EP8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O26 | C25 | doub | 1.22Å | 1.28Å | |
| C25 | O27 | sing | 1.35Å | 1.26Å | |
| C25 | C15 | sing | 1.47Å | 1.54Å | |
| C16 | C15 | sing | 1.42Å | 1.43Å | Aromatic |
| C16 | N17 | doub | 1.30Å | 1.35Å | Aromatic |
| C15 | C14 | doub | 1.39Å | 1.44Å | Aromatic |
| N17 | N18 | sing | 1.40Å | 1.32Å | Aromatic |
| N07 | C08 | sing | 1.37Å | 1.31Å | Aromatic |
| N07 | C04 | sing | 1.38Å | 1.34Å | Aromatic |
| C08 | C09 | doub | 1.34Å | 1.40Å | Aromatic |
| C14 | N18 | sing | 1.35Å | 1.34Å | Aromatic |
| C14 | O13 | sing | 1.35Å | 1.45Å | |
| C04 | C05 | doub | 1.39Å | 1.41Å | Aromatic |
| C04 | C03 | sing | 1.41Å | 1.39Å | Aromatic |
| C05 | C06 | sing | 1.38Å | 1.39Å | Aromatic |
| N18 | C19 | sing | 1.40Å | 1.47Å | |
| C09 | C03 | sing | 1.47Å | 1.43Å | Aromatic |
| C09 | C10 | sing | 1.51Å | 1.56Å | |
| C12 | O13 | sing | 1.43Å | 1.43Å | |
| C12 | C11 | sing | 1.53Å | 1.57Å | |
| C03 | C02 | doub | 1.40Å | 1.41Å | Aromatic |
| C06 | C01 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C19 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C02 | C01 | sing | 1.37Å | 1.40Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.40Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C02 | H021 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| N07 | H1 | sing | 0.97Å | 1.00Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| O27 | H2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O26 | C25 | O27 | 121.4° | 120.0° |
| O26 | C25 | C15 | 118.5° | 120.0° |
| O27 | C25 | C15 | 120.1° | 120.0° |
| C25 | O27 | H2 | 109.5° | 117.0° |
| C25 | C15 | C16 | 127.4° | 126.5° |
| C25 | C15 | C14 | 128.7° | 126.5° |
| C15 | C16 | N17 | 107.7° | 108.2° |
| C16 | C15 | C14 | 104.0° | 107.0° |
| C15 | C16 | H161 | 126.1° | 125.9° |
| C16 | N17 | N18 | 109.9° | 109.2° |
| N17 | C16 | H161 | 126.2° | 125.9° |
| C15 | C14 | N18 | 107.5° | 107.1° |
| C15 | C14 | O13 | 129.4° | 126.4° |
| N17 | N18 | C14 | 111.0° | 108.5° |
| N17 | N18 | C19 | 128.5° | 125.8° |
| C08 | N07 | C04 | 110.7° | 109.9° |
| N07 | C08 | C09 | 109.8° | 110.0° |
| C08 | N07 | H1 | 124.6° | 125.1° |
| N07 | C08 | H081 | 125.1° | 125.1° |
| N07 | C04 | C05 | 131.3° | 133.5° |
| N07 | C04 | C03 | 108.3° | 107.1° |
| C04 | N07 | H1 | 124.7° | 125.1° |
| C08 | C09 | C03 | 104.6° | 107.0° |
| C08 | C09 | C10 | 125.2° | 126.5° |
| C09 | C08 | H081 | 125.1° | 125.0° |
| N18 | C14 | O13 | 123.1° | 126.5° |
| C14 | N18 | C19 | 120.5° | 125.7° |
| C14 | O13 | C12 | 118.7° | 117.1° |
| C05 | C04 | C03 | 120.4° | 119.3° |
| C04 | C05 | C06 | 120.6° | 119.8° |
| C04 | C05 | H051 | 119.7° | 120.1° |
| C04 | C03 | C09 | 106.6° | 106.1° |
| C04 | C03 | C02 | 118.6° | 120.0° |
| C05 | C06 | C01 | 119.3° | 120.6° |
| C06 | C05 | H051 | 119.7° | 120.1° |
