KT2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | P1 | sing | 1.61Å | 1.57Å | |
| O11 | P1 | doub | 1.48Å | 1.44Å | |
| P1 | O8 | sing | 1.61Å | 1.60Å | |
| P1 | O9 | sing | 1.61Å | 1.56Å | |
| O8 | C19 | sing | 1.43Å | 1.43Å | |
| O5 | C17 | sing | 1.43Å | 1.41Å | |
| O5 | C18 | sing | 1.43Å | 1.41Å | |
| C14 | C21 | doub | 1.34Å | 1.36Å | Aromatic |
| C14 | N6 | sing | 1.37Å | 1.34Å | Aromatic |
| C21 | C12 | sing | 1.46Å | 1.40Å | Aromatic |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| N6 | C17 | sing | 1.46Å | 1.46Å | |
| N6 | C11 | sing | 1.37Å | 1.32Å | Aromatic |
| C12 | C11 | doub | 1.41Å | 1.44Å | Aromatic |
| C12 | C13 | sing | 1.40Å | 1.37Å | Aromatic |
| C17 | C16 | sing | 1.54Å | 1.48Å | |
| N9 | C13 | sing | 1.38Å | 1.33Å | |
| C18 | C15 | sing | 1.54Å | 1.52Å | |
| C11 | N5 | sing | 1.33Å | 1.34Å | Aromatic |
| C13 | N4 | doub | 1.33Å | 1.32Å | Aromatic |
| O9 | C6 | sing | 1.43Å | 1.40Å | |
| N5 | C10 | doub | 1.32Å | 1.32Å | Aromatic |
| N4 | C10 | sing | 1.32Å | 1.32Å | Aromatic |
| N8 | C | sing | 1.37Å | 1.34Å | |
| C16 | C15 | sing | 1.54Å | 1.51Å | |
| C16 | O6 | sing | 1.43Å | 1.44Å | |
| C15 | O7 | sing | 1.43Å | 1.39Å | |
| C | N | sing | 1.36Å | 1.32Å | |
| C | N1 | doub | 1.31Å | 1.32Å | |
| C6 | C5 | sing | 1.55Å | 1.51Å | |
| C6 | C7 | sing | 1.54Å | 1.53Å | |
| N | C3 | sing | 1.35Å | 1.32Å | |
| N1 | C1 | sing | 1.34Å | 1.33Å | |
| O10 | C5 | sing | 1.42Å | 1.44Å | |
| C3 | O | doub | 1.22Å | 1.23Å | |
| C3 | C2 | sing | 1.41Å | 1.38Å | |
| C1 | C2 | doub | 1.40Å | 1.36Å | Aromatic |
| C1 | N2 | sing | 1.37Å | 1.31Å | Aromatic |
| C5 | C8 | sing | 1.55Å | 1.49Å | |
| O7 | P | sing | 1.61Å | 1.57Å | |
| C2 | N3 | sing | 1.36Å | 1.33Å | Aromatic |
| C7 | N2 | sing | 1.46Å | 1.49Å | |
| C7 | O1 | sing | 1.43Å | 1.40Å | |
| N2 | C4 | sing | 1.36Å | 1.33Å | Aromatic |
| N3 | C4 | doub | 1.30Å | 1.34Å | Aromatic |
| O2 | P | sing | 1.61Å | 1.57Å | |
| O2 | C9 | sing | 1.43Å | 1.41Å | |
| O12 | P | doub | 1.48Å | 1.43Å | |
| C8 | O1 | sing | 1.43Å | 1.42Å | |
| C8 | C9 | sing | 1.52Å | 1.50Å | |
| P | O3 | sing | 1.61Å | 1.56Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| N8 | HN81 | sing | 0.97Å | 1.00Å | |
| N8 | HN82 | sing | 0.97Å | 1.00Å | |
| C9 | H92 | sing | 1.09Å | 1.10Å | |
