UZG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N28 | C27 | doub | 1.30Å | 1.26Å | |
| N29 | C27 | sing | 1.38Å | 1.24Å | |
| C27 | C23 | sing | 1.48Å | 1.52Å | |
| C23 | C24 | doub | 1.39Å | 1.40Å | Aromatic |
| C23 | C22 | sing | 1.40Å | 1.40Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.42Å | Aromatic |
| C22 | C21 | doub | 1.36Å | 1.40Å | Aromatic |
| C25 | N26 | sing | 1.38Å | 1.34Å | Aromatic |
| C25 | C20 | doub | 1.41Å | 1.36Å | Aromatic |
| C21 | C20 | sing | 1.40Å | 1.44Å | Aromatic |
| N26 | C18 | sing | 1.37Å | 1.31Å | Aromatic |
| C20 | N19 | sing | 1.35Å | 1.37Å | Aromatic |
| C18 | N19 | doub | 1.31Å | 1.30Å | Aromatic |
| C18 | C15 | sing | 1.48Å | 1.53Å | |
| C14 | C15 | doub | 1.40Å | 1.38Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.39Å | Aromatic |
| C13 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C17 | sing | 1.39Å | 1.38Å | Aromatic |
| C12 | O11 | sing | 1.36Å | 1.41Å | |
| O11 | C06 | sing | 1.36Å | 1.41Å | |
| C05 | C06 | doub | 1.39Å | 1.39Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.39Å | Aromatic |
| C06 | C07 | sing | 1.39Å | 1.38Å | Aromatic |
| C04 | C03 | doub | 1.39Å | 1.38Å | Aromatic |
| C07 | C08 | doub | 1.38Å | 1.39Å | Aromatic |
| C03 | C08 | sing | 1.39Å | 1.40Å | Aromatic |
| C03 | O02 | sing | 1.36Å | 1.41Å | |
| C08 | O09 | sing | 1.36Å | 1.40Å | |
| C01 | O02 | sing | 1.43Å | 1.40Å | |
| O09 | C10 | sing | 1.43Å | 1.41Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.08Å | 1.08Å | |
| C17 | H5 | sing | 1.08Å | 1.08Å | |
| C21 | H6 | sing | 1.08Å | 1.08Å | |
| C22 | H7 | sing | 1.08Å | 1.08Å | |
| C24 | H8 | sing | 1.08Å | 1.08Å | |
| C01 | H9 | sing | 1.09Å | 1.10Å | |
| C01 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.08Å | 1.08Å | |
| C05 | H13 | sing | 1.08Å | 1.08Å | |
| C07 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| N26 | H18 | sing | 0.97Å | 1.00Å | |
| N28 | H19 | sing | 0.97Å | 1.00Å | |
| N29 | H20 | sing | 0.97Å | 1.00Å | |
| N29 | H21 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N28 | C27 | N29 | 120.8° | 120.0° |
| N28 | C27 | C23 | 120.9° | 120.0° |
| C27 | N28 | H19 | 112.0° | 120.0° |
| N29 | C27 | C23 | 118.3° | 120.0° |
| C27 | N29 | H20 | 120.0° | 120.0° |
| C27 | N29 | H21 | 120.0° | 120.0° |
| C27 | C23 | C24 | 120.1° | 119.9° |
| C27 | C23 | C22 | 118.9° | 119.9° |
| C24 | C23 | C22 | 121.0° | 120.1° |
| C23 | C24 | C25 | 119.5° | 119.6° |
| C23 | C24 | H8 | 120.2° | 120.2° |
| C23 | C22 | C21 | 118.6° | 120.6° |
| C23 | C22 | H7 | 120.7° | 119.7° |
| C24 | C25 | N26 | 133.7° | 133.9° |
| C24 | C25 | C20 | 120.8° | 119.9° |
| C25 | C24 | H8 | 120.3° | 120.2° |
| C22 | C21 | C20 | 120.8° | 120.1° |
| C22 | C21 | H6 | 119.6° | 120.0° |
| C21 | C22 | H7 | 120.7° | 119.7° |
| N26 | C25 | C20 | 105.5° | 106.2° |
