7D4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O26 | P25 | doub | 1.48Å | 1.56Å | |
| O28 | P25 | sing | 1.61Å | 1.56Å | |
| P25 | O27 | sing | 1.61Å | 1.53Å | |
| P25 | O24 | sing | 1.61Å | 1.56Å | |
| O30 | C29 | sing | 1.43Å | 1.38Å | |
| O24 | P21 | sing | 1.61Å | 1.65Å | |
| C29 | C12 | sing | 1.53Å | 1.56Å | |
| C13 | C15 | sing | 1.53Å | 1.52Å | |
| C13 | O14 | sing | 1.44Å | 1.47Å | |
| C13 | C12 | sing | 1.54Å | 1.40Å | |
| C15 | O16 | sing | 1.43Å | 1.39Å | |
| O14 | C11 | sing | 1.44Å | 1.40Å | |
| C12 | C11 | sing | 1.54Å | 1.47Å | |
| C11 | N10 | sing | 1.47Å | 1.40Å | |
| P21 | O22 | doub | 1.48Å | 1.51Å | |
| P21 | O23 | sing | 1.61Å | 1.55Å | |
| P21 | O20 | sing | 1.61Å | 1.61Å | |
| O19 | P17 | doub | 1.48Å | 1.49Å | |
| O16 | P17 | sing | 1.61Å | 1.59Å | |
| O20 | P17 | sing | 1.61Å | 1.63Å | |
| P17 | O18 | sing | 1.61Å | 1.48Å | |
| N10 | C03 | sing | 1.37Å | 1.39Å | Aromatic |
| N10 | C09 | sing | 1.36Å | 1.34Å | Aromatic |
| N02 | C03 | doub | 1.33Å | 1.39Å | Aromatic |
| N02 | C01 | sing | 1.32Å | 1.32Å | Aromatic |
| C03 | C04 | sing | 1.40Å | 1.40Å | Aromatic |
| C09 | N08 | doub | 1.30Å | 1.34Å | Aromatic |
| C01 | N06 | doub | 1.32Å | 1.33Å | Aromatic |
| C04 | N08 | sing | 1.35Å | 1.37Å | Aromatic |
| C04 | C05 | doub | 1.41Å | 1.43Å | Aromatic |
| N06 | C05 | sing | 1.33Å | 1.36Å | Aromatic |
| C05 | N07 | sing | 1.38Å | 1.40Å | |
| C01 | H1 | sing | 1.08Å | 1.08Å | |
| N07 | H2 | sing | 0.97Å | 1.00Å | |
| N07 | H3 | sing | 0.97Å | 1.00Å | |
| C09 | H4 | sing | 1.08Å | 1.08Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| O18 | H10 | sing | 0.97Å | 0.95Å | |
| O23 | H11 | sing | 0.97Å | 0.95Å | |
| O27 | H12 | sing | 0.97Å | 0.95Å | |
| O28 | H13 | sing | 0.97Å | 0.95Å | |
| C29 | H14 | sing | 1.09Å | 1.10Å | |
| C29 | H15 | sing | 1.09Å | 1.10Å | |
| O30 | H16 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O26 | P25 | O28 | 108.0° | 109.5° |
| O26 | P25 | O27 | 107.7° | 109.5° |
| O26 | P25 | O24 | 111.5° | 109.5° |
| O28 | P25 | O27 | 110.1° | 109.5° |
| O28 | P25 | O24 | 109.7° | 109.5° |
| P25 | O28 | H13 | 109.5° | 114.0° |
| O27 | P25 | O24 | 109.8° | 109.5° |
| P25 | O27 | H12 | 109.5° | 114.0° |
| P25 | O24 | P21 | 127.5° | 134.0° |
| O30 | C29 | C12 | 110.9° | 109.5° |