| C05 | C06 | H061 | 120.3° | 119.7° |
| N18 | C19 | C24 | 118.6° | 120.1° |
| N18 | C19 | C20 | 121.7° | 120.1° |
| C03 | C09 | C10 | 130.2° | 126.5° |
| C09 | C03 | C02 | 134.8° | 134.0° |
| C09 | C10 | C11 | 114.6° | 109.5° |
| C09 | C10 | H101 | 108.1° | 109.4° |
| C09 | C10 | H102 | 108.2° | 109.5° |
| O13 | C12 | C11 | 110.8° | 109.5° |
| O13 | C12 | H121 | 109.2° | 109.4° |
| O13 | C12 | H122 | 109.2° | 109.5° |
| C12 | C11 | C10 | 108.4° | 109.5° |
| C12 | C11 | H111 | 109.8° | 109.4° |
| C12 | C11 | H112 | 109.8° | 109.5° |
| C11 | C12 | H121 | 109.1° | 109.4° |
| C11 | C12 | H122 | 109.1° | 109.5° |
| C03 | C02 | C01 | 120.7° | 119.7° |
| C03 | C02 | H021 | 119.7° | 120.2° |
| C06 | C01 | C02 | 120.5° | 120.5° |
| C06 | C01 | H011 | 119.8° | 119.7° |
| C01 | C06 | H061 | 120.4° | 119.6° |
| C11 | C10 | H101 | 108.2° | 109.4° |
| C11 | C10 | H102 | 108.2° | 109.5° |
| C10 | C11 | H111 | 109.7° | 109.5° |
| C10 | C11 | H112 | 109.8° | 109.5° |
| C24 | C19 | C20 | 119.6° | 119.9° |
| C19 | C24 | C23 | 120.2° | 119.9° |
| C19 | C24 | H241 | 119.9° | 120.1° |
| C19 | C20 | C21 | 119.5° | 120.0° |
| C19 | C20 | H201 | 120.3° | 120.0° |
| C02 | C01 | H011 | 119.7° | 119.7° |
| C01 | C02 | H021 | 119.6° | 120.1° |
| C24 | C23 | C22 | 120.5° | 120.1° |
| C23 | C24 | H241 | 119.9° | 120.0° |
| C24 | C23 | H231 | 119.8° | 119.9° |
| C20 | C21 | C22 | 120.9° | 120.1° |
| C21 | C20 | H201 | 120.2° | 120.1° |
| C20 | C21 | H211 | 119.5° | 120.0° |
| C23 | C22 | C21 | 119.3° | 120.1° |
| C23 | C22 | H221 | 120.4° | 120.0° |
| C22 | C23 | H231 | 119.8° | 119.9° |
| C22 | C21 | H211 | 119.6° | 119.9° |
| C21 | C22 | H221 | 120.3° | 119.9° |
| H101 | C10 | H102 | 109.5° | 109.5° |
| H111 | C11 | H112 | 109.5° | 109.5° |
| H121 | C12 | H122 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O26 | C25 | O27 | C15 | 178.4° | 180.0° |
| O26 | C25 | C15 | C16 | 6.4° | 179.7° |
| O26 | C25 | C15 | C14 | 171.9° | 0.0° |
| O26 | C25 | O27 | H2 | 0.0° | 0.0° |
| O27 | C25 | C15 | C16 | 175.2° | 0.3° |
| O27 | C25 | C15 | C14 | 6.5° | 180.0° |
| C25 | C15 | C16 | C14 | 178.6° | 179.8° |
| C25 | C15 | C16 | N17 | 178.7° | 179.7° |
| C25 | C15 | C14 | N18 | 178.6° | 179.8° |
| C25 | C15 | C14 | O13 | 0.1° | 0.3° |
| C25 | C15 | C16 | H161 | 1.3° | 0.2° |
| C15 | C25 | O27 | H2 | 178.3° | 179.9° |
| C15 | C16 | N17 | H161 | 180.0° | 180.0° |
| C15 | C16 | N17 | N18 | 0.1° | 0.0° |
| C16 | C15 | C14 | N18 | 0.0° | 0.0° |
| C16 | C15 | C14 | O13 | 178.5° | 180.0° |
| N17 | C16 | C15 | C14 | 0.1° | 0.0° |
| C16 | N17 | N18 | C14 | 0.1° | 0.0° |
| C16 | N17 | N18 | C19 | 179.7° | 179.9° |
| C15 | C14 | N18 | N17 | 0.1° | 0.0° |
| C15 | C14 | N18 | O13 | 178.7° | 179.9° |
| C15 | C14 | N18 | C19 | 179.7° | 179.9° |
| C15 | C14 | O13 | C12 | 55.7° | 92.5° |