| C25 | N26 | C18 | 110.3° | 107.0° |
| C25 | N26 | H18 | 124.8° | 126.4° |
| C25 | C20 | C21 | 119.4° | 119.7° |
| C25 | C20 | N19 | 107.1° | 107.2° |
| C21 | C20 | N19 | 133.5° | 133.2° |
| C20 | C21 | H6 | 119.6° | 119.9° |
| N26 | C18 | N19 | 109.0° | 109.8° |
| N26 | C18 | C15 | 124.5° | 125.1° |
| C18 | N26 | H18 | 124.9° | 126.5° |
| C20 | N19 | C18 | 108.1° | 109.8° |
| N19 | C18 | C15 | 126.2° | 125.1° |
| C18 | C15 | C14 | 121.5° | 120.1° |
| C18 | C15 | C16 | 119.9° | 120.1° |
| C15 | C14 | C13 | 120.4° | 119.9° |
| C14 | C15 | C16 | 118.4° | 119.8° |
| C15 | C14 | H15 | 119.8° | 120.0° |
| C14 | C13 | C12 | 121.7° | 120.1° |
| C14 | C13 | H4 | 119.1° | 120.0° |
| C13 | C14 | H15 | 119.8° | 120.1° |
| C15 | C16 | C17 | 121.3° | 119.9° |
| C15 | C16 | H16 | 119.4° | 120.1° |
| C13 | C12 | C17 | 118.4° | 120.1° |
| C13 | C12 | O11 | 116.2° | 119.9° |
| C12 | C13 | H4 | 119.2° | 119.9° |
| C16 | C17 | C12 | 119.8° | 120.1° |
| C16 | C17 | H5 | 120.1° | 120.0° |
| C17 | C16 | H16 | 119.4° | 120.0° |
| C17 | C12 | O11 | 125.4° | 119.9° |
| C12 | C17 | H5 | 120.1° | 120.0° |
| C12 | O11 | C06 | 122.9° | 118.0° |
| O11 | C06 | C05 | 118.7° | 120.0° |
| O11 | C06 | C07 | 121.5° | 120.0° |
| C06 | C05 | C04 | 122.3° | 120.1° |
| C05 | C06 | C07 | 119.6° | 120.0° |
| C06 | C05 | H13 | 118.9° | 120.0° |
| C05 | C04 | C03 | 117.7° | 120.1° |
| C05 | C04 | H12 | 121.1° | 120.0° |
| C04 | C05 | H13 | 118.8° | 119.9° |
| C06 | C07 | C08 | 118.7° | 120.0° |
| C06 | C07 | H14 | 120.7° | 120.0° |
| C04 | C03 | C08 | 120.1° | 119.9° |
| C04 | C03 | O02 | 119.8° | 120.0° |
| C03 | C04 | H12 | 121.1° | 120.0° |
| C07 | C08 | C03 | 121.5° | 119.9° |
| C07 | C08 | O09 | 118.6° | 120.1° |
| C08 | C07 | H14 | 120.6° | 120.0° |
| C08 | C03 | O02 | 120.1° | 120.1° |
| C03 | C08 | O09 | 120.0° | 120.0° |
| C03 | O02 | C01 | 114.6° | 117.1° |
| C08 | O09 | C10 | 114.7° | 117.0° |
| O02 | C01 | H9 | 109.5° | 109.5° |
| O02 | C01 | H10 | 109.5° | 109.5° |
| O02 | C01 | H11 | 109.5° | 109.4° |
| O09 | C10 | H1 | 109.5° | 109.5° |
| O09 | C10 | H2 | 109.5° | 109.5° |
| O09 | C10 | H3 | 109.5° | 109.5° |
| H1 | C10 | H2 | 109.4° | 109.5° |
| H1 | C10 | H3 | 109.4° | 109.4° |
| H2 | C10 | H3 | 109.5° | 109.4° |
| H9 | C01 | H10 | 109.4° | 109.5° |
| H9 | C01 | H11 | 109.5° | 109.5° |
| H10 | C01 | H11 | 109.5° | 109.4° |
| H20 | N29 | H21 | 120.0° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N28 | C27 | N29 | C23 | 177.6° | 179.9° |
| N28 | C27 | C23 | C24 | 10.1° | 0.1° |
| N28 | C27 | C23 | C22 | 168.9° | 179.7° |
| N28 | C27 | N29 | H20 | 177.6° | 180.0° |
| N28 | C27 | N29 | H21 | 2.4° | 0.1° |
| N29 | C27 | C23 | C24 | 172.3° | 180.0° |
| N29 | C27 | C23 | C22 | 8.7° | 0.2° |
| N29 | C27 | N28 | H19 | 177.6° | 180.0° |
| C27 | N29 | H20 | H21 | 180.0° | 179.9° |
