ELT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O02 | P01 | doub | 1.48Å | 1.49Å | |
| C07 | C08 | sing | 1.53Å | 1.55Å | |
| C07 | O06 | sing | 1.43Å | 1.44Å | |
| O06 | P01 | sing | 1.61Å | 1.62Å | |
| P01 | N03 | sing | 1.68Å | 1.62Å | |
| C04 | N03 | sing | 1.47Å | 1.42Å | |
| N03 | C05 | sing | 1.47Å | 1.49Å | |
| P01 | O1 | sing | 1.61Å | 1.61Å | |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C04 | H2 | sing | 1.09Å | 1.10Å | |
| C04 | H3 | sing | 1.09Å | 1.10Å | |
| C05 | H4 | sing | 1.09Å | 1.10Å | |
| C05 | H5 | sing | 1.09Å | 1.10Å | |
| C05 | H6 | sing | 1.09Å | 1.10Å | |
| C07 | H7 | sing | 1.09Å | 1.10Å | |
| C07 | H8 | sing | 1.09Å | 1.10Å | |
| C08 | H9 | sing | 1.09Å | 1.10Å | |
| C08 | H10 | sing | 1.09Å | 1.10Å | |
| C08 | H11 | sing | 1.09Å | 1.10Å | |
| O1 | H12 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O02 | P01 | O06 | 111.8° | 109.5° |
| O02 | P01 | N03 | 114.7° | 109.4° |
| O02 | P01 | O1 | 114.6° | 109.5° |
| C08 | C07 | O06 | 115.9° | 109.5° |
| C08 | C07 | H7 | 107.8° | 109.5° |
| C08 | C07 | H8 | 107.9° | 109.5° |
| C07 | C08 | H9 | 109.5° | 109.4° |
| C07 | C08 | H10 | 109.5° | 109.5° |
| C07 | C08 | H11 | 109.5° | 109.5° |
| C07 | O06 | P01 | 117.6° | 123.0° |
| O06 | C07 | H7 | 107.8° | 109.4° |
| O06 | C07 | H8 | 107.8° | 109.4° |
| O06 | P01 | N03 | 111.9° | 109.5° |
| O06 | P01 | O1 | 106.2° | 109.5° |
| P01 | N03 | C04 | 119.6° | 111.0° |
| P01 | N03 | C05 | 115.4° | 111.0° |
| N03 | P01 | O1 | 96.5° | 109.5° |
| C04 | N03 | C05 | 113.7° | 111.0° |
| N03 | C04 | H1 | 109.5° | 109.5° |
| N03 | C04 | H2 | 109.5° | 109.5° |
| N03 | C04 | H3 | 109.5° | 109.5° |
| N03 | C05 | H4 | 109.5° | 109.4° |
| N03 | C05 | H5 | 109.5° | 109.5° |
| N03 | C05 | H6 | 109.5° | 109.5° |
| P01 | O1 | H12 | 109.5° | 114.0° |
| H1 | C04 | H2 | 109.5° | 109.5° |
| H1 | C04 | H3 | 109.5° | 109.5° |
| H2 | C04 | H3 | 109.5° | 109.5° |
| H4 | C05 | H5 | 109.5° | 109.5° |
| H4 | C05 | H6 | 109.4° | 109.5° |
| H5 | C05 | H6 | 109.4° | 109.4° |
| H7 | C07 | H8 | 109.5° | 109.5° |
| H9 | C08 | H10 | 109.5° | 109.5° |
| H9 | C08 | H11 | 109.5° | 109.5° |
| H10 | C08 | H11 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O02 | P01 | O06 | C07 | 24.7° | 45.5° |
| O02 | P01 | O06 | N03 | 130.2° | 120.0° |