| O30 | C29 | H14 | 109.1° | 109.5° |
| O30 | C29 | H15 | 109.1° | 109.5° |
| C29 | O30 | H16 | 109.5° | 114.0° |
| O24 | P21 | O22 | 111.5° | 109.5° |
| O24 | P21 | O23 | 110.3° | 109.4° |
| O24 | P21 | O20 | 109.1° | 109.5° |
| C29 | C12 | C13 | 111.6° | 113.9° |
| C29 | C12 | C11 | 114.0° | 113.8° |
| C29 | C12 | H6 | 111.8° | 113.0° |
| C12 | C29 | H14 | 109.1° | 109.5° |
| C12 | C29 | H15 | 109.1° | 109.5° |
| C15 | C13 | O14 | 113.2° | 113.8° |
| C15 | C13 | C12 | 115.2° | 113.9° |
| C13 | C15 | O16 | 110.5° | 109.5° |
| C15 | C13 | H7 | 111.6° | 113.1° |
| C13 | C15 | H8 | 109.2° | 109.4° |
| C13 | C15 | H9 | 109.2° | 109.5° |
| O14 | C13 | C12 | 89.2° | 85.5° |
| C13 | O14 | C11 | 90.5° | 93.2° |
| O14 | C13 | H7 | 112.4° | 113.9° |
| C13 | C12 | C11 | 90.4° | 85.8° |
| C13 | C12 | H6 | 114.4° | 113.8° |
| C12 | C13 | H7 | 113.5° | 113.8° |
| C15 | O16 | P17 | 121.4° | 123.0° |
| O16 | C15 | H8 | 109.2° | 109.5° |
| O16 | C15 | H9 | 109.2° | 109.5° |
| O14 | C11 | C12 | 88.6° | 85.6° |
| O14 | C11 | N10 | 112.7° | 113.9° |
| O14 | C11 | H5 | 112.7° | 113.9° |
| C12 | C11 | N10 | 116.2° | 113.8° |
| C12 | C11 | H5 | 111.6° | 113.9° |
| C11 | C12 | H6 | 113.1° | 113.9° |
| C11 | N10 | C03 | 126.5° | 126.3° |
| C11 | N10 | C09 | 125.9° | 126.2° |
| N10 | C11 | H5 | 112.8° | 113.0° |
| O22 | P21 | O23 | 108.6° | 109.4° |
| O22 | P21 | O20 | 109.4° | 109.5° |
| O23 | P21 | O20 | 107.9° | 109.5° |
| P21 | O23 | H11 | 109.5° | 114.0° |
| P21 | O20 | P17 | 128.0° | 134.0° |
| O19 | P17 | O16 | 110.7° | 109.5° |
| O19 | P17 | O20 | 110.3° | 109.5° |
| O19 | P17 | O18 | 109.1° | 109.5° |
| O16 | P17 | O20 | 108.8° | 109.5° |
| O16 | P17 | O18 | 109.7° | 109.5° |
| O20 | P17 | O18 | 108.2° | 109.5° |
| P17 | O18 | H10 | 109.5° | 114.0° |
| C03 | N10 | C09 | 107.6° | 107.5° |
| N10 | C03 | N02 | 134.6° | 134.9° |
| N10 | C03 | C04 | 106.9° | 106.0° |
| N10 | C09 | N08 | 110.5° | 109.9° |
| N10 | C09 | H4 | 124.7° | 125.1° |
| C03 | N02 | C01 | 120.6° | 120.6° |
| N02 | C03 | C04 | 118.5° | 119.1° |
| N02 | C01 | N06 | 122.9° | 122.5° |
| N02 | C01 | H1 | 118.6° | 118.7° |
| C03 | C04 | N08 | 106.7° | 107.2° |
| C03 | C04 | C05 | 118.3° | 118.1° |
| C09 | N08 | C04 | 108.4° | 109.4° |
| N08 | C09 | H4 | 124.8° | 125.0° |