| C9 | H93 | sing | 1.09Å | 1.10Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| N9 | HN92 | sing | 0.97Å | 1.00Å | |
| N9 | HN91 | sing | 0.97Å | 1.00Å | |
| O10 | HO1 | sing | 0.97Å | 0.95Å | |
| O3 | H3 | sing | 0.97Å | 0.95Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | P1 | O11 | 111.3° | 109.2° |
| O4 | P1 | O8 | 111.2° | 109.2° |
| O4 | P1 | O9 | 106.4° | 109.2° |
| P1 | O4 | HO4 | 109.5° | 114.0° |
| O11 | P1 | O8 | 107.5° | 109.7° |
| O11 | P1 | O9 | 105.6° | 109.8° |
| O8 | P1 | O9 | 114.7° | 109.6° |
| P1 | O8 | C19 | 125.3° | 123.9° |
| P1 | O9 | C6 | 124.2° | 124.7° |
| O8 | C19 | C18 | 112.7° | 109.5° |
| O8 | C19 | H192 | 108.7° | 110.2° |
| O8 | C19 | H193 | 108.6° | 109.1° |
| C17 | O5 | C18 | 112.2° | 110.4° |
| O5 | C17 | N6 | 114.7° | 109.8° |
| O5 | C17 | C16 | 107.6° | 108.7° |
| O5 | C17 | H17 | 110.5° | 109.7° |
| O5 | C18 | C19 | 109.8° | 109.5° |
| O5 | C18 | C15 | 101.6° | 108.0° |
| O5 | C18 | H18 | 110.3° | 109.5° |
| C21 | C14 | N6 | 108.9° | 109.8° |
| C14 | C21 | C12 | 106.8° | 106.8° |
| C21 | C14 | H14 | 125.6° | 125.1° |
| C14 | C21 | H21 | 126.6° | 126.5° |
| C14 | N6 | C17 | 127.3° | 125.0° |
| C14 | N6 | C11 | 112.2° | 110.0° |
| N6 | C14 | H14 | 125.6° | 125.0° |
| C21 | C12 | C11 | 106.6° | 106.2° |
| C21 | C12 | C13 | 136.2° | 135.1° |
| C12 | C21 | H21 | 126.6° | 126.6° |
| C19 | C18 | C15 | 117.4° | 110.4° |
| C19 | C18 | H18 | 108.6° | 109.7° |
| C18 | C19 | H192 | 108.6° | 109.9° |
| C18 | C19 | H193 | 108.7° | 109.0° |
| C17 | N6 | C11 | 120.5° | 125.0° |
| N6 | C17 | C16 | 104.7° | 109.6° |
| N6 | C17 | H17 | 109.7° | 109.5° |
| N6 | C11 | C12 | 105.5° | 107.1° |
| N6 | C11 | N5 | 134.6° | 134.3° |
| C11 | C12 | C13 | 117.2° | 118.7° |
| C12 | C11 | N5 | 119.9° | 118.6° |
| C12 | C13 | N9 | 121.6° | 120.9° |
| C12 | C13 | N4 | 119.2° | 118.3° |
| C17 | C16 | C15 | 100.2° | 105.0° |
| C17 | C16 | O6 | 109.1° | 110.2° |
| C17 | C16 | H16 | 110.1° | 110.3° |
| C16 | C17 | H17 | 109.5° | 109.5° |
| N9 | C13 | N4 | 119.3° | 120.8° |
| C13 | N9 | HN92 | 109.5° | 120.0° |
| C13 | N9 | HN91 | 109.5° | 120.0° |
| C18 | C15 | C16 | 104.8° | 105.1° |
| C18 | C15 | O7 | 118.1° | 110.6° |
| C18 | C15 | H15 | 108.5° | 110.3° |
| C15 | C18 | H18 | 108.9° | 109.7° |
| C11 | N5 | C10 | 119.1° | 120.7° |
| C13 | N4 | C10 | 122.4° | 121.0° |
