0K2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C13 | sing | 1.51Å | 1.39Å | |
| C30 | C27 | sing | 1.53Å | 1.49Å | |
| C13 | O33 | doub | 1.21Å | 1.38Å | |
| C28 | C27 | sing | 1.53Å | 1.57Å | |
| C28 | O29 | sing | 1.43Å | 1.48Å | |
| O29 | P13 | sing | 1.61Å | 1.61Å | |
| O20 | P17 | doub | 1.48Å | 1.48Å | |
| O18 | P17 | sing | 1.61Å | 1.53Å | |
| P13 | O16 | sing | 1.61Å | 1.64Å | |
| P13 | O15 | doub | 1.48Å | 1.43Å | |
| P13 | O14 | sing | 1.61Å | 1.58Å | |
| P17 | O16 | sing | 1.61Å | 1.63Å | |
| P17 | O19 | sing | 1.61Å | 1.54Å | |
| O18 | H1 | sing | 0.97Å | 0.95Å | |
| O19 | H2 | sing | 0.97Å | 0.95Å | |
| O14 | H3 | sing | 0.97Å | 0.95Å | |
| C28 | H4 | sing | 1.09Å | 1.10Å | |
| C28 | H5 | sing | 1.09Å | 1.10Å | |
| C27 | H6 | sing | 1.09Å | 1.10Å | |
| C27 | H7 | sing | 1.09Å | 1.10Å | |
| C30 | H8 | sing | 1.09Å | 1.10Å | |
| C30 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C30 | C27 | 122.5° | 109.5° |
| C30 | C13 | O33 | 119.0° | 120.0° |
| C13 | C30 | H8 | 106.1° | 109.5° |
| C13 | C30 | H9 | 106.1° | 109.5° |
| C30 | C13 | H10 | 120.5° | 120.0° |
| C30 | C27 | C28 | 114.4° | 109.5° |
| C30 | C27 | H6 | 108.2° | 109.5° |
| C30 | C27 | H7 | 108.2° | 109.4° |
| C27 | C30 | H8 | 106.1° | 109.4° |
| C27 | C30 | H9 | 106.1° | 109.4° |
| O33 | C13 | H10 | 120.5° | 120.0° |
| C27 | C28 | O29 | 112.8° | 109.5° |
| C27 | C28 | H4 | 108.6° | 109.5° |
| C27 | C28 | H5 | 108.7° | 109.5° |
| C28 | C27 | H6 | 108.2° | 109.5° |
| C28 | C27 | H7 | 108.2° | 109.5° |
| C28 | O29 | P13 | 125.1° | 123.1° |
| O29 | C28 | H4 | 108.6° | 109.4° |
| O29 | C28 | H5 | 108.6° | 109.4° |
| O29 | P13 | O16 | 105.6° | 109.5° |
| O29 | P13 | O15 | 102.0° | 109.4° |
| O29 | P13 | O14 | 111.8° | 109.5° |
| O20 | P17 | O18 | 115.3° | 109.5° |
| O20 | P17 | O16 | 120.1° | 109.5° |
| O20 | P17 | O19 | 105.7° | 109.5° |
| O18 | P17 | O16 | 99.9° | 109.5° |
| O18 | P17 | O19 | 108.4° | 109.4° |
| P17 | O18 | H1 | 109.5° | 114.0° |
| O16 | P13 | O15 | 114.5° | 109.5° |
| O16 | P13 | O14 | 102.1° | 109.5° |
| P13 | O16 | P17 | 129.4° | 134.0° |
| O15 | P13 | O14 | 120.2° | 109.5° |
| P13 | O14 | H3 | 109.5° | 114.0° |
| O16 | P17 | O19 | 106.9° | 109.5° |
| P17 | O19 | H2 | 109.5° | 114.0° |
| H4 | C28 | H5 | 109.5° | 109.5° |
| H6 | C27 | H7 | 109.5° | 109.5° |
| H8 | C30 | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C30 | C27 | H8 | 121.8° | 120.0° |
| C13 | C30 | C27 | H9 | 121.8° | 120.0° |
| C30 | C13 | O33 | H10 | 180.0° | 180.0° |
| C13 | C30 | C27 | C28 | 178.6° | 180.0° |
| C13 | C30 | C27 | H6 | 60.7° | 60.0° |
