6G0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | P1 | doub | 1.48Å | 1.61Å | |
| O3 | P1 | sing | 1.61Å | 1.51Å | |
| P1 | O2 | sing | 1.61Å | 1.51Å | |
| P1 | O4 | sing | 1.61Å | 1.62Å | |
| O5 | P2 | doub | 1.48Å | 1.51Å | |
| O4 | P2 | sing | 1.61Å | 1.61Å | |
| O6 | P2 | sing | 1.61Å | 1.52Å | |
| O15 | C8 | sing | 1.43Å | 1.43Å | |
| P2 | O7 | sing | 1.61Å | 1.61Å | |
| C8 | C9 | sing | 1.55Å | 1.50Å | |
| C8 | C7 | sing | 1.54Å | 1.51Å | |
| C9 | O16 | sing | 1.43Å | 1.43Å | |
| C9 | C10 | sing | 1.55Å | 1.52Å | |
| O7 | P3 | sing | 1.61Å | 1.59Å | |
| N2 | C1 | sing | 1.37Å | 1.36Å | |
| N1 | C1 | sing | 1.36Å | 1.36Å | |
| N1 | C5 | sing | 1.35Å | 1.35Å | |
| C1 | N3 | doub | 1.31Å | 1.35Å | |
| O17 | C5 | doub | 1.22Å | 1.33Å | |
| C5 | C4 | sing | 1.41Å | 1.39Å | |
| N3 | C3 | sing | 1.34Å | 1.35Å | |
| O13 | C6 | sing | 1.43Å | 1.42Å | |
| O13 | P4 | sing | 1.61Å | 1.62Å | |
| C4 | C3 | doub | 1.40Å | 1.38Å | Aromatic |
| C4 | N5 | sing | 1.36Å | 1.35Å | Aromatic |
| C3 | N4 | sing | 1.37Å | 1.34Å | Aromatic |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C7 | O14 | sing | 1.44Å | 1.42Å | |
| O11 | P4 | doub | 1.48Å | 1.52Å | |
| O10 | P3 | sing | 1.61Å | 1.60Å | |
| O10 | P4 | sing | 1.61Å | 1.61Å | |
| N5 | C11 | sing | 1.46Å | 1.49Å | |
| N5 | C2 | doub | 1.30Å | 1.36Å | Aromatic |
| N4 | C10 | sing | 1.46Å | 1.49Å | |
| N4 | C2 | sing | 1.36Å | 1.36Å | Aromatic |
| C10 | O14 | sing | 1.44Å | 1.43Å | |
| P3 | O9 | doub | 1.48Å | 1.50Å | |
| P3 | O8 | sing | 1.61Å | 1.51Å | |
| P4 | O12 | sing | 1.61Å | 1.50Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| N2 | H3 | sing | 0.97Å | 1.00Å | |
| N2 | H4 | sing | 0.97Å | 1.00Å | |
| O2 | H5 | sing | 0.97Å | 0.95Å | |
| O3 | H6 | sing | 0.97Å | 0.95Å | |
| O6 | H7 | sing | 0.97Å | 0.95Å | |
| O8 | H8 | sing | 0.97Å | 0.95Å | |
| O12 | H9 | sing | 0.97Å | 0.95Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| O15 | H14 | sing | 0.97Å | 0.95Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| O16 | H16 | sing | 0.97Å | 0.95Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | P1 | O3 | 109.2° | 109.5° |
| O1 | P1 | O2 | 109.7° | 109.5° |
| O1 | P1 | O4 | 110.1° | 109.5° |