| O9 | C6 | C5 | 106.4° | 110.0° |
| O9 | C6 | C7 | 116.9° | 109.7° |
| O9 | C6 | H6 | 110.2° | 112.2° |
| N5 | C10 | N4 | 122.2° | 122.7° |
| N5 | C10 | H10 | 118.9° | 118.6° |
| N4 | C10 | H10 | 118.9° | 118.6° |
| N8 | C | N | 122.9° | 119.1° |
| N8 | C | N1 | 115.7° | 119.0° |
| C | N8 | HN81 | 120.0° | 119.9° |
| C | N8 | HN82 | 120.0° | 120.0° |
| C15 | C16 | O6 | 116.3° | 110.5° |
| C16 | C15 | O7 | 106.0° | 110.5° |
| C16 | C15 | H15 | 108.7° | 110.0° |
| C15 | C16 | H16 | 109.8° | 110.4° |
| O6 | C16 | H16 | 110.8° | 110.3° |
| C16 | O6 | HO6 | 109.5° | 114.0° |
| C15 | O7 | P | 115.8° | 123.6° |
| O7 | C15 | H15 | 110.3° | 110.2° |
| N | C | N1 | 121.4° | 121.9° |
| C | N | C3 | 120.2° | 120.3° |
| C | N | H | 119.9° | 119.8° |
| C | N1 | C1 | 120.8° | 121.1° |
| C5 | C6 | C7 | 105.8° | 102.3° |
| C6 | C5 | O10 | 116.0° | 111.3° |
| C6 | C5 | C8 | 103.6° | 101.7° |
| C6 | C5 | H5 | 109.2° | 110.4° |
| C5 | C6 | H6 | 108.8° | 111.1° |
| C6 | C7 | N2 | 113.8° | 109.5° |
| C6 | C7 | O1 | 105.2° | 108.1° |
| C7 | C6 | H6 | 108.5° | 111.1° |
| C6 | C7 | H7 | 108.9° | 109.6° |
| N | C3 | O | 119.6° | 120.8° |
| N | C3 | C2 | 119.5° | 118.4° |
| C3 | N | H | 119.9° | 119.9° |
| N1 | C1 | C2 | 119.1° | 119.7° |
| N1 | C1 | N2 | 130.9° | 134.2° |
| O10 | C5 | C8 | 107.8° | 110.9° |
| O10 | C5 | H5 | 110.3° | 111.4° |
| C5 | O10 | HO1 | 109.5° | 114.0° |
| O | C3 | C2 | 120.9° | 120.8° |
| C3 | C2 | C1 | 119.0° | 118.6° |
| C3 | C2 | N3 | 134.8° | 134.2° |
| C2 | C1 | N2 | 110.0° | 106.1° |
| C1 | C2 | N3 | 106.2° | 107.2° |
| C1 | N2 | C7 | 125.2° | 126.3° |
| C1 | N2 | C4 | 106.5° | 107.5° |
| C5 | C8 | O1 | 108.3° | 105.7° |
| C5 | C8 | C9 | 106.5° | 110.2° |
| C8 | C5 | H5 | 109.5° | 110.6° |
| C5 | C8 | H8 | 109.9° | 109.4° |
| O7 | P | O2 | 105.3° | 109.7° |
| O7 | P | O12 | 112.9° | 109.6° |
| O7 | P | O3 | 108.8° | 109.6° |
| C2 | N3 | C4 | 107.9° | 109.3° |
| N2 | C7 | O1 | 108.7° | 109.6° |
| C7 | N2 | C4 | 128.3° | 126.3° |
| N2 | C7 | H7 | 109.5° | 110.2° |
| C7 | O1 | C8 | 112.1° | 109.7° |
| O1 | C7 | H7 | 110.7° | 109.8° |
| N2 | C4 | N3 | 109.4° | 109.8° |
| N2 | C4 | H4 | 125.3° | 125.1° |
| N3 | C4 | H4 | 125.3° | 125.1° |
| P | O2 | C9 | 117.5° | 123.5° |
| O2 | P | O12 | 109.5° | 109.5° |
| O2 | P | O3 | 109.1° | 109.3° |
