EM6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.53Å | 1.53Å | |
| C02 | C03 | sing | 1.51Å | 1.51Å | |
| C03 | C04 | doub | 1.37Å | 1.49Å | |
| C03 | C14 | sing | 1.41Å | 1.47Å | |
| C04 | C05 | sing | 1.51Å | 1.51Å | |
| C04 | N06 | sing | 1.33Å | 1.35Å | |
| N06 | C07 | doub | 1.32Å | 1.37Å | |
| C07 | C08 | sing | 1.47Å | 1.40Å | |
| C07 | N13 | sing | 1.37Å | 1.32Å | |
| C08 | C09 | sing | 1.43Å | 1.33Å | |
| C08 | C11 | doub | 1.38Å | 1.40Å | |
| C09 | N10 | trip | 1.14Å | 1.18Å | |
| C11 | N12 | sing | 1.36Å | 1.37Å | |
| N12 | N13 | sing | 1.40Å | 1.39Å | |
| N13 | C14 | sing | 1.35Å | 1.35Å | |
| C14 | O15 | doub | 1.22Å | 1.27Å | |
| C01 | H01 | sing | 1.09Å | 1.10Å | |
| C01 | H01A | sing | 1.09Å | 1.10Å | |
| C01 | H01B | sing | 1.09Å | 1.10Å | |
| C02 | H02 | sing | 1.09Å | 1.10Å | |
| C02 | H02A | sing | 1.09Å | 1.10Å | |
| C05 | H05 | sing | 1.09Å | 1.10Å | |
| C05 | H05A | sing | 1.09Å | 1.10Å | |
| C05 | H05B | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| N12 | HN12 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 106.2° | 109.5° |
| C02 | C01 | H01 | 109.5° | 109.4° |
| C02 | C01 | H01A | 109.5° | 109.5° |
| C02 | C01 | H01B | 109.4° | 109.5° |
| C01 | C02 | H02 | 110.3° | 109.4° |
| C01 | C02 | H02A | 110.3° | 109.4° |
| C02 | C03 | C04 | 123.3° | 120.5° |
| C02 | C03 | C14 | 119.8° | 120.5° |
| C03 | C02 | H02 | 110.3° | 109.5° |
| C03 | C02 | H02A | 110.3° | 109.5° |
| C04 | C03 | C14 | 116.9° | 119.0° |
| C03 | C04 | C05 | 118.5° | 119.9° |
| C03 | C04 | N06 | 119.8° | 120.2° |
| C03 | C14 | N13 | 117.1° | 118.7° |
| C03 | C14 | O15 | 121.7° | 120.6° |
| C05 | C04 | N06 | 121.7° | 119.9° |
| C04 | C05 | H05 | 109.5° | 109.5° |
| C04 | C05 | H05A | 109.5° | 109.5° |
| C04 | C05 | H05B | 109.5° | 109.5° |
| C04 | N06 | C07 | 118.8° | 121.3° |
| N06 | C07 | C08 | 133.1° | 132.4° |
| N06 | C07 | N13 | 124.1° | 121.1° |
| C08 | C07 | N13 | 102.7° | 106.4° |
| C07 | C08 | C09 | 126.3° | 126.7° |
| C07 | C08 | C11 | 111.8° | 106.6° |
| C07 | N13 | N12 | 114.4° | 108.3° |
| C07 | N13 | C14 | 123.3° | 119.6° |
| C09 | C08 | C11 | 121.5° | 126.7° |
| C08 | C09 | N10 | 172.8° | 180.0° |
| C08 | C11 | N12 | 104.8° | 108.8° |
| C08 | C11 | H11 | 127.6° | 125.6° |
| C11 | N12 | N13 | 106.1° | 109.8° |
| N12 | C11 | H11 | 127.6° | 125.6° |
| C11 | N12 | HN12 | 110.3° | 125.1° |
| N12 | N13 | C14 | 122.2° | 132.1° |
| N13 | N12 | HN12 | 110.3° | 125.1° |
| N13 | C14 | O15 | 121.1° | 120.6° |
| H01 | C01 | H01A | 109.5° | 109.5° |
| H01 | C01 | H01B | 109.5° | 109.5° |
| H01A | C01 | H01B | 109.5° | 109.5° |
| H02 | C02 | H02A | 109.5° | 109.5° |
| H05 | C05 | H05A | 109.5° | 109.5° |
| H05 | C05 | H05B | 109.4° | 109.4° |
| H05A | C05 | H05B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | H02 | 119.5° | 120.0° |
| C01 | C02 | C03 | H02A | 119.5° | 120.0° |
| C01 | C02 | C03 | C04 | 94.3° | 95.0° |
| C01 | C02 | C03 | C14 | 85.4° | 85.3° |
| C02 | C01 | H01 | H01A | 120.0° | 120.0° |
| C02 | C01 | H01 | H01B | 120.0° | 119.9° |
| C02 | C01 | H01A | H01B | 119.9° | 120.0° |