| C14 | C15 | C16 | H161 | 179.9° | 180.0° |
| N17 | N18 | C14 | C19 | 179.6° | 180.0° |
| N17 | N18 | C14 | O13 | 178.7° | 180.0° |
| N17 | N18 | C19 | C24 | 93.8° | 138.4° |
| N17 | N18 | C19 | C20 | 88.0° | 41.6° |
| N18 | N17 | C16 | H161 | 179.9° | 180.0° |
| C08 | N07 | C04 | H1 | 180.0° | 179.8° |
| N07 | C08 | C09 | H081 | 180.0° | 179.9° |
| C08 | N07 | C04 | C05 | 179.8° | 180.0° |
| C08 | N07 | C04 | C03 | 0.1° | 0.2° |
| N07 | C08 | C09 | C03 | 0.0° | 0.1° |
| N07 | C08 | C09 | C10 | 179.6° | 180.0° |
| C04 | N07 | C08 | C09 | 0.0° | 0.2° |
| N07 | C04 | C05 | C03 | 179.9° | 179.7° |
| N07 | C04 | C05 | C06 | 179.8° | 180.0° |
| N07 | C04 | C03 | C09 | 0.1° | 0.2° |
| N07 | C04 | C03 | C02 | 179.8° | 179.8° |
| N07 | C04 | C05 | H051 | 0.2° | 0.2° |
| C04 | N07 | C08 | H081 | 180.0° | 179.9° |
| C08 | C09 | C03 | C04 | 0.1° | 0.1° |
| C08 | C09 | C03 | C10 | 179.5° | 179.9° |
| C08 | C09 | C03 | C02 | 179.7° | 179.9° |
| C08 | C09 | C10 | C11 | 144.3° | 95.0° |
| C08 | C09 | C10 | H101 | 23.5° | 25.0° |
| C08 | C09 | C10 | H102 | 94.9° | 145.0° |
| C09 | C08 | N07 | H1 | 180.0° | 180.0° |
| N18 | C14 | O13 | C12 | 126.0° | 87.5° |
| C14 | N18 | C19 | C24 | 85.8° | 41.6° |
| C14 | N18 | C19 | C20 | 92.5° | 138.4° |
| O13 | C14 | N18 | C19 | 1.6° | 0.0° |
| C14 | O13 | C12 | C11 | 110.9° | 175.1° |
| C14 | O13 | C12 | H121 | 128.9° | 55.1° |
| C14 | O13 | C12 | H122 | 9.3° | 64.9° |
| C04 | C05 | C06 | H051 | 180.0° | 179.8° |
| C05 | C04 | C03 | C09 | 179.8° | 180.0° |
| C05 | C04 | C03 | C02 | 0.1° | 0.0° |
| C04 | C05 | C06 | C01 | 0.2° | 0.5° |
| C04 | C05 | C06 | H061 | 179.8° | 180.0° |
| C05 | C04 | N07 | H1 | 0.2° | 0.2° |
| C03 | C04 | C05 | C06 | 0.0° | 0.2° |
| C04 | C03 | C09 | C02 | 179.6° | 180.0° |
| C04 | C03 | C09 | C10 | 179.6° | 179.9° |
| C04 | C03 | C02 | C01 | 0.0° | 0.0° |
| C04 | C03 | C02 | H021 | 180.0° | 180.0° |
| C03 | C04 | C05 | H051 | 180.0° | 179.9° |
| C03 | C04 | N07 | H1 | 179.9° | 180.0° |
| C05 | C06 | C01 | H061 | 180.0° | 179.5° |
| C05 | C06 | C01 | C02 | 0.4° | 0.5° |
| C05 | C06 | C01 | H011 | 179.6° | 179.8° |
| N18 | C19 | C24 | C20 | 178.3° | 179.9° |
| N18 | C19 | C24 | C23 | 178.8° | 179.4° |
| N18 | C19 | C20 | C21 | 178.6° | 180.0° |
| N18 | C19 | C20 | H201 | 1.4° | 0.3° |
| N18 | C19 | C24 | H241 | 1.2° | 0.3° |
| C03 | C09 | C10 | C11 | 36.3° | 84.9° |
| C09 | C03 | C02 | C01 | 179.5° | 180.0° |
| C03 | C09 | C10 | H101 | 157.1° | 155.1° |
| C03 | C09 | C10 | H102 | 84.5° | 35.1° |
| C09 | C03 | C02 | H021 | 0.4° | 0.0° |
| C03 | C09 | C08 | H081 | 179.9° | 179.9° |
| C09 | C10 | C11 | C12 | 104.2° | 180.0° |
| C10 | C09 | C03 | C02 | 0.8° | 0.2° |
| C09 | C10 | C11 | H101 | 120.7° | 119.9° |
| C09 | C10 | C11 | H102 | 120.8° | 120.0° |
| C09 | C10 | H101 | H102 | 117.6° | 120.0° |