| O2 | C9 | C8 | 107.6° | 109.4° |
| O2 | C9 | H92 | 109.9° | 109.4° |
| O2 | C9 | H93 | 109.9° | 109.3° |
| O12 | P | O3 | 111.0° | 109.2° |
| O1 | C8 | C9 | 111.4° | 111.2° |
| O1 | C8 | H8 | 110.9° | 109.8° |
| C8 | C9 | H92 | 109.9° | 109.8° |
| C8 | C9 | H93 | 109.9° | 109.6° |
| C9 | C8 | H8 | 109.8° | 110.5° |
| P | O3 | H3 | 109.5° | 114.0° |
| HN81 | N8 | HN82 | 120.0° | 120.1° |
| H92 | C9 | H93 | 109.5° | 109.3° |
| H192 | C19 | H193 | 109.4° | 109.1° |
| HN92 | N9 | HN91 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | P1 | O11 | O8 | 122.0° | 119.7° |
| O4 | P1 | O11 | O9 | 115.1° | 119.8° |
| O4 | P1 | O8 | O9 | 120.9° | 119.7° |
| O4 | P1 | O8 | C19 | 57.5° | 134.2° |
| O4 | P1 | O9 | C6 | 157.5° | 116.3° |
| O11 | P1 | O8 | O9 | 117.1° | 120.6° |
| O11 | P1 | O8 | C19 | 179.5° | 14.5° |
| O11 | P1 | O9 | C6 | 84.1° | 3.5° |
| O11 | P1 | O4 | HO4 | 0.0° | 60.0° |
| P1 | O8 | C19 | C18 | 155.8° | 135.5° |
| O8 | P1 | O9 | C6 | 34.0° | 124.0° |
| P1 | O8 | C19 | H192 | 35.3° | 14.5° |
| P1 | O8 | C19 | H193 | 83.7° | 105.3° |
| O8 | P1 | O4 | HO4 | 119.8° | 60.0° |
| O9 | P1 | O8 | C19 | 63.4° | 106.1° |
| P1 | O9 | C6 | C5 | 114.5° | 76.8° |
| P1 | O9 | C6 | C7 | 127.6° | 171.4° |
| P1 | O9 | C6 | H6 | 3.2° | 47.4° |
| O9 | P1 | O4 | HO4 | 114.6° | 179.9° |
| O8 | C19 | C18 | O5 | 56.8° | 113.2° |
| O8 | C19 | C18 | H192 | 120.5° | 121.2° |
| O8 | C19 | C18 | H193 | 120.5° | 119.3° |
| O8 | C19 | C18 | C15 | 58.5° | 128.1° |
| O8 | C19 | C18 | H18 | 177.5° | 7.1° |
| O8 | C19 | H192 | H193 | 118.5° | 119.8° |
| O5 | C17 | N6 | C14 | 9.7° | 24.3° |
| C17 | O5 | C18 | C19 | 141.8° | 138.1° |
| O5 | C17 | N6 | C16 | 117.6° | 119.3° |
| O5 | C17 | N6 | H17 | 125.0° | 120.4° |
| O5 | C17 | N6 | C11 | 170.6° | 156.1° |
| O5 | C17 | C16 | H17 | 120.0° | 119.8° |
| C17 | O5 | C18 | C15 | 16.8° | 17.8° |
| O5 | C17 | C16 | C15 | 26.3° | 4.5° |
| O5 | C17 | C16 | O6 | 96.3° | 123.6° |
| O5 | C17 | C16 | H16 | 141.9° | 114.4° |
| C17 | O5 | C18 | H18 | 98.5° | 101.6° |
| O5 | C18 | C19 | C15 | 115.3° | 118.8° |
| O5 | C18 | C19 | H18 | 120.7° | 120.2° |
| C18 | O5 | C17 | N6 | 109.8° | 134.0° |
| C18 | O5 | C17 | C16 | 6.2° | 14.0° |
| O5 | C18 | C15 | H18 | 116.4° | 119.3° |
| O5 | C18 | C15 | C16 | 33.1° | 14.2° |
| O5 | C18 | C15 | O7 | 150.7° | 133.4° |