| C13 | C30 | C27 | H7 | 57.8° | 60.0° |
| C13 | C30 | H8 | H9 | 114.1° | 120.1° |
| C27 | C30 | C13 | O33 | 53.9° | 125.0° |
| C30 | C27 | C28 | H6 | 120.7° | 120.0° |
| C30 | C27 | C28 | H7 | 120.7° | 120.0° |
| C30 | C27 | C28 | O29 | 83.4° | 180.0° |
| C30 | C27 | C28 | H4 | 37.0° | 60.0° |
| C30 | C27 | C28 | H5 | 156.1° | 60.0° |
| C30 | C27 | H6 | H7 | 117.7° | 120.0° |
| C27 | C30 | H8 | H9 | 114.2° | 120.0° |
| C27 | C30 | C13 | H10 | 126.2° | 55.0° |
| O33 | C13 | C30 | H8 | 67.9° | 5.1° |
| O33 | C13 | C30 | H9 | 175.7° | 115.0° |
| C27 | C28 | O29 | H4 | 120.5° | 120.0° |
| C27 | C28 | O29 | H5 | 120.5° | 120.0° |
| C27 | C28 | O29 | P13 | 53.8° | 180.0° |
| C27 | C28 | H4 | H5 | 118.5° | 120.1° |
| C28 | C27 | H6 | H7 | 117.8° | 120.0° |
| C28 | C27 | C30 | H8 | 56.8° | 60.0° |
| C28 | C27 | C30 | H9 | 59.6° | 60.0° |
| C28 | O29 | P13 | O16 | 77.4° | 175.0° |
| C28 | O29 | P13 | O15 | 162.6° | 55.0° |
| C28 | O29 | P13 | O14 | 32.8° | 65.0° |
| O29 | C28 | H4 | H5 | 118.5° | 119.9° |
| O29 | C28 | C27 | H6 | 155.9° | 60.0° |
| O29 | C28 | C27 | H7 | 37.3° | 60.0° |
| O29 | P13 | O16 | O15 | 111.4° | 120.0° |
| O29 | P13 | O16 | O14 | 117.0° | 120.0° |
| O29 | P13 | O15 | O14 | 124.3° | 120.0° |
| O29 | P13 | O16 | P17 | 81.8° | 164.9° |
| O29 | P13 | O14 | H3 | 119.5° | 60.0° |
| P13 | O29 | C28 | H4 | 174.2° | 60.0° |
| P13 | O29 | C28 | H5 | 66.7° | 60.0° |
| O20 | P17 | O18 | O16 | 130.2° | 120.0° |
| O20 | P17 | O18 | O19 | 118.2° | 120.0° |
| O20 | P17 | O16 | P13 | 23.7° | 40.0° |
| O20 | P17 | O16 | O19 | 120.2° | 120.0° |
| O20 | P17 | O18 | H1 | 0.0° | 60.0° |
| O20 | P17 | O19 | H2 | 0.0° | 180.0° |
| O18 | P17 | O16 | P13 | 150.7° | 160.0° |
| O18 | P17 | O16 | O19 | 112.8° | 120.0° |
| O18 | P17 | O19 | H2 | 124.1° | 60.0° |
| O16 | P13 | O15 | O14 | 122.2° | 120.0° |
| P13 | O16 | P17 | O19 | 96.5° | 80.0° |
| O16 | P13 | O14 | H3 | 128.1° | 60.0° |
| O15 | P13 | O16 | P17 | 29.7° | 45.0° |
| O15 | P13 | O14 | H3 | 0.0° | 180.0° |
| O14 | P13 | O16 | P17 | 161.2° | 75.0° |
| O16 | P17 | O18 | H1 | 130.2° | 180.0° |
| O16 | P17 | O19 | H2 | 129.0° | 60.0° |
| O19 | P17 | O18 | H1 | 118.2° | 60.0° |
| H4 | C28 | C27 | H6 | 83.7° | 180.0° |
| H4 | C28 | C27 | H7 | 157.8° | 59.9° |
| H5 | C28 | C27 | H6 | 35.4° | 60.0° |
| H5 | C28 | C27 | H7 | 83.2° | 180.0° |
| H6 | C27 | C30 | H8 | 177.5° | 180.0° |
| H6 | C27 | C30 | H9 | 61.1° | 60.0° |
| H7 | C27 | C30 | H8 | 63.9° | 60.0° |
| H7 | C27 | C30 | H9 | 179.7° | 180.0° |
| H8 | C30 | C13 | H10 | 112.1° | 175.0° |
| H9 | C30 | C13 | H10 | 4.3° | 65.0° |
