EG6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F22 | C19 | sing | 1.40Å | 1.35Å | |
| F20 | C19 | sing | 1.40Å | 1.37Å | |
| C19 | F21 | sing | 1.40Å | 1.33Å | |
| C19 | C18 | sing | 1.51Å | 1.47Å | |
| C23 | C18 | doub | 1.38Å | 1.36Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.36Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C24 | C15 | doub | 1.40Å | 1.39Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.42Å | Aromatic |
| C15 | C14 | sing | 1.48Å | 1.49Å | |
| N13 | C14 | doub | 1.30Å | 1.33Å | Aromatic |
| N13 | C11 | sing | 1.31Å | 1.41Å | Aromatic |
| C14 | S25 | sing | 1.71Å | 1.82Å | Aromatic |
| C12 | C11 | sing | 1.51Å | 1.53Å | |
| C11 | C10 | doub | 1.37Å | 1.38Å | Aromatic |
| S25 | C10 | sing | 1.76Å | 1.81Å | Aromatic |
| C10 | C02 | sing | 1.47Å | 1.57Å | |
| N03 | C02 | sing | 1.35Å | 1.42Å | |
| N03 | C04 | sing | 1.46Å | 1.52Å | |
| C02 | O01 | doub | 1.22Å | 1.22Å | |
| C04 | C05 | sing | 1.53Å | 1.54Å | |
| C05 | O06 | sing | 1.43Å | 1.39Å | |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C05 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| O06 | H4 | sing | 0.97Å | 0.95Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.08Å | 1.08Å | |
| C17 | H9 | sing | 1.08Å | 1.08Å | |
| C23 | H10 | sing | 1.08Å | 1.08Å | |
| C24 | H11 | sing | 1.08Å | 1.08Å | |
| C04 | C1 | sing | 1.51Å | 36.67Å | |
| C1 | O2 | sing | 1.34Å | 0.00Å | |
| C1 | O1 | doub | 1.21Å | 0.00Å | |
| N03 | H12 | sing | 0.97Å | 1.00Å | |
| O2 | H13 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F22 | C19 | F20 | 101.1° | 109.5° |
| F22 | C19 | F21 | 103.7° | 109.5° |
| F22 | C19 | C18 | 115.4° | 109.5° |
| F20 | C19 | F21 | 105.4° | 109.5° |
| F20 | C19 | C18 | 115.4° | 109.4° |
| F21 | C19 | C18 | 114.2° | 109.5° |
| C19 | C18 | C23 | 119.3° | 119.9° |
| C19 | C18 | C17 | 123.1° | 119.8° |
| C18 | C23 | C24 | 120.9° | 120.2° |
| C23 | C18 | C17 | 117.6° | 120.3° |
| C18 | C23 | H10 | 119.5° | 120.0° |
| C23 | C24 | C15 | 125.6° | 119.8° |
| C24 | C23 | H10 | 119.6° | 119.9° |
| C23 | C24 | H11 | 117.2° | 120.1° |
| C18 | C17 | C16 | 120.7° | 120.1° |
| C18 | C17 | H9 | 119.6° | 119.9° |
| C24 | C15 | C16 | 112.9° | 119.7° |
| C24 | C15 | C14 | 117.9° | 120.1° |
| C15 | C24 | H11 | 117.2° | 120.1° |
| C17 | C16 | C15 | 122.2° | 119.9° |
| C17 | C16 | H8 | 118.9° | 120.0° |
| C16 | C17 | H9 | 119.6° | 119.9° |
| C16 | C15 | C14 | 129.0° | 120.2° |
| C15 | C16 | H8 | 118.9° | 120.1° |
| C15 | C14 | N13 | 124.6° | 124.8° |
| C15 | C14 | S25 | 126.3° | 124.7° |
| C14 | N13 | C11 | 115.5° | 117.4° |
| N13 | C14 | S25 | 109.0° | 110.5° |
| N13 | C11 | C12 | 116.4° | 123.0° |
| N13 | C11 | C10 | 117.2° | 114.0° |
| C14 | S25 | C10 | 91.9° | 90.4° |
| C12 | C11 | C10 | 126.4° | 123.0° |
| C11 | C12 | H5 | 109.5° | 109.5° |
| C11 | C12 | H6 | 109.5° | 109.4° |
| C11 | C12 | H7 | 109.5° | 109.5° |
| C11 | C10 | S25 | 106.4° | 107.8° |