| O3 | P1 | O2 | 109.9° | 109.5° |
| O3 | P1 | O4 | 107.3° | 109.4° |
| P1 | O3 | H6 | 109.5° | 114.0° |
| O2 | P1 | O4 | 110.7° | 109.4° |
| P1 | O2 | H5 | 109.5° | 114.0° |
| P1 | O4 | P2 | 122.4° | 134.0° |
| O5 | P2 | O4 | 109.7° | 109.5° |
| O5 | P2 | O6 | 110.5° | 109.5° |
| O5 | P2 | O7 | 107.5° | 109.5° |
| O4 | P2 | O6 | 109.8° | 109.5° |
| O4 | P2 | O7 | 105.6° | 109.5° |
| O6 | P2 | O7 | 113.7° | 109.5° |
| P2 | O6 | H7 | 109.5° | 114.0° |
| O15 | C8 | C9 | 110.1° | 110.5° |
| O15 | C8 | C7 | 111.0° | 110.5° |
| O15 | C8 | H13 | 111.8° | 110.6° |
| C8 | O15 | H14 | 109.5° | 114.0° |
| P2 | O7 | P3 | 124.8° | 134.0° |
| C9 | C8 | C7 | 102.5° | 104.2° |
| C8 | C9 | O16 | 108.1° | 110.9° |
| C8 | C9 | C10 | 101.0° | 102.1° |
| C9 | C8 | H13 | 110.7° | 110.5° |
| C8 | C9 | H15 | 112.4° | 110.9° |
| C8 | C7 | C6 | 113.6° | 109.9° |
| C8 | C7 | O14 | 103.6° | 107.3° |
| C8 | C7 | H12 | 109.4° | 110.0° |
| C7 | C8 | H13 | 110.5° | 110.5° |
| O16 | C9 | C10 | 108.9° | 110.9° |
| O16 | C9 | H15 | 113.5° | 110.8° |
| C9 | O16 | H16 | 109.5° | 114.0° |
| C9 | C10 | N4 | 109.2° | 110.6° |
| C9 | C10 | O14 | 107.1° | 103.5° |
| C10 | C9 | H15 | 112.2° | 110.9° |
| C9 | C10 | H17 | 110.4° | 110.6° |
| O7 | P3 | O10 | 107.7° | 109.5° |
| O7 | P3 | O9 | 112.7° | 109.5° |
| O7 | P3 | O8 | 107.3° | 109.5° |
| N2 | C1 | N1 | 120.4° | 119.1° |
| N2 | C1 | N3 | 118.5° | 119.0° |
| C1 | N2 | H3 | 120.0° | 120.0° |
| C1 | N2 | H4 | 120.0° | 119.9° |
| C1 | N1 | C5 | 121.4° | 120.3° |
| N1 | C1 | N3 | 121.1° | 121.9° |
| C1 | N1 | H2 | 119.3° | 119.9° |
| N1 | C5 | O17 | 119.2° | 120.8° |
| N1 | C5 | C4 | 117.6° | 118.4° |
| C5 | N1 | H2 | 119.3° | 119.8° |
| C1 | N3 | C3 | 119.1° | 121.1° |
| O17 | C5 | C4 | 123.3° | 120.8° |
| C5 | C4 | C3 | 120.4° | 118.6° |
| C5 | C4 | N5 | 130.7° | 134.2° |
| N3 | C3 | C4 | 120.4° | 119.7° |
| N3 | C3 | N4 | 132.5° | 134.2° |
| C6 | O13 | P4 | 122.5° | 123.0° |
| O13 | C6 | C7 | 109.9° | 109.5° |
| O13 | C6 | H10 | 109.4° | 109.5° |
| O13 | C6 | H11 | 109.4° | 109.5° |
| O13 | P4 | O11 | 108.0° | 109.5° |
| O13 | P4 | O10 | 112.2° | 109.5° |
| O13 | P4 | O12 | 107.8° | 109.5° |
| C3 | C4 | N5 | 108.9° | 107.2° |
| C4 | C3 | N4 | 107.1° | 106.1° |