| C10 | C09 | C08 | H081 | 0.4° | 0.1° |
| C09 | C10 | C11 | H111 | 15.6° | 60.0° |
| C09 | C10 | C11 | H112 | 136.0° | 60.0° |
| O13 | C12 | C11 | H121 | 120.2° | 120.0° |
| O13 | C12 | C11 | H122 | 120.2° | 120.0° |
| O13 | C12 | C11 | C10 | 174.3° | 180.0° |
| O13 | C12 | C11 | H111 | 54.5° | 60.0° |
| O13 | C12 | C11 | H112 | 65.8° | 60.0° |
| O13 | C12 | H121 | H122 | 119.4° | 120.0° |
| C12 | C11 | C10 | H111 | 119.8° | 120.0° |
| C12 | C11 | C10 | H112 | 119.8° | 120.0° |
| C12 | C11 | C10 | H101 | 16.5° | 60.1° |
| C12 | C11 | C10 | H102 | 135.0° | 60.0° |
| C12 | C11 | H111 | H112 | 120.5° | 120.0° |
| C11 | C12 | H121 | H122 | 119.4° | 120.0° |
| C03 | C02 | C01 | C06 | 0.3° | 0.2° |
| C03 | C02 | C01 | H021 | 180.0° | 180.0° |
| C03 | C02 | C01 | H011 | 179.7° | 180.0° |
| C06 | C01 | C02 | H011 | 180.0° | 179.7° |
| C06 | C01 | C02 | H021 | 179.7° | 179.8° |
| C01 | C06 | C05 | H051 | 179.8° | 179.7° |
| C11 | C10 | H101 | H102 | 117.7° | 120.0° |
| C10 | C11 | H111 | H112 | 120.5° | 120.0° |
| C10 | C11 | C12 | H121 | 65.5° | 60.1° |
| C10 | C11 | C12 | H122 | 54.1° | 60.0° |
| C19 | C24 | C23 | H241 | 180.0° | 179.1° |
| C24 | C19 | C20 | C21 | 0.4° | 0.0° |
| C19 | C24 | C23 | C22 | 0.3° | 0.9° |
| C24 | C19 | C20 | H201 | 179.6° | 179.7° |
| C19 | C24 | C23 | H231 | 179.7° | 179.9° |
| C20 | C19 | C24 | C23 | 0.5° | 0.6° |
| C19 | C20 | C21 | H201 | 180.0° | 179.7° |
| C19 | C20 | C21 | C22 | 0.1° | 0.3° |
| C19 | C20 | C21 | H211 | 179.9° | 179.7° |
| C20 | C19 | C24 | H241 | 179.5° | 179.6° |
| C02 | C01 | C06 | H061 | 179.6° | 180.0° |
| C24 | C23 | C22 | H231 | 180.0° | 179.2° |
| C24 | C23 | C22 | C21 | 0.0° | 0.6° |
| C24 | C23 | C22 | H221 | 179.9° | 179.4° |
| C20 | C21 | C22 | C23 | 0.1° | 0.0° |
| C20 | C21 | C22 | H211 | 180.0° | 180.0° |
| C20 | C21 | C22 | H221 | 179.9° | 180.0° |
| C23 | C22 | C21 | H221 | 180.0° | 180.0° |
| C23 | C22 | C21 | H211 | 179.9° | 180.0° |
| C22 | C23 | C24 | H241 | 179.7° | 180.0° |
| C22 | C21 | C20 | H201 | 179.9° | 180.0° |
| C21 | C22 | C23 | H231 | 179.9° | 179.8° |
| H101 | C10 | C11 | H111 | 136.4° | 180.0° |
| H101 | C10 | C11 | H112 | 103.3° | 60.0° |
| H102 | C10 | C11 | H111 | 105.1° | 60.0° |
| H102 | C10 | C11 | H112 | 15.2° | 180.0° |
| H201 | C20 | C21 | H211 | 0.1° | 0.0° |
| H211 | C21 | C22 | H221 | 0.1° | 0.0° |
| H221 | C22 | C23 | H231 | 0.1° | 0.2° |
| H241 | C24 | C23 | H231 | 0.3° | 0.8° |
| H011 | C01 | C02 | H021 | 0.2° | 0.0° |
| H011 | C01 | C06 | H061 | 0.3° | 0.3° |
| H051 | C05 | C06 | H061 | 0.2° | 0.2° |
| H1 | N07 | C08 | H081 | 0.0° | 0.2° |
| H111 | C11 | C12 | H121 | 174.7° | 180.0° |
| H111 | C11 | C12 | H122 | 65.7° | 60.0° |
| H112 | C11 | C12 | H121 | 54.4° | 60.0° |
| H112 | C11 | C12 | H122 | 174.0° | 180.0° |