| O5 | C18 | C15 | H15 | 82.8° | 104.3° |
| C18 | O5 | C17 | H17 | 125.6° | 105.7° |
| O5 | C18 | C19 | H192 | 177.3° | 125.6° |
| O5 | C18 | C19 | H193 | 63.7° | 6.2° |
| C21 | C14 | N6 | H14 | 180.0° | 179.8° |
| C14 | C21 | C12 | H21 | 180.0° | 179.8° |
| C21 | C14 | N6 | C17 | 179.3° | 180.0° |
| C21 | C14 | N6 | C11 | 0.9° | 0.4° |
| C14 | C21 | C12 | C11 | 0.1° | 0.0° |
| C14 | C21 | C12 | C13 | 179.9° | 179.7° |
| N6 | C14 | C21 | C12 | 0.4° | 0.2° |
| C14 | N6 | C17 | C11 | 179.7° | 179.6° |
| C14 | N6 | C11 | C12 | 1.0° | 0.4° |
| C14 | N6 | C17 | C16 | 107.9° | 95.0° |
| C14 | N6 | C11 | N5 | 180.0° | 179.6° |
| C14 | N6 | C17 | H17 | 134.7° | 144.8° |
| N6 | C14 | C21 | H21 | 179.5° | 180.0° |
| C21 | C12 | C11 | N6 | 0.6° | 0.3° |
| C21 | C12 | C11 | C13 | 179.8° | 179.7° |
| C21 | C12 | C13 | N9 | 0.1° | 0.4° |
| C21 | C12 | C11 | N5 | 179.9° | 179.7° |
| C21 | C12 | C13 | N4 | 179.5° | 179.7° |
| C12 | C21 | C14 | H14 | 179.6° | 180.0° |
| C19 | C18 | C15 | H18 | 123.9° | 121.0° |
| C19 | C18 | C15 | C16 | 152.8° | 133.9° |
| C19 | C18 | C15 | O7 | 89.6° | 106.8° |
| C19 | C18 | C15 | H15 | 36.8° | 15.4° |
| C18 | C19 | H192 | H193 | 118.5° | 119.4° |
| C17 | N6 | C11 | C12 | 179.3° | 180.0° |
| N6 | C17 | C16 | H17 | 117.6° | 120.2° |
| C17 | N6 | C11 | N5 | 0.2° | 0.0° |
| N6 | C17 | C16 | C15 | 96.1° | 124.5° |
| N6 | C17 | C16 | O6 | 141.3° | 116.4° |
| C17 | N6 | C14 | H14 | 0.7° | 0.2° |
| N6 | C17 | C16 | H16 | 19.5° | 5.6° |
| N6 | C11 | C12 | N5 | 179.2° | 180.0° |
| N6 | C11 | C12 | C13 | 179.6° | 180.0° |
| C11 | N6 | C17 | C16 | 71.8° | 84.6° |
| N6 | C11 | N5 | C10 | 179.6° | 179.9° |
| C11 | N6 | C14 | H14 | 179.1° | 179.8° |
| C11 | N6 | C17 | H17 | 45.6° | 35.7° |
| C11 | C12 | C13 | N9 | 179.8° | 179.9° |
| C11 | C12 | C13 | N4 | 0.2° | 0.1° |
| C12 | C11 | N5 | C10 | 0.6° | 0.1° |
| C11 | C12 | C21 | H21 | 179.9° | 179.8° |
| C12 | C13 | N9 | N4 | 179.6° | 179.9° |
| C13 | C12 | C11 | N5 | 0.3° | 0.0° |
| C12 | C13 | N4 | C10 | 0.5° | 0.1° |
| C13 | C12 | C21 | H21 | 0.1° | 0.1° |
| C12 | C13 | N9 | HN92 | 179.6° | 0.1° |
| C12 | C13 | N9 | HN91 | 60.4° | 180.0° |
| C17 | C16 | C15 | C18 | 36.3° | 5.7° |
| C17 | C16 | C15 | O6 | 117.4° | 118.8° |
| C17 | C16 | C15 | H16 | 115.9° | 118.9° |