| C11 | C10 | C02 | 127.0° | 126.1° |
| S25 | C10 | C02 | 126.6° | 126.1° |
| C10 | C02 | N03 | 118.3° | 120.0° |
| C10 | C02 | O01 | 118.3° | 120.0° |
| C02 | N03 | C04 | 133.7° | 120.0° |
| N03 | C02 | O01 | 123.4° | 120.0° |
| C02 | N03 | H12 | 113.2° | 120.0° |
| N03 | C04 | C05 | 115.5° | 109.5° |
| N03 | C04 | H1 | 120.1° | 109.5° |
| N03 | C04 | C1 | 73.7° | 109.5° |
| C04 | N03 | H12 | 113.2° | 120.0° |
| C04 | C05 | O06 | 107.3° | 109.5° |
| C05 | C04 | H1 | 119.9° | 109.5° |
| C04 | C05 | H2 | 110.0° | 109.5° |
| C04 | C05 | H3 | 110.0° | 109.4° |
| C05 | C04 | C1 | 125.5° | 109.5° |
| O06 | C05 | H2 | 110.0° | 109.5° |
| O06 | C05 | H3 | 110.0° | 109.6° |
| C05 | O06 | H4 | 109.5° | 114.0° |
| H1 | C04 | C1 | 91.2° | 109.5° |
| H2 | C05 | H3 | 109.5° | 109.4° |
| H5 | C12 | H6 | 109.5° | 109.5° |
| H5 | C12 | H7 | 109.5° | 109.5° |
| H6 | C12 | H7 | 109.5° | 109.5° |
| C04 | C1 | O2 | 90.0° | 120.0° |
| C04 | C1 | O1 | 90.0° | 120.0° |
| O2 | C1 | O1 | 90.0° | 120.0° |
| C1 | O2 | H13 | 90.0° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F22 | C19 | F20 | F21 | 107.8° | 120.0° |
| F22 | C19 | F20 | C18 | 125.3° | 120.0° |
| F22 | C19 | F21 | C18 | 126.4° | 120.0° |
| F22 | C19 | C18 | C23 | 42.4° | 30.0° |
| F22 | C19 | C18 | C17 | 135.9° | 150.0° |
| F20 | C19 | F21 | C18 | 127.7° | 120.0° |
| F20 | C19 | C18 | C23 | 75.1° | 150.0° |
| F20 | C19 | C18 | C17 | 106.6° | 30.0° |
| F21 | C19 | C18 | C23 | 162.5° | 90.0° |
| F21 | C19 | C18 | C17 | 15.8° | 90.0° |
| C19 | C18 | C23 | C17 | 178.4° | 180.0° |
| C19 | C18 | C23 | C24 | 179.3° | 179.7° |
| C19 | C18 | C17 | C16 | 179.7° | 180.0° |
| C19 | C18 | C17 | H9 | 0.2° | 0.1° |
| C19 | C18 | C23 | H10 | 0.7° | 0.0° |
| C18 | C23 | C24 | H10 | 180.0° | 179.7° |
| C18 | C23 | C24 | C15 | 1.1° | 0.6° |
| C23 | C18 | C17 | C16 | 1.4° | 0.0° |
| C23 | C18 | C17 | H9 | 178.6° | 180.0° |
| C18 | C23 | C24 | H11 | 178.9° | 180.0° |
| C24 | C23 | C18 | C17 | 0.9° | 0.3° |
| C23 | C24 | C15 | H11 | 180.0° | 179.4° |
| C23 | C24 | C15 | C16 | 2.4° | 0.6° |
| C23 | C24 | C15 | C14 | 178.3° | 179.7° |
| C18 | C17 | C16 | H9 | 180.0° | 179.9° |
| C18 | C17 | C16 | C15 | 0.0° | 0.0° |
| C18 | C17 | C16 | H8 | 180.0° | 180.0° |
| C17 | C18 | C23 | H10 | 179.1° | 180.0° |
| C24 | C15 | C16 | C17 | 1.7° | 0.3° |
| C24 | C15 | C16 | C14 | 175.3° | 179.7° |
| C24 | C15 | C14 | N13 | 16.3° | 179.7° |
| C24 | C15 | C14 | S25 | 165.8° | 0.0° |
| C24 | C15 | C16 | H8 | 178.2° | 179.7° |
| C15 | C24 | C23 | H10 | 178.9° | 179.7° |
| C17 | C16 | C15 | H8 | 180.0° | 180.0° |
| C17 | C16 | C15 | C14 | 177.1° | 180.0° |
| C16 | C15 | C14 | N13 | 158.9° | 0.0° |
| C16 | C15 | C14 | S25 | 19.1° | 179.7° |
| C15 | C16 | C17 | H9 | 179.9° | 180.0° |
| C16 | C15 | C24 | H11 | 177.6° | 180.0° |
| C15 | C14 | N13 | S25 | 178.2° | 179.7° |
| C15 | C14 | N13 | C11 | 178.9° | 180.0° |
| C15 | C14 | S25 | C10 | 178.9° | 180.0° |
| C14 | C15 | C16 | H8 | 2.9° | 0.0° |