| C01 | N06 | C05 | 120.6° | 121.1° |
| N06 | C01 | H1 | 118.5° | 118.7° |
| N08 | C04 | C05 | 135.0° | 134.7° |
| C04 | C05 | N06 | 119.1° | 118.5° |
| C04 | C05 | N07 | 120.7° | 120.8° |
| N06 | C05 | N07 | 120.2° | 120.7° |
| C05 | N07 | H2 | 109.5° | 120.0° |
| C05 | N07 | H3 | 109.4° | 120.0° |
| H2 | N07 | H3 | 109.5° | 120.0° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H14 | C29 | H15 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O26 | P25 | O28 | O27 | 117.4° | 120.0° |
| O26 | P25 | O28 | O24 | 121.6° | 120.0° |
| O26 | P25 | O27 | O24 | 121.6° | 120.0° |
| O26 | P25 | O24 | P21 | 175.3° | 45.0° |
| O26 | P25 | O27 | H12 | 0.0° | 60.0° |
| O26 | P25 | O28 | H13 | 0.0° | 179.9° |
| O28 | P25 | O27 | O24 | 120.9° | 120.0° |
| O28 | P25 | O24 | P21 | 65.1° | 74.9° |
| O28 | P25 | O27 | H12 | 117.5° | 60.0° |
| O27 | P25 | O24 | P21 | 56.0° | 165.0° |
| O27 | P25 | O28 | H13 | 117.4° | 60.0° |
| P25 | O24 | P21 | O22 | 3.5° | 44.9° |
| P25 | O24 | P21 | O23 | 117.3° | 75.0° |
| P25 | O24 | P21 | O20 | 124.4° | 165.0° |
| O24 | P25 | O27 | H12 | 121.6° | 180.0° |
| O24 | P25 | O28 | H13 | 121.6° | 60.0° |
| O30 | C29 | C12 | H14 | 120.2° | 120.0° |
| O30 | C29 | C12 | H15 | 120.2° | 120.0° |
| O30 | C29 | C12 | C13 | 51.0° | 88.8° |
| O30 | C29 | C12 | C11 | 49.6° | 175.0° |
| O30 | C29 | C12 | H6 | 179.4° | 43.1° |
| O30 | C29 | H14 | H15 | 119.3° | 120.0° |
| O24 | P21 | O22 | O23 | 121.8° | 119.9° |
| O24 | P21 | O22 | O20 | 120.7° | 120.1° |
| O24 | P21 | O23 | O20 | 119.0° | 120.0° |
| O24 | P21 | O20 | P17 | 83.8° | 160.0° |
| O24 | P21 | O23 | H11 | 122.5° | 60.1° |
| C29 | C12 | C13 | C15 | 120.0° | 109.2° |
| C29 | C12 | C13 | O14 | 124.6° | 136.7° |
| C29 | C12 | C13 | C11 | 116.1° | 114.2° |
| C29 | C12 | C13 | H6 | 128.2° | 131.5° |
| C29 | C12 | C11 | O14 | 122.9° | 136.8° |
| C29 | C12 | C11 | H6 | 129.1° | 131.5° |
| C29 | C12 | C11 | N10 | 122.4° | 108.9° |
| C29 | C12 | C11 | H5 | 8.9° | 22.6° |
| C29 | C12 | C13 | H7 | 10.5° | 22.5° |
| C12 | C29 | H14 | H15 | 119.3° | 120.0° |
| C12 | C29 | O30 | H16 | 180.0° | 180.0° |
| C15 | C13 | O14 | C12 | 117.2° | 114.2° |
| C15 | C13 | O14 | H7 | 127.6° | 131.6° |
| C15 | C13 | C12 | H7 | 130.5° | 131.7° |
| C13 | C15 | O16 | H8 | 120.1° | 120.0° |