| C17 | C16 | O6 | H16 | 121.4° | 122.0° |
| C17 | C16 | C15 | O7 | 161.9° | 125.1° |
| C17 | C16 | C15 | H15 | 79.6° | 113.0° |
| C17 | C16 | O6 | HO6 | 180.0° | 64.3° |
| N9 | C13 | N4 | C10 | 179.9° | 179.9° |
| C13 | N9 | HN92 | HN91 | 120.0° | 179.9° |
| C18 | C15 | C16 | O7 | 125.6° | 119.3° |
| C18 | C15 | C16 | H15 | 115.9° | 118.8° |
| C18 | C15 | C16 | O6 | 81.1° | 113.1° |
| C18 | C15 | O7 | H15 | 125.5° | 122.3° |
| C18 | C15 | O7 | P | 161.6° | 155.9° |
| C18 | C15 | C16 | H16 | 152.1° | 124.6° |
| C15 | C18 | C19 | H192 | 62.0° | 6.9° |
| C15 | C18 | C19 | H193 | 179.0° | 112.6° |
| C11 | N5 | C10 | N4 | 0.3° | 0.1° |
| C11 | N5 | C10 | H10 | 179.7° | 180.0° |
| C13 | N4 | C10 | N5 | 0.2° | 0.0° |
| C13 | N4 | C10 | H10 | 179.8° | 179.9° |
| N4 | C13 | N9 | HN92 | 0.0° | 180.0° |
| N4 | C13 | N9 | HN91 | 120.0° | 0.1° |
| O9 | C6 | C5 | C7 | 125.0° | 116.5° |
| O9 | C6 | C5 | H6 | 118.7° | 124.9° |
| O9 | C6 | C7 | H6 | 125.3° | 124.6° |
| O9 | C6 | C5 | O10 | 29.2° | 33.5° |
| O9 | C6 | C5 | C8 | 147.2° | 84.7° |
| O9 | C6 | C7 | N2 | 103.7° | 143.1° |
| O9 | C6 | C7 | O1 | 137.5° | 97.5° |
| O9 | C6 | C5 | H5 | 96.2° | 157.8° |
| O9 | C6 | C7 | H7 | 18.7° | 22.2° |
| N5 | C10 | N4 | H10 | 180.0° | 179.9° |
| N8 | C | N | N1 | 179.2° | 179.7° |
| N8 | C | N | C3 | 179.9° | 180.0° |
| N8 | C | N1 | C1 | 179.8° | 179.7° |
| C | N8 | HN81 | HN82 | 180.0° | 179.9° |
| N8 | C | N | H | 0.1° | 0.0° |
| C15 | C16 | O6 | H16 | 126.2° | 122.3° |
| C16 | C15 | O7 | H15 | 117.4° | 121.7° |
| C16 | C15 | O7 | P | 81.4° | 88.2° |
| C15 | C16 | C17 | H17 | 146.3° | 115.3° |
| C16 | C15 | C18 | H18 | 83.3° | 105.1° |
| C15 | C16 | O6 | HO6 | 67.7° | 180.0° |
| O6 | C16 | C15 | O7 | 44.5° | 6.2° |
| O6 | C16 | C15 | H15 | 163.0° | 128.1° |
| O6 | C16 | C17 | H17 | 23.7° | 3.8° |
| C15 | O7 | P | O2 | 80.4° | 159.4° |
| C15 | O7 | P | O12 | 39.0° | 39.1° |
| C15 | O7 | P | O3 | 162.8° | 80.7° |
| O7 | C15 | C16 | H16 | 82.3° | 116.1° |
| O7 | C15 | C18 | H18 | 34.3° | 14.1° |
| C | N | C3 | H | 180.0° | 180.0° |
| N | C | N1 | C1 | 1.0° | 0.5° |
| C | N | C3 | O | 179.7° | 180.0° |
| C | N | C3 | C2 | 0.1° | 0.0° |
| N | C | N8 | HN81 | 179.3° | 0.0° |
| N | C | N8 | HN82 | 0.7° | 180.0° |
| N1 | C | N | C3 | 0.7° | 0.3° |
| C | N1 | C1 | C2 | 0.7° | 0.5° |
