T6Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O04 | C03 | doub | 1.22Å | 1.17Å | |
| C03 | C05 | sing | 1.41Å | 1.43Å | |
| C03 | N02 | sing | 1.34Å | 1.30Å | |
| C05 | C06 | doub | 1.36Å | 1.39Å | |
| O10 | P08 | doub | 1.48Å | 1.47Å | |
| C01 | N02 | sing | 1.47Å | 1.48Å | |
| N02 | C17 | sing | 1.38Å | 1.32Å | |
| O09 | P08 | sing | 1.61Å | 1.55Å | |
| C06 | C07 | sing | 1.51Å | 1.54Å | |
| C06 | C12 | sing | 1.46Å | 1.40Å | |
| P08 | C07 | sing | 1.82Å | 1.84Å | |
| P08 | O11 | sing | 1.61Å | 1.49Å | |
| C17 | C12 | doub | 1.41Å | 1.41Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.40Å | 1.35Å | Aromatic |
| C16 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | doub | 1.37Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.39Å | 1.38Å | Aromatic |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C05 | H4 | sing | 1.08Å | 1.08Å | |
| C07 | H5 | sing | 1.09Å | 1.10Å | |
| C07 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C16 | H10 | sing | 1.08Å | 1.08Å | |
| O09 | H11 | sing | 0.97Å | 0.95Å | |
| O11 | H12 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O04 | C03 | C05 | 122.3° | 119.1° |
| O04 | C03 | N02 | 119.5° | 119.2° |
| C05 | C03 | N02 | 118.2° | 121.7° |
| C03 | C05 | C06 | 121.3° | 120.2° |
| C03 | C05 | H4 | 119.4° | 119.9° |
| C03 | N02 | C01 | 119.7° | 119.5° |
| C03 | N02 | C17 | 124.3° | 121.0° |
| C05 | C06 | C07 | 124.0° | 120.7° |
| C05 | C06 | C12 | 116.1° | 118.5° |
| C06 | C05 | H4 | 119.3° | 119.9° |
| O10 | P08 | O09 | 106.9° | 109.4° |
| O10 | P08 | C07 | 112.6° | 109.5° |
| O10 | P08 | O11 | 113.3° | 109.5° |
| C01 | N02 | C17 | 115.8° | 119.5° |
| N02 | C01 | H1 | 109.5° | 109.5° |
| N02 | C01 | H2 | 109.5° | 109.5° |
| N02 | C01 | H3 | 109.5° | 109.4° |
| N02 | C17 | C12 | 119.3° | 119.6° |
| N02 | C17 | C16 | 123.2° | 121.0° |
| O09 | P08 | C07 | 107.4° | 109.5° |
| O09 | P08 | O11 | 108.7° | 109.5° |
| P08 | O09 | H11 | 109.5° | 114.0° |
| C07 | C06 | C12 | 120.0° | 120.7° |
| C06 | C07 | P08 | 111.3° | 109.5° |
| C06 | C07 | H5 | 109.0° | 109.5° |
| C06 | C07 | H6 | 109.0° | 109.5° |
| C06 | C12 | C17 | 120.8° | 119.0° |
| C06 | C12 | C13 | 118.8° | 121.2° |
| C07 | P08 | O11 | 107.6° | 109.5° |
| P08 | C07 | H5 | 109.0° | 109.5° |
| P08 | C07 | H6 | 109.0° | 109.5° |
| P08 | O11 | H12 | 109.5° | 114.1° |
| C12 | C17 | C16 | 117.5° | 119.4° |
| C17 | C12 | C13 | 120.5° | 119.9° |
| C17 | C16 | C15 | 121.1° | 119.7° |
| C17 | C16 | H10 | 119.4° | 120.1° |
| C12 | C13 | C14 | 122.2° | 119.7° |
| C12 | C13 | H7 | 118.9° | 120.2° |
| C16 | C15 | C14 | 121.0° | 120.7° |
| C16 | C15 | H9 | 119.5° | 119.7° |
| C15 | C16 | H10 | 119.4° | 120.2° |
| C13 | C14 | C15 | 117.7° | 120.6° |
| C14 | C13 | H7 | 118.9° | 120.1° |
| C13 | C14 | H8 | 121.2° | 119.7° |
| C15 | C14 | H8 | 121.2° | 119.7° |
| C14 | C15 | H9 | 119.5° | 119.6° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.4° |
| H2 | C01 | H3 | 109.5° | 109.4° |
| H5 | C07 | H6 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O04 | C03 | C05 | N02 | 176.3° | 179.8° |
| O04 | C03 | C05 | C06 | 178.8° | 179.8° |
| O04 | C03 | N02 | C01 | 4.3° | 0.3° |
| O04 | C03 | N02 | C17 | 179.1° | 179.7° |
| O04 | C03 | C05 | H4 | 1.2° | 0.3° |
| C03 | C05 | C06 | H4 | 180.0° | 180.0° |
| C05 | C03 | N02 | C01 | 179.3° | 180.0° |
| C05 | C03 | N02 | C17 | 4.5° | 0.0° |
| C03 | C05 | C06 | C07 | 178.1° | 180.0° |
| C03 | C05 | C06 | C12 | 0.9° | 0.0° |
| N02 | C03 | C05 | C06 | 2.5° | 0.0° |