| O02 | P01 | O06 | O1 | 125.7° | 120.0° |
| O02 | P01 | N03 | O1 | 120.9° | 120.0° |
| O02 | P01 | N03 | C04 | 47.1° | 60.6° |
| O02 | P01 | N03 | C05 | 171.6° | 175.5° |
| O02 | P01 | O1 | H12 | 0.0° | 180.0° |
| C08 | C07 | O06 | H7 | 120.9° | 120.0° |
| C08 | C07 | O06 | H8 | 121.0° | 120.0° |
| C08 | C07 | O06 | P01 | 135.1° | 174.9° |
| C08 | C07 | H7 | H8 | 117.1° | 120.1° |
| C07 | C08 | H9 | H10 | 120.0° | 120.0° |
| C07 | C08 | H9 | H11 | 120.0° | 120.0° |
| C07 | C08 | H10 | H11 | 120.0° | 120.0° |
| C07 | O06 | P01 | N03 | 105.6° | 74.5° |
| C07 | O06 | P01 | O1 | 150.3° | 165.5° |
| O06 | C07 | H7 | H8 | 117.1° | 119.9° |
| O06 | C07 | C08 | H9 | 180.0° | 60.1° |
| O06 | C07 | C08 | H10 | 60.0° | 60.0° |
| O06 | C07 | C08 | H11 | 60.0° | 180.0° |
| O06 | P01 | N03 | O1 | 110.4° | 120.0° |
| O06 | P01 | N03 | C04 | 81.6° | 179.5° |
| O06 | P01 | N03 | C05 | 59.7° | 55.5° |
| P01 | O06 | C07 | H7 | 14.2° | 65.1° |
| P01 | O06 | C07 | H8 | 104.0° | 54.8° |
| O06 | P01 | O1 | H12 | 124.0° | 60.0° |
| P01 | N03 | C04 | C05 | 141.9° | 124.0° |
| P01 | N03 | C04 | H1 | 180.0° | 61.9° |
| P01 | N03 | C04 | H2 | 60.0° | 178.1° |
| P01 | N03 | C04 | H3 | 60.0° | 58.1° |
| P01 | N03 | C05 | H4 | 180.0° | 60.0° |
| P01 | N03 | C05 | H5 | 60.0° | 179.9° |
| P01 | N03 | C05 | H6 | 60.0° | 60.0° |
| N03 | P01 | O1 | H12 | 120.9° | 60.0° |
| C04 | N03 | P01 | O1 | 168.0° | 59.5° |
| N03 | C04 | H1 | H2 | 120.0° | 120.0° |
| N03 | C04 | H1 | H3 | 120.0° | 120.0° |
| N03 | C04 | H2 | H3 | 120.0° | 120.0° |
| C04 | N03 | C05 | H4 | 36.4° | 176.0° |
| C04 | N03 | C05 | H5 | 156.4° | 56.0° |
| C04 | N03 | C05 | H6 | 83.6° | 64.0° |
| C05 | N03 | P01 | O1 | 50.7° | 64.5° |
| C05 | N03 | C04 | H1 | 38.1° | 62.1° |
| C05 | N03 | C04 | H2 | 81.9° | 57.9° |
| C05 | N03 | C04 | H3 | 158.1° | 177.9° |
| N03 | C05 | H4 | H5 | 120.0° | 120.0° |
| N03 | C05 | H4 | H6 | 120.0° | 120.0° |
| N03 | C05 | H5 | H6 | 120.0° | 120.0° |
| H1 | C04 | H2 | H3 | 120.0° | 120.0° |
| H4 | C05 | H5 | H6 | 120.0° | 120.0° |
| H7 | C07 | C08 | H9 | 59.1° | 180.0° |
| H7 | C07 | C08 | H10 | 60.9° | 60.0° |
| H7 | C07 | C08 | H11 | 179.1° | 60.0° |
| H8 | C07 | C08 | H9 | 59.1° | 59.9° |
| H8 | C07 | C08 | H10 | 179.0° | 180.0° |
| H8 | C07 | C08 | H11 | 60.9° | 60.0° |
| H9 | C08 | H10 | H11 | 120.0° | 120.0° |