| C13 | C15 | O16 | H9 | 120.1° | 120.0° |
| C15 | C13 | O14 | C11 | 126.2° | 138.4° |
| C15 | C13 | C12 | C11 | 123.9° | 136.6° |
| C13 | C15 | O16 | P17 | 159.5° | 180.0° |
| C15 | C13 | C12 | H6 | 8.2° | 22.4° |
| C13 | C15 | H8 | H9 | 119.5° | 120.0° |
| O14 | C13 | C12 | H7 | 114.2° | 114.2° |
| O14 | C13 | C15 | O16 | 44.2° | 84.5° |
| O14 | C13 | C12 | C11 | 8.5° | 22.5° |
| C13 | O14 | C11 | N10 | 126.4° | 138.3° |
| C13 | O14 | C11 | H5 | 104.4° | 90.1° |
| O14 | C13 | C12 | H6 | 107.2° | 91.8° |
| O14 | C13 | C15 | H8 | 76.0° | 155.5° |
| O14 | C13 | C15 | H9 | 164.3° | 35.5° |
| C12 | C13 | C15 | O16 | 56.4° | 179.5° |
| C13 | C12 | C11 | H6 | 116.9° | 114.2° |
| C13 | C12 | C11 | N10 | 123.6° | 136.7° |
| C13 | C12 | C11 | H5 | 105.1° | 91.7° |
| C12 | C13 | C15 | H8 | 176.6° | 59.6° |
| C12 | C13 | C15 | H9 | 63.7° | 60.4° |
| C13 | C12 | C29 | H14 | 69.2° | 31.2° |
| C13 | C12 | C29 | H15 | 171.3° | 151.2° |
| C15 | O16 | P17 | O19 | 34.7° | 55.0° |
| C15 | O16 | P17 | O20 | 86.7° | 175.0° |
| C15 | O16 | P17 | O18 | 155.1° | 65.0° |
| O16 | C15 | C13 | H7 | 172.1° | 47.5° |
| O16 | C15 | H8 | H9 | 119.5° | 120.1° |
| O14 | C11 | C12 | N10 | 114.7° | 114.2° |
| O14 | C11 | C12 | H5 | 114.0° | 114.2° |
| O14 | C11 | N10 | H5 | 129.1° | 132.0° |
| O14 | C11 | N10 | C03 | 121.7° | 176.7° |
| O14 | C11 | N10 | C09 | 57.8° | 3.3° |
| O14 | C11 | C12 | H6 | 108.0° | 91.7° |
| C11 | O14 | C13 | H7 | 106.3° | 90.0° |
| C12 | C11 | N10 | H5 | 130.7° | 132.0° |
| C12 | C11 | N10 | C03 | 138.2° | 87.3° |
| C12 | C11 | N10 | C09 | 42.4° | 92.7° |
| C11 | C12 | C13 | H7 | 105.6° | 91.7° |
| C11 | C12 | C29 | H14 | 169.8° | 65.0° |
| C11 | C12 | C29 | H15 | 70.6° | 55.0° |
| C11 | N10 | C03 | C09 | 179.5° | 180.0° |
| C11 | N10 | C03 | N02 | 1.0° | 0.0° |
| C11 | N10 | C03 | C04 | 179.7° | 180.0° |
| C11 | N10 | C09 | N08 | 179.7° | 180.0° |
| C11 | N10 | C09 | H4 | 0.3° | 0.0° |
| N10 | C11 | C12 | H6 | 6.7° | 22.5° |
| O22 | P21 | O23 | O20 | 118.5° | 120.0° |
| O22 | P21 | O20 | P17 | 38.4° | 40.0° |
| O22 | P21 | O23 | H11 | 0.0° | 180.0° |
| O23 | P21 | O20 | P17 | 156.4° | 80.0° |
| P21 | O20 | P17 | O19 | 0.9° | 45.0° |
| P21 | O20 | P17 | O16 | 122.5° | 165.0° |
| P21 | O20 | P17 | O18 | 118.3° | 75.0° |