| C14 | C15 | C24 | H11 | 1.7° | 0.3° |
| C14 | N13 | C11 | C12 | 179.6° | 179.9° |
| C14 | N13 | C11 | C10 | 0.3° | 0.0° |
| N13 | C14 | S25 | C10 | 0.7° | 0.3° |
| C11 | N13 | C14 | S25 | 0.6° | 0.2° |
| N13 | C11 | C12 | C10 | 179.9° | 179.9° |
| N13 | C11 | C10 | S25 | 0.3° | 0.2° |
| N13 | C11 | C10 | C02 | 179.3° | 179.9° |
| N13 | C11 | C12 | H5 | 0.0° | 90.0° |
| N13 | C11 | C12 | H6 | 120.0° | 30.0° |
| N13 | C11 | C12 | H7 | 120.0° | 150.0° |
| C14 | S25 | C10 | C11 | 0.5° | 0.3° |
| C14 | S25 | C10 | C02 | 179.6° | 180.0° |
| C12 | C11 | C10 | S25 | 179.9° | 179.7° |
| C12 | C11 | C10 | C02 | 0.8° | 0.0° |
| C11 | C12 | H5 | H6 | 120.0° | 120.0° |
| C11 | C12 | H5 | H7 | 120.0° | 120.0° |
| C11 | C12 | H6 | H7 | 120.0° | 119.9° |
| C11 | C10 | S25 | C02 | 179.1° | 179.7° |
| C11 | C10 | C02 | N03 | 14.4° | 179.7° |
| C11 | C10 | C02 | O01 | 166.4° | 0.0° |
| C10 | C11 | C12 | H5 | 179.8° | 90.0° |
| C10 | C11 | C12 | H6 | 59.8° | 150.0° |
| C10 | C11 | C12 | H7 | 60.2° | 30.1° |
| S25 | C10 | C02 | N03 | 164.4° | 0.6° |
| S25 | C10 | C02 | O01 | 14.7° | 179.7° |
| C10 | C02 | N03 | O01 | 179.1° | 179.7° |
| C10 | C02 | N03 | C04 | 179.6° | 179.7° |
| C10 | C02 | N03 | H12 | 0.4° | 0.3° |
| C02 | N03 | C04 | H12 | 180.0° | 180.0° |
| C02 | N03 | C04 | C05 | 4.0° | 85.0° |
| C02 | N03 | C04 | H1 | 152.3° | 35.0° |
| C02 | N03 | C04 | C1 | 126.1° | 155.0° |
| C04 | N03 | C02 | O01 | 1.3° | 0.0° |
| N03 | C04 | C05 | H1 | 156.4° | 120.0° |
| N03 | C04 | C05 | C1 | 87.6° | 120.0° |
| N03 | C04 | C05 | O06 | 96.0° | 65.0° |
| N03 | C04 | H1 | C1 | 71.8° | 120.0° |
| N03 | C04 | C05 | H2 | 144.3° | 175.0° |
| N03 | C04 | C05 | H3 | 23.6° | 55.0° |
| N03 | C04 | C1 | O2 | 90.0° | 180.0° |
| N03 | C04 | C1 | O1 | 90.0° | 0.0° |
| O01 | C02 | N03 | H12 | 178.6° | 180.0° |
| C04 | C05 | O06 | H2 | 119.7° | 120.0° |
| C04 | C05 | O06 | H3 | 119.7° | 120.0° |
| C05 | C04 | H1 | C1 | 133.0° | 120.0° |
| C04 | C05 | H2 | H3 | 121.0° | 119.9° |
| C04 | C05 | O06 | H4 | 180.0° | 180.0° |
| C05 | C04 | C1 | O2 | 90.0° | 60.0° |
| C05 | C04 | C1 | O1 | 90.0° | 120.0° |
| C05 | C04 | N03 | H12 | 175.9° | 95.0° |
| O06 | C05 | C04 | H1 | 107.6° | 174.9° |
| O06 | C05 | H2 | H3 | 121.0° | 120.1° |
| O06 | C05 | C04 | C1 | 8.4° | 54.9° |
| H1 | C04 | C05 | H2 | 12.1° | 55.0° |
| H1 | C04 | C05 | H3 | 132.8° | 65.0° |
| H1 | C04 | C1 | O2 | 90.0° | 60.0° |
| H1 | C04 | C1 | O1 | 90.0° | 120.0° |
| H1 | C04 | N03 | H12 | 27.7° | 145.0° |
| H2 | C05 | O06 | H4 | 60.3° | 60.1° |
| H2 | C05 | C04 | C1 | 128.1° | 65.0° |
| H3 | C05 | O06 | H4 | 60.4° | 60.0° |
| H3 | C05 | C04 | C1 | 111.2° | 175.0° |
| H5 | C12 | H6 | H7 | 120.0° | 120.1° |
| H8 | C16 | C17 | H9 | 0.0° | 0.0° |
| H10 | C23 | C24 | H11 | 1.1° | 0.3° |
| C04 | C1 | O2 | O1 | 90.0° | 179.9° |
| C1 | C04 | N03 | H12 | 53.9° | 25.0° |
| C04 | C1 | O2 | H13 | 90.0° | 180.0° |
| O1 | C1 | O2 | H13 | 90.0° | 0.0° |