| C4 | N5 | C11 | 127.7° | 125.3° |
| C4 | N5 | C2 | 106.9° | 109.3° |
| C3 | N4 | C10 | 123.1° | 126.3° |
| C3 | N4 | C2 | 108.5° | 107.5° |
| C6 | C7 | O14 | 110.1° | 109.9° |
| C7 | C6 | H10 | 109.4° | 109.4° |
| C7 | C6 | H11 | 109.3° | 109.5° |
| C6 | C7 | H12 | 109.2° | 109.8° |
| C7 | O14 | C10 | 109.4° | 107.0° |
| O14 | C7 | H12 | 110.7° | 109.9° |
| O11 | P4 | O10 | 104.5° | 109.4° |
| O11 | P4 | O12 | 113.7° | 109.5° |
| P3 | O10 | P4 | 124.1° | 134.0° |
| O10 | P3 | O9 | 108.6° | 109.5° |
| O10 | P3 | O8 | 112.5° | 109.5° |
| O10 | P4 | O12 | 110.6° | 109.5° |
| C11 | N5 | C2 | 125.4° | 125.4° |
| N5 | C11 | H18 | 109.5° | 109.5° |
| N5 | C11 | H19 | 109.5° | 109.5° |
| N5 | C11 | H20 | 109.5° | 109.5° |
| N5 | C2 | N4 | 108.5° | 109.8° |
| N5 | C2 | H1 | 125.7° | 125.1° |
| C10 | N4 | C2 | 128.3° | 126.2° |
| N4 | C10 | O14 | 107.4° | 110.6° |
| N4 | C10 | H17 | 110.8° | 110.7° |
| N4 | C2 | H1 | 125.7° | 125.1° |
| O14 | C10 | H17 | 111.7° | 110.7° |
| O9 | P3 | O8 | 108.1° | 109.5° |
| P3 | O8 | H8 | 109.5° | 114.0° |
| P4 | O12 | H9 | 109.5° | 114.0° |
| H3 | N2 | H4 | 120.0° | 120.1° |
| H10 | C6 | H11 | 109.5° | 109.5° |
| H18 | C11 | H19 | 109.4° | 109.4° |
| H18 | C11 | H20 | 109.5° | 109.5° |
| H19 | C11 | H20 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | P1 | O3 | O2 | 120.3° | 120.0° |
| O1 | P1 | O3 | O4 | 119.4° | 120.0° |
| O1 | P1 | O2 | O4 | 121.7° | 120.0° |
| O1 | P1 | O4 | P2 | 59.0° | 44.9° |
| O1 | P1 | O2 | H5 | 0.0° | 180.0° |
| O1 | P1 | O3 | H6 | 0.0° | 60.0° |
| O3 | P1 | O2 | O4 | 118.3° | 119.9° |
| O3 | P1 | O4 | P2 | 177.7° | 165.0° |
| O3 | P1 | O2 | H5 | 120.0° | 60.0° |
| O2 | P1 | O4 | P2 | 62.4° | 75.0° |
| O2 | P1 | O3 | H6 | 120.3° | 60.0° |
| P1 | O4 | P2 | O5 | 113.1° | 45.0° |
| P1 | O4 | P2 | O6 | 8.4° | 74.9° |
| P1 | O4 | P2 | O7 | 131.3° | 165.0° |
| O4 | P1 | O2 | H5 | 121.7° | 60.0° |
| O4 | P1 | O3 | H6 | 119.4° | 179.9° |
| O5 | P2 | O4 | O6 | 121.6° | 120.0° |
| O5 | P2 | O4 | O7 | 115.6° | 120.0° |
| O5 | P2 | O6 | O7 | 120.9° | 120.0° |
| O5 | P2 | O7 | P3 | 120.4° | 40.0° |
| O5 | P2 | O6 | H7 | 0.0° | 180.0° |
| O4 | P2 | O6 | O7 | 118.0° | 120.0° |
| O4 | P2 | O7 | P3 | 122.5° | 160.0° |