| O20 | P21 | O23 | H11 | 118.5° | 60.0° |
| O19 | P17 | O16 | O20 | 121.4° | 120.0° |
| O19 | P17 | O16 | O18 | 120.4° | 120.0° |
| O19 | P17 | O20 | O18 | 119.3° | 120.0° |
| O19 | P17 | O18 | H10 | 0.0° | 180.0° |
| O16 | P17 | O20 | O18 | 119.2° | 120.0° |
| P17 | O16 | C15 | H8 | 39.4° | 60.0° |
| P17 | O16 | C15 | H9 | 80.3° | 60.0° |
| O16 | P17 | O18 | H10 | 121.3° | 59.9° |
| O20 | P17 | O18 | H10 | 120.1° | 60.1° |
| N10 | C03 | N02 | C04 | 179.2° | 180.0° |
| N10 | C03 | N02 | C01 | 179.7° | 180.0° |
| C03 | N10 | C09 | N08 | 0.1° | 0.0° |
| N10 | C03 | C04 | N08 | 0.2° | 0.0° |
| N10 | C03 | C04 | C05 | 179.6° | 180.0° |
| C03 | N10 | C09 | H4 | 179.8° | 180.0° |
| C03 | N10 | C11 | H5 | 7.4° | 44.7° |
| C09 | N10 | C03 | N02 | 179.5° | 180.0° |
| C09 | N10 | C03 | C04 | 0.2° | 0.0° |
| N10 | C09 | N08 | H4 | 180.0° | 180.0° |
| N10 | C09 | N08 | C04 | 0.0° | 0.0° |
| C09 | N10 | C11 | H5 | 173.1° | 135.3° |
| C03 | N02 | C01 | N06 | 0.5° | 0.1° |
| N02 | C03 | C04 | N08 | 179.6° | 180.0° |
| N02 | C03 | C04 | C05 | 0.2° | 0.0° |
| C03 | N02 | C01 | H1 | 179.5° | 179.7° |
| C01 | N02 | C03 | C04 | 0.5° | 0.1° |
| N02 | C01 | N06 | H1 | 180.0° | 179.8° |
| N02 | C01 | N06 | C05 | 0.1° | 0.1° |
| C03 | C04 | N08 | C09 | 0.1° | 0.0° |
| C03 | C04 | N08 | C05 | 179.7° | 179.9° |
| C03 | C04 | C05 | N06 | 0.2° | 0.0° |
| C03 | C04 | C05 | N07 | 179.7° | 180.0° |
| C09 | N08 | C04 | C05 | 179.6° | 180.0° |
| C01 | N06 | C05 | C04 | 0.2° | 0.0° |
| C01 | N06 | C05 | N07 | 179.7° | 180.0° |
| N08 | C04 | C05 | N06 | 179.9° | 180.0° |
| N08 | C04 | C05 | N07 | 0.6° | 0.1° |
| C04 | N08 | C09 | H4 | 180.0° | 179.9° |
| C04 | C05 | N06 | N07 | 179.5° | 180.0° |
| C04 | C05 | N07 | H2 | 179.5° | 0.0° |
| C04 | C05 | N07 | H3 | 59.5° | 179.9° |
| C05 | N06 | C01 | H1 | 179.9° | 179.7° |
| N06 | C05 | N07 | H2 | 0.0° | 180.0° |
| N06 | C05 | N07 | H3 | 120.0° | 0.1° |
| C05 | N07 | H2 | H3 | 120.0° | 179.9° |
| H5 | C11 | C12 | H6 | 138.0° | 154.1° |
| H6 | C12 | C13 | H7 | 138.7° | 154.1° |
| H6 | C12 | C29 | H14 | 60.4° | 163.2° |
| H6 | C12 | C29 | H15 | 59.2° | 76.8° |
| H7 | C13 | C15 | H8 | 52.0° | 72.5° |
| H7 | C13 | C15 | H9 | 67.7° | 167.5° |
| H14 | C29 | O30 | H16 | 59.8° | 60.0° |
| H15 | C29 | O30 | H16 | 59.7° | 60.0° |