| C27 | C23 | C24 | C22 | 179.0° | 179.8° |
| C27 | C23 | C24 | C25 | 179.5° | 179.9° |
| C27 | C23 | C22 | C21 | 179.2° | 179.8° |
| C27 | C23 | C22 | H7 | 0.8° | 0.2° |
| C27 | C23 | C24 | H8 | 0.6° | 0.1° |
| C23 | C27 | N28 | H19 | 0.0° | 0.1° |
| C23 | C27 | N29 | H20 | 0.0° | 0.1° |
| C23 | C27 | N29 | H21 | 180.0° | 180.0° |
| C23 | C24 | C25 | H8 | 180.0° | 180.0° |
| C24 | C23 | C22 | C21 | 0.2° | 0.0° |
| C23 | C24 | C25 | N26 | 177.7° | 179.9° |
| C23 | C24 | C25 | C20 | 0.9° | 0.7° |
| C24 | C23 | C22 | H7 | 179.9° | 180.0° |
| C22 | C23 | C24 | C25 | 0.5° | 0.3° |
| C23 | C22 | C21 | H7 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 0.3° | 0.1° |
| C23 | C22 | C21 | H6 | 179.7° | 180.0° |
| C22 | C23 | C24 | H8 | 179.5° | 179.7° |
| C24 | C25 | N26 | C20 | 178.8° | 179.3° |
| C24 | C25 | C20 | C21 | 1.1° | 0.7° |
| C24 | C25 | N26 | C18 | 179.1° | 179.3° |
| C24 | C25 | C20 | N19 | 179.2° | 179.6° |
| C24 | C25 | N26 | H18 | 0.9° | 0.1° |
| C22 | C21 | C20 | C25 | 0.8° | 0.4° |
| C22 | C21 | C20 | H6 | 180.0° | 179.9° |
| C22 | C21 | C20 | N19 | 179.6° | 180.0° |
| N26 | C25 | C20 | C21 | 177.9° | 179.8° |
| C25 | N26 | C18 | H18 | 180.0° | 179.4° |
| N26 | C25 | C20 | N19 | 1.8° | 0.2° |
| C25 | N26 | C18 | N19 | 1.4° | 0.2° |
| C25 | N26 | C18 | C15 | 175.9° | 179.9° |
| N26 | C25 | C24 | H8 | 2.3° | 0.1° |
| C25 | C20 | C21 | N19 | 179.6° | 179.6° |
| C20 | C25 | N26 | C18 | 0.4° | 0.0° |
| C25 | C20 | N19 | C18 | 2.7° | 0.3° |
| C25 | C20 | C21 | H6 | 179.2° | 179.6° |
| C20 | C25 | C24 | H8 | 179.1° | 179.4° |
| C20 | C25 | N26 | H18 | 179.6° | 179.4° |
| C21 | C20 | N19 | C18 | 176.9° | 179.9° |
| C20 | C21 | C22 | H7 | 179.7° | 180.0° |
| N26 | C18 | N19 | C20 | 2.5° | 0.3° |
| N26 | C18 | N19 | C15 | 174.4° | 179.7° |
| N26 | C18 | C15 | C14 | 23.4° | 0.6° |
| N26 | C18 | C15 | C16 | 151.4° | 179.6° |
| C20 | N19 | C18 | C15 | 176.9° | 180.0° |
| N19 | C20 | C21 | H6 | 0.4° | 0.1° |
| N19 | C18 | C15 | C14 | 163.0° | 179.7° |
| N19 | C18 | C15 | C16 | 22.2° | 0.0° |
| N19 | C18 | N26 | H18 | 178.6° | 179.6° |
| C18 | C15 | C14 | C16 | 174.9° | 179.7° |
| C18 | C15 | C14 | C13 | 178.4° | 179.7° |
| C18 | C15 | C16 | C17 | 177.8° | 180.0° |
| C18 | C15 | C14 | H15 | 1.6° | 0.2° |
| C18 | C15 | C16 | H16 | 2.3° | 0.3° |
| C15 | C18 | N26 | H18 | 4.1° | 0.7° |
| C15 | C14 | C13 | H15 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 2.6° | 0.0° |
| C14 | C15 | C16 | C17 | 2.8° | 0.3° |
| C15 | C14 | C13 | H4 | 177.4° | 179.7° |
| C14 | C15 | C16 | H16 | 177.3° | 180.0° |
| C13 | C14 | C15 | C16 | 3.5° | 0.0° |
| C14 | C13 | C12 | H4 | 180.0° | 179.7° |
| C14 | C13 | C12 | C17 | 0.9° | 0.3° |
| C14 | C13 | C12 | O11 | 179.1° | 179.8° |
| C15 | C16 | C17 | H16 | 180.0° | 179.7° |
| C15 | C16 | C17 | C12 | 1.1° | 0.5° |
| C15 | C16 | C17 | H5 | 178.9° | 179.9° |