| O4 | P2 | O6 | H7 | 121.1° | 60.0° |
| O6 | P2 | O7 | P3 | 2.2° | 80.0° |
| O15 | C8 | C9 | C7 | 118.2° | 118.7° |
| O15 | C8 | C9 | H13 | 124.0° | 122.7° |
| O15 | C8 | C7 | H13 | 124.5° | 122.6° |
| O15 | C8 | C9 | O16 | 41.8° | 20.4° |
| O15 | C8 | C9 | C10 | 156.0° | 97.8° |
| O15 | C8 | C7 | C6 | 84.2° | 119.8° |
| O15 | C8 | C7 | O14 | 156.2° | 120.8° |
| O15 | C8 | C7 | H12 | 38.1° | 1.2° |
| O15 | C8 | C9 | H15 | 84.3° | 144.0° |
| P2 | O7 | P3 | O10 | 60.0° | 165.0° |
| P2 | O7 | P3 | O9 | 59.7° | 45.0° |
| P2 | O7 | P3 | O8 | 178.6° | 75.0° |
| O7 | P2 | O6 | H7 | 120.9° | 60.0° |
| C9 | C8 | C7 | H13 | 117.9° | 118.7° |
| C8 | C9 | O16 | C10 | 108.9° | 112.7° |
| C8 | C9 | O16 | H15 | 125.4° | 123.6° |
| C8 | C9 | C10 | H15 | 119.9° | 118.2° |
| C9 | C8 | C7 | C6 | 158.2° | 121.5° |
| C9 | C8 | C7 | O14 | 38.7° | 2.1° |
| C8 | C9 | C10 | N4 | 91.5° | 155.5° |
| C8 | C9 | C10 | O14 | 24.6° | 37.1° |
| C9 | C8 | C7 | H12 | 79.5° | 117.5° |
| C9 | C8 | O15 | H14 | 180.0° | 61.4° |
| C8 | C9 | O16 | H16 | 180.0° | 61.5° |
| C8 | C9 | C10 | H17 | 146.4° | 81.5° |
| C7 | C8 | C9 | O16 | 76.4° | 139.1° |
| C7 | C8 | C9 | C10 | 37.8° | 20.9° |
| C8 | C7 | C6 | O13 | 45.8° | 175.7° |
| C8 | C7 | C6 | O14 | 115.7° | 117.8° |
| C8 | C7 | C6 | H12 | 122.4° | 121.1° |
| C8 | C7 | O14 | H12 | 117.3° | 119.6° |
| C8 | C7 | O14 | C10 | 23.6° | 26.6° |
| C8 | C7 | C6 | H10 | 74.3° | 64.3° |
| C8 | C7 | C6 | H11 | 165.9° | 55.7° |
| C7 | C8 | O15 | H14 | 67.2° | 176.2° |
| C7 | C8 | C9 | H15 | 157.5° | 97.4° |
| O16 | C9 | C10 | H15 | 126.4° | 123.6° |
| O16 | C9 | C10 | N4 | 154.8° | 86.3° |
| O16 | C9 | C10 | O14 | 89.1° | 155.3° |
| O16 | C9 | C8 | H13 | 165.8° | 102.3° |
| O16 | C9 | C10 | H17 | 32.7° | 36.7° |
| C9 | C10 | N4 | C3 | 83.5° | 85.1° |
| C9 | C10 | O14 | C7 | 0.6° | 40.1° |
| C9 | C10 | N4 | O14 | 115.9° | 114.0° |
| C9 | C10 | N4 | H17 | 121.8° | 123.0° |
| C9 | C10 | N4 | C2 | 97.1° | 95.0° |
| C9 | C10 | O14 | H17 | 121.0° | 118.5° |
| C10 | C9 | C8 | H13 | 80.0° | 139.5° |
| C10 | C9 | O16 | H16 | 71.1° | 174.2° |
| O7 | P3 | O10 | O9 | 122.3° | 120.0° |
| O7 | P3 | O10 | O8 | 118.1° | 120.0° |
| O7 | P3 | O10 | P4 | 89.6° | 160.0° |
| O7 | P3 | O9 | O8 | 118.5° | 120.0° |