| C03 | N02 | C01 | C17 | 175.2° | 180.0° |
| C03 | N02 | C17 | C12 | 4.8° | 0.0° |
| C03 | N02 | C17 | C16 | 178.1° | 180.0° |
| C03 | N02 | C01 | H1 | 180.0° | 0.1° |
| C03 | N02 | C01 | H2 | 60.0° | 120.0° |
| C03 | N02 | C01 | H3 | 60.0° | 120.0° |
| N02 | C03 | C05 | H4 | 177.5° | 180.0° |
| C05 | C06 | C07 | C12 | 179.0° | 179.9° |
| C05 | C06 | C07 | P08 | 98.8° | 0.0° |
| C05 | C06 | C12 | C17 | 1.2° | 0.0° |
| C05 | C06 | C12 | C13 | 179.0° | 179.9° |
| C05 | C06 | C07 | H5 | 21.5° | 120.0° |
| C05 | C06 | C07 | H6 | 141.0° | 120.0° |
| O10 | P08 | O09 | C07 | 121.1° | 120.0° |
| O10 | P08 | O09 | O11 | 122.7° | 120.0° |
| O10 | P08 | C07 | C06 | 33.9° | 55.0° |
| O10 | P08 | C07 | O11 | 125.6° | 120.0° |
| O10 | P08 | C07 | H5 | 86.4° | 175.0° |
| O10 | P08 | C07 | H6 | 154.1° | 65.0° |
| O10 | P08 | O09 | H11 | 0.0° | 60.0° |
| O10 | P08 | O11 | H12 | 0.0° | 180.0° |
| C01 | N02 | C17 | C12 | 179.8° | 179.9° |
| C01 | N02 | C17 | C16 | 3.1° | 0.0° |
| N02 | C01 | H1 | H2 | 120.0° | 120.1° |
| N02 | C01 | H1 | H3 | 120.0° | 120.0° |
| N02 | C01 | H2 | H3 | 120.0° | 120.0° |
| N02 | C17 | C12 | C06 | 3.0° | 0.0° |
| N02 | C17 | C12 | C16 | 177.3° | 180.0° |
| N02 | C17 | C12 | C13 | 179.2° | 180.0° |
| N02 | C17 | C16 | C15 | 178.4° | 179.9° |
| C17 | N02 | C01 | H1 | 4.8° | 179.9° |
| C17 | N02 | C01 | H2 | 115.2° | 59.9° |
| C17 | N02 | C01 | H3 | 124.8° | 60.0° |
| N02 | C17 | C16 | H10 | 1.5° | 0.0° |
| O09 | P08 | C07 | C06 | 151.3° | 175.0° |
| O09 | P08 | C07 | O11 | 116.9° | 120.0° |
| O09 | P08 | C07 | H5 | 31.0° | 65.0° |
| O09 | P08 | C07 | H6 | 88.4° | 55.0° |
| O09 | P08 | O11 | H12 | 118.7° | 60.0° |
| C06 | C07 | P08 | H5 | 120.3° | 120.0° |
| C06 | C07 | P08 | H6 | 120.3° | 120.0° |
| C06 | C07 | P08 | O11 | 91.8° | 65.0° |
| C07 | C06 | C12 | C17 | 177.9° | 179.9° |
| C07 | C06 | C12 | C13 | 0.1° | 0.0° |
| C07 | C06 | C05 | H4 | 1.9° | 0.1° |
| C06 | C07 | H5 | H6 | 119.2° | 120.0° |
| C12 | C06 | C07 | P08 | 82.2° | 180.0° |
| C06 | C12 | C17 | C13 | 177.8° | 179.9° |
| C06 | C12 | C17 | C16 | 179.7° | 180.0° |
| C06 | C12 | C13 | C14 | 179.1° | 180.0° |
| C12 | C06 | C05 | H4 | 179.1° | 180.0° |
| C12 | C06 | C07 | H5 | 157.5° | 60.0° |
| C12 | C06 | C07 | H6 | 38.0° | 60.0° |
| C06 | C12 | C13 | H7 | 0.9° | 0.1° |
| P08 | C07 | H5 | H6 | 119.2° | 120.0° |
| C07 | P08 | O09 | H11 | 121.1° | 180.0° |
| C07 | P08 | O11 | H12 | 125.2° | 60.0° |
| O11 | P08 | C07 | H5 | 148.0° | 55.0° |
| O11 | P08 | C07 | H6 | 28.5° | 175.0° |
| O11 | P08 | O09 | H11 | 122.7° | 60.0° |
| C12 | C17 | C16 | C15 | 1.3° | 0.1° |
| C17 | C12 | C13 | C14 | 3.0° | 0.0° |
| C17 | C12 | C13 | H7 | 176.9° | 180.0° |
| C12 | C17 | C16 | H10 | 178.7° | 180.0° |
| C16 | C17 | C12 | C13 | 2.0° | 0.1° |
| C17 | C16 | C15 | H10 | 180.0° | 179.9° |
| C17 | C16 | C15 | C14 | 1.7° | 0.1° |
| C17 | C16 | C15 | H9 | 178.3° | 180.0° |
| C12 | C13 | C14 | H7 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 3.3° | 0.0° |
| C12 | C13 | C14 | H8 | 176.7° | 180.0° |
| C16 | C15 | C14 | C13 | 2.5° | 0.0° |
| C16 | C15 | C14 | H9 | 180.0° | 180.0° |
| C16 | C15 | C14 | H8 | 177.5° | 179.9° |
| C13 | C14 | C15 | H8 | 180.0° | 179.9° |
| C13 | C14 | C15 | H9 | 177.4° | 180.0° |
| C15 | C14 | C13 | H7 | 176.7° | 180.0° |
| C14 | C15 | C16 | H10 | 178.3° | 180.0° |
| H1 | C01 | H2 | H3 | 120.0° | 119.9° |
| H7 | C13 | C14 | H8 | 3.3° | 0.0° |
| H8 | C14 | C15 | H9 | 2.5° | 0.0° |
| H9 | C15 | C16 | H10 | 1.7° | 0.1° |
