 | C02 | C01 | H2 | 66.6° | 179.2° |
| N03 | C02 | H3 | H4 | 119.1° | 120.0° |
| C02 | N03 | C04 | H5 | 174.1° | 178.2° |
| C02 | N03 | C04 | H6 | 66.7° | 58.3° |
| C04 | N03 | C02 | H3 | 66.5° | 58.3° |
| C04 | N03 | C02 | H4 | 174.2° | 178.3° |
| N03 | C04 | H5 | H6 | 118.7° | 120.0° |
| N03 | C04 | C05 | H7 | 67.3° | 179.1° |
| N03 | C04 | C05 | H8 | 173.4° | 60.8° |
| H1 | C01 | C02 | H3 | 53.9° | 179.2° |
| H1 | C01 | C02 | H4 | 65.4° | 59.2° |
| H1 | C01 | C06 | H9 | 50.3° | 177.8° |
| H2 | C01 | C02 | H3 | 173.1° | 59.2° |
| H2 | C01 | C02 | H4 | 53.8° | 60.9° |
| H2 | C01 | C06 | H9 | 169.5° | 57.8° |
| H3 | C02 | N03 | H10 | 53.9° | 65.8° |
| H4 | C02 | N03 | H10 | 65.5° | 54.2° |
| H5 | C04 | C05 | H7 | 53.1° | 60.8° |
| H5 | C04 | C05 | H8 | 66.2° | 59.2° |
| H5 | C04 | N03 | H10 | 65.5° | 54.1° |
| H6 | C04 | C05 | H7 | 172.3° | 59.1° |
| H6 | C04 | C05 | H8 | 53.0° | 179.2° |
| H6 | C04 | N03 | H10 | 53.7° | 65.9° |
| H7 | C05 | C06 | H9 | 168.9° | 57.7° |
| H8 | C05 | C06 | H9 | 49.7° | 177.8° |