| O7 | P3 | O8 | H8 | 121.8° | 60.0° |
| N2 | C1 | N1 | N3 | 179.5° | 179.7° |
| N2 | C1 | N1 | C5 | 179.8° | 179.7° |
| N2 | C1 | N3 | C3 | 179.7° | 179.8° |
| N2 | C1 | N1 | H2 | 0.2° | 0.3° |
| C1 | N2 | H3 | H4 | 180.0° | 180.0° |
| C1 | N1 | C5 | H2 | 180.0° | 180.0° |
| C1 | N1 | C5 | O17 | 179.9° | 179.9° |
| C1 | N1 | C5 | C4 | 0.5° | 0.0° |
| N1 | C1 | N3 | C3 | 0.2° | 0.0° |
| N1 | C1 | N2 | H3 | 179.5° | 179.7° |
| N1 | C1 | N2 | H4 | 0.5° | 0.2° |
| C5 | N1 | C1 | N3 | 0.7° | 0.0° |
| N1 | C5 | O17 | C4 | 179.6° | 179.9° |
| N1 | C5 | C4 | C3 | 0.3° | 0.0° |
| N1 | C5 | C4 | N5 | 179.9° | 180.0° |
| C1 | N3 | C3 | C4 | 0.6° | 0.1° |
| C1 | N3 | C3 | N4 | 179.2° | 179.9° |
| N3 | C1 | N1 | H2 | 179.3° | 180.0° |
| N3 | C1 | N2 | H3 | 0.0° | 0.0° |
| N3 | C1 | N2 | H4 | 180.0° | 180.0° |
| O17 | C5 | C4 | C3 | 179.3° | 180.0° |
| O17 | C5 | C4 | N5 | 0.5° | 0.1° |
| O17 | C5 | N1 | H2 | 0.1° | 0.1° |
| C5 | C4 | C3 | N3 | 0.8° | 0.1° |
| C5 | C4 | C3 | N5 | 179.9° | 179.9° |
| C5 | C4 | C3 | N4 | 179.8° | 180.0° |
| C5 | C4 | N5 | C11 | 0.9° | 0.0° |
| C5 | C4 | N5 | C2 | 179.9° | 180.0° |
| C4 | C5 | N1 | H2 | 179.5° | 180.0° |
| N3 | C3 | C4 | N4 | 178.9° | 179.9° |
| N3 | C3 | C4 | N5 | 179.3° | 180.0° |
| N3 | C3 | N4 | C10 | 0.4° | 0.1° |
| N3 | C3 | N4 | C2 | 179.1° | 179.9° |
| O13 | C6 | C7 | H10 | 120.1° | 120.0° |
| O13 | C6 | C7 | H11 | 120.1° | 120.0° |
| O13 | C6 | C7 | O14 | 69.9° | 66.4° |
| C6 | O13 | P4 | O11 | 166.2° | 55.0° |
| C6 | O13 | P4 | O10 | 79.1° | 175.0° |
| C6 | O13 | P4 | O12 | 43.0° | 65.0° |
| O13 | C6 | H10 | H11 | 119.8° | 120.1° |
| O13 | C6 | C7 | H12 | 168.3° | 54.6° |
| P4 | O13 | C6 | C7 | 147.8° | 180.0° |
| O13 | P4 | O11 | O10 | 119.7° | 120.0° |
| O13 | P4 | O11 | O12 | 119.6° | 120.0° |
| O13 | P4 | O10 | P3 | 69.3° | 165.0° |
| O13 | P4 | O10 | O12 | 120.5° | 120.0° |
| O13 | P4 | O12 | H9 | 119.7° | 60.0° |
| P4 | O13 | C6 | H10 | 92.1° | 60.0° |
| P4 | O13 | C6 | H11 | 27.8° | 60.0° |
| C3 | C4 | N5 | C11 | 178.9° | 180.0° |
| C3 | C4 | N5 | C2 | 0.2° | 0.1° |
| C4 | C3 | N4 | C10 | 179.2° | 180.0° |
| C4 | C3 | N4 | C2 | 0.3° | 0.1° |
| N5 | C4 | C3 | N4 | 0.4° | 0.1° |
| C4 | N5 | C11 | C2 | 179.0° | 180.0° |