| C16 | C15 | C14 | H15 | 176.5° | 179.9° |
| C13 | C12 | C17 | C16 | 0.2° | 0.6° |
| C13 | C12 | C17 | O11 | 179.9° | 179.9° |
| C13 | C12 | O11 | C06 | 169.5° | 90.1° |
| C13 | C12 | C17 | H5 | 179.8° | 179.9° |
| C12 | C13 | C14 | H15 | 177.4° | 179.9° |
| C16 | C17 | C12 | H5 | 180.0° | 179.5° |
| C16 | C17 | C12 | O11 | 179.9° | 179.5° |
| C17 | C12 | O11 | C06 | 10.6° | 89.8° |
| C17 | C12 | C13 | H4 | 179.1° | 180.0° |
| C12 | C17 | C16 | H16 | 178.9° | 179.7° |
| C12 | O11 | C06 | C05 | 121.4° | 179.5° |
| C12 | O11 | C06 | C07 | 62.9° | 0.5° |
| O11 | C12 | C13 | H4 | 0.9° | 0.1° |
| O11 | C12 | C17 | H5 | 0.1° | 0.0° |
| O11 | C06 | C05 | C07 | 175.8° | 180.0° |
| O11 | C06 | C05 | C04 | 178.0° | 180.0° |
| O11 | C06 | C07 | C08 | 177.5° | 180.0° |
| O11 | C06 | C05 | H13 | 2.0° | 0.0° |
| O11 | C06 | C07 | H14 | 2.5° | 0.0° |
| C06 | C05 | C04 | H13 | 180.0° | 179.9° |
| C06 | C05 | C04 | C03 | 1.3° | 0.0° |
| C05 | C06 | C07 | C08 | 1.9° | 0.0° |
| C06 | C05 | C04 | H12 | 178.7° | 180.0° |
| C05 | C06 | C07 | H14 | 178.1° | 180.0° |
| C04 | C05 | C06 | C07 | 2.2° | 0.0° |
| C05 | C04 | C03 | H12 | 180.0° | 180.0° |
| C05 | C04 | C03 | C08 | 0.1° | 0.0° |
| C05 | C04 | C03 | O02 | 179.9° | 179.7° |
| C06 | C07 | C08 | H14 | 180.0° | 180.0° |
| C06 | C07 | C08 | C03 | 0.7° | 0.0° |
| C06 | C07 | C08 | O09 | 179.3° | 179.8° |
| C07 | C06 | C05 | H13 | 177.8° | 180.0° |
| C04 | C03 | C08 | C07 | 0.1° | 0.0° |
| C04 | C03 | C08 | O02 | 179.8° | 179.7° |
| C04 | C03 | C08 | O09 | 179.8° | 179.7° |
| C04 | C03 | O02 | C01 | 1.7° | 0.3° |
| C03 | C04 | C05 | H13 | 178.7° | 180.0° |
| C07 | C08 | C03 | O09 | 180.0° | 179.8° |
| C07 | C08 | C03 | O02 | 179.7° | 179.7° |
| C07 | C08 | O09 | C10 | 8.3° | 0.2° |
| C08 | C03 | O02 | C01 | 178.1° | 180.0° |
| C03 | C08 | O09 | C10 | 171.6° | 180.0° |
| C08 | C03 | C04 | H12 | 179.9° | 180.0° |
| C03 | C08 | C07 | H14 | 179.3° | 179.9° |
| O02 | C03 | C08 | O09 | 0.4° | 0.1° |
| C03 | O02 | C01 | H9 | 180.0° | 59.9° |
| C03 | O02 | C01 | H10 | 60.0° | 180.0° |
| C03 | O02 | C01 | H11 | 60.0° | 60.0° |
| O02 | C03 | C04 | H12 | 0.1° | 0.3° |
| C08 | O09 | C10 | H1 | 180.0° | 60.1° |
| C08 | O09 | C10 | H2 | 60.0° | 60.0° |
| C08 | O09 | C10 | H3 | 60.0° | 180.0° |
| O09 | C08 | C07 | H14 | 0.7° | 0.3° |
| O02 | C01 | H9 | H10 | 120.0° | 120.1° |
| O02 | C01 | H9 | H11 | 120.0° | 119.9° |
| O02 | C01 | H10 | H11 | 120.0° | 120.0° |
| O09 | C10 | H1 | H2 | 120.0° | 120.1° |
| O09 | C10 | H1 | H3 | 120.0° | 120.0° |
| O09 | C10 | H2 | H3 | 120.0° | 120.0° |
| H1 | C10 | H2 | H3 | 119.9° | 119.9° |
| H4 | C13 | C14 | H15 | 2.6° | 0.2° |
| H5 | C17 | C16 | H16 | 1.1° | 0.2° |
| H6 | C21 | C22 | H7 | 0.3° | 0.0° |
| H9 | C01 | H10 | H11 | 120.0° | 120.0° |
| H12 | C04 | C05 | H13 | 1.3° | 0.1° |