| C01 | C02 | H02 | H02A | 121.5° | 119.9° |
| C02 | C03 | C04 | C14 | 179.7° | 179.7° |
| C02 | C03 | C04 | C05 | 0.9° | 0.1° |
| C02 | C03 | C04 | N06 | 179.9° | 180.0° |
| C02 | C03 | C14 | N13 | 178.6° | 179.8° |
| C02 | C03 | C14 | O15 | 1.6° | 0.1° |
| C03 | C02 | C01 | H01 | 180.0° | 60.0° |
| C03 | C02 | C01 | H01A | 60.0° | 180.0° |
| C03 | C02 | C01 | H01B | 60.0° | 60.0° |
| C03 | C02 | H02 | H02A | 121.5° | 120.1° |
| C03 | C04 | C05 | N06 | 179.0° | 180.0° |
| C03 | C04 | N06 | C07 | 0.2° | 0.0° |
| C04 | C03 | C14 | N13 | 1.7° | 0.5° |
| C04 | C03 | C14 | O15 | 178.7° | 179.8° |
| C04 | C03 | C02 | H02 | 25.2° | 25.0° |
| C04 | C03 | C02 | H02A | 146.2° | 145.0° |
| C03 | C04 | C05 | H05 | 179.0° | 90.0° |
| C03 | C04 | C05 | H05A | 59.0° | 150.0° |
| C03 | C04 | C05 | H05B | 61.0° | 30.0° |
| C14 | C03 | C04 | C05 | 178.9° | 179.7° |
| C14 | C03 | C04 | N06 | 0.2° | 0.3° |
| C03 | C14 | N13 | C07 | 3.4° | 0.5° |
| C03 | C14 | N13 | N12 | 179.8° | 179.8° |
| C03 | C14 | N13 | O15 | 177.0° | 179.7° |
| C14 | C03 | C02 | H02 | 155.1° | 154.7° |
| C14 | C03 | C02 | H02A | 34.1° | 34.7° |
| C05 | C04 | N06 | C07 | 178.8° | 180.0° |
| C04 | C05 | H05 | H05A | 120.0° | 120.1° |
| C04 | C05 | H05 | H05B | 120.0° | 120.0° |
| C04 | C05 | H05A | H05B | 120.0° | 120.0° |
| C04 | N06 | C07 | C08 | 178.4° | 180.0° |
| C04 | N06 | C07 | N13 | 1.9° | 0.0° |
| N06 | C04 | C05 | H05 | 0.0° | 90.0° |
| N06 | C04 | C05 | H05A | 120.0° | 30.0° |
| N06 | C04 | C05 | H05B | 120.0° | 150.0° |
| N06 | C07 | C08 | N13 | 177.0° | 180.0° |
| N06 | C07 | C08 | C09 | 7.4° | 0.1° |
| N06 | C07 | C08 | C11 | 179.7° | 180.0° |
| N06 | C07 | N13 | N12 | 179.3° | 180.0° |
| N06 | C07 | N13 | C14 | 3.7° | 0.3° |
| C07 | C08 | C09 | C11 | 172.2° | 180.0° |
| C07 | C08 | C09 | N10 | 70.1° | 142.8° |
| C07 | C08 | C11 | N12 | 2.5° | 0.0° |
| C08 | C07 | N13 | N12 | 1.9° | 0.0° |
| C08 | C07 | N13 | C14 | 179.0° | 179.8° |
| C07 | C08 | C11 | H11 | 177.5° | 179.9° |
| N13 | C07 | C08 | C09 | 175.6° | 180.0° |
| N13 | C07 | C08 | C11 | 2.7° | 0.0° |
| C07 | N13 | N12 | C11 | 0.5° | 0.0° |
| C07 | N13 | N12 | C14 | 177.1° | 179.7° |
| C07 | N13 | C14 | O15 | 179.6° | 179.8° |
| C07 | N13 | N12 | HN12 | 119.0° | 179.9° |
| C09 | C08 | C11 | N12 | 175.8° | 180.0° |
| C09 | C08 | C11 | H11 | 4.2° | 0.1° |
| C11 | C08 | C09 | N10 | 102.1° | 37.3° |
| C08 | C11 | N12 | H11 | 180.0° | 179.9° |
| C08 | C11 | N12 | N13 | 1.2° | 0.1° |
| C08 | C11 | N12 | HN12 | 120.7° | 179.9° |
| C11 | N12 | N13 | HN12 | 119.5° | 179.9° |
| C11 | N12 | N13 | C14 | 177.5° | 179.7° |
| N12 | N13 | C14 | O15 | 2.8° | 0.1° |
| N13 | N12 | C11 | H11 | 178.8° | 179.9° |
| C14 | N13 | N12 | HN12 | 58.1° | 0.2° |
| H01 | C01 | H01A | H01B | 120.0° | 120.0° |
| H01 | C01 | C02 | H02 | 60.5° | 180.0° |
| H01 | C01 | C02 | H02A | 60.5° | 60.0° |
| H01A | C01 | C02 | H02 | 59.5° | 60.0° |
| H01A | C01 | C02 | H02A | 179.4° | 60.0° |
| H01B | C01 | C02 | H02 | 179.5° | 60.0° |
| H01B | C01 | C02 | H02A | 59.5° | 180.0° |
| H05 | C05 | H05A | H05B | 120.0° | 119.9° |
| H11 | C11 | N12 | HN12 | 59.3° | 0.2° |