| C4 | N5 | C2 | N4 | 0.0° | 0.0° |
| C4 | N5 | C2 | H1 | 180.0° | 180.0° |
| C4 | N5 | C11 | H18 | 180.0° | 90.0° |
| C4 | N5 | C11 | H19 | 60.0° | 150.0° |
| C4 | N5 | C11 | H20 | 60.0° | 30.0° |
| C3 | N4 | C2 | N5 | 0.2° | 0.0° |
| C3 | N4 | C10 | C2 | 179.4° | 180.0° |
| C3 | N4 | C10 | O14 | 160.7° | 160.9° |
| C3 | N4 | C2 | H1 | 179.8° | 179.9° |
| C3 | N4 | C10 | H17 | 38.4° | 37.9° |
| C6 | C7 | O14 | H12 | 120.9° | 121.0° |
| C6 | C7 | O14 | C10 | 145.5° | 146.0° |
| C7 | C6 | H10 | H11 | 119.8° | 120.0° |
| C6 | C7 | C8 | H13 | 40.3° | 2.8° |
| C7 | O14 | C10 | N4 | 116.6° | 158.6° |
| O14 | C7 | C6 | H10 | 170.0° | 53.5° |
| O14 | C7 | C6 | H11 | 50.1° | 173.5° |
| O14 | C7 | C8 | H13 | 79.2° | 116.6° |
| C7 | O14 | C10 | H17 | 121.6° | 78.4° |
| O11 | P4 | O10 | P3 | 173.9° | 45.0° |
| O11 | P4 | O10 | O12 | 122.7° | 120.0° |
| O11 | P4 | O12 | H9 | 0.0° | 179.9° |
| O10 | P3 | O9 | O8 | 122.3° | 120.0° |
| P3 | O10 | P4 | O12 | 51.1° | 75.0° |
| O10 | P3 | O8 | H8 | 119.9° | 60.0° |
| P4 | O10 | P3 | O9 | 148.1° | 40.0° |
| P4 | O10 | P3 | O8 | 28.5° | 80.0° |
| O10 | P4 | O12 | H9 | 117.2° | 60.0° |
| C11 | N5 | C2 | N4 | 179.1° | 180.0° |
| C11 | N5 | C2 | H1 | 0.8° | 0.1° |
| N5 | C11 | H18 | H19 | 120.0° | 120.0° |
| N5 | C11 | H18 | H20 | 120.0° | 120.0° |
| N5 | C11 | H19 | H20 | 120.0° | 120.0° |
| N5 | C2 | N4 | C10 | 179.3° | 180.0° |
| N5 | C2 | N4 | H1 | 180.0° | 179.9° |
| C2 | N5 | C11 | H18 | 1.0° | 90.0° |
| C2 | N5 | C11 | H19 | 119.0° | 30.0° |
| C2 | N5 | C11 | H20 | 121.0° | 150.0° |
| N4 | C10 | O14 | H17 | 121.7° | 123.0° |
| C10 | N4 | C2 | H1 | 0.7° | 0.1° |
| N4 | C10 | C9 | H15 | 28.4° | 37.3° |
| C2 | N4 | C10 | O14 | 18.8° | 19.0° |
| C2 | N4 | C10 | H17 | 141.0° | 142.1° |
| C10 | O14 | C7 | H12 | 93.6° | 93.0° |
| O14 | C10 | C9 | H15 | 144.5° | 81.2° |
| O9 | P3 | O8 | H8 | 0.0° | 180.0° |
| H10 | C6 | C7 | H12 | 48.2° | 174.5° |
| H11 | C6 | C7 | H12 | 71.7° | 65.5° |
| H12 | C7 | C8 | H13 | 162.6° | 123.9° |
| H13 | C8 | O15 | H14 | 56.6° | 61.2° |
| H13 | C8 | C9 | H15 | 39.8° | 21.3° |
| H15 | C9 | O16 | H16 | 54.6° | 62.1° |
| H15 | C9 | C10 | H17 | 93.7° | 160.3° |
| H18 | C11 | H19 | H20 | 120.0° | 120.0° |