| C | N1 | C1 | N2 | 179.6° | 179.8° |
| N1 | C | N8 | HN81 | 0.0° | 179.7° |
| N1 | C | N8 | HN82 | 180.0° | 0.2° |
| N1 | C | N | H | 179.3° | 179.7° |
| C5 | C6 | C7 | H6 | 116.6° | 118.6° |
| C6 | C5 | O10 | C8 | 115.6° | 112.5° |
| C6 | C5 | O10 | H5 | 124.9° | 123.8° |
| C6 | C5 | C8 | H5 | 116.5° | 117.3° |
| C5 | C6 | C7 | N2 | 138.1° | 100.1° |
| C5 | C6 | C7 | O1 | 19.3° | 19.3° |
| C6 | C5 | C8 | O1 | 17.6° | 34.7° |
| C6 | C5 | C8 | C9 | 102.2° | 155.0° |
| C5 | C6 | C7 | H7 | 99.4° | 138.9° |
| C6 | C5 | C8 | H8 | 138.9° | 83.4° |
| C6 | C5 | O10 | HO1 | 180.0° | 74.9° |
| C7 | C6 | C5 | O10 | 95.7° | 150.0° |
| C6 | C7 | N2 | C1 | 119.1° | 85.0° |
| C7 | C6 | C5 | C8 | 22.2° | 31.8° |
| C6 | C7 | N2 | O1 | 116.8° | 118.5° |
| C6 | C7 | N2 | H7 | 122.1° | 120.6° |
| C6 | C7 | O1 | H7 | 117.5° | 119.5° |
| C6 | C7 | N2 | C4 | 59.2° | 95.0° |
| C6 | C7 | O1 | C8 | 8.5° | 2.6° |
| C7 | C6 | C5 | H5 | 138.9° | 85.6° |
| N | C3 | O | C2 | 179.7° | 180.0° |
| N | C3 | C2 | C1 | 0.2° | 0.0° |
| N | C3 | C2 | N3 | 179.5° | 179.9° |
| N1 | C1 | C2 | C3 | 0.1° | 0.3° |
| N1 | C1 | C2 | N2 | 179.8° | 179.8° |
| N1 | C1 | C2 | N3 | 179.9° | 179.8° |
| N1 | C1 | N2 | C7 | 1.2° | 0.3° |
| N1 | C1 | N2 | C4 | 179.8° | 179.7° |
| O10 | C5 | C8 | H5 | 120.0° | 124.2° |
| O10 | C5 | C8 | O1 | 105.9° | 153.2° |
| O10 | C5 | C8 | C9 | 134.3° | 86.5° |
| O10 | C5 | C6 | H6 | 147.9° | 91.4° |
| O10 | C5 | C8 | H8 | 15.5° | 35.1° |
| O | C3 | C2 | C1 | 179.9° | 180.0° |
| O | C3 | C2 | N3 | 0.2° | 0.1° |
| O | C3 | N | H | 0.3° | 0.0° |
| C3 | C2 | C1 | N3 | 179.8° | 179.9° |
| C3 | C2 | C1 | N2 | 179.9° | 179.9° |
| C3 | C2 | N3 | C4 | 179.8° | 179.9° |
| C2 | C3 | N | H | 179.9° | 180.0° |
| C2 | C1 | N2 | C7 | 178.5° | 180.0° |
| C2 | C1 | N2 | C4 | 0.1° | 0.0° |
| C1 | C2 | N3 | C4 | 0.5° | 0.0° |
| N2 | C1 | C2 | N3 | 0.4° | 0.0° |
| C1 | N2 | C7 | C4 | 178.3° | 180.0° |
| C1 | N2 | C7 | O1 | 124.1° | 156.6° |
| C1 | N2 | C4 | N3 | 0.2° | 0.1° |
| C1 | N2 | C4 | H4 | 179.8° | 179.9° |
| C1 | N2 | C7 | H7 | 3.1° | 35.6° |
| C5 | C8 | O1 | C7 | 5.9° | 23.7° |
| C5 | C8 | C9 | O2 | 52.5° | 108.0° |
| C5 | C8 | O1 | C9 | 116.7° | 119.6° |
| C5 | C8 | O1 | H8 | 120.7° | 117.8° |
| C5 | C8 | C9 | H8 | 118.9° | 121.0° |
| C8 | C5 | C6 | H6 | 94.1° | 150.4° |
| C5 | C8 | C9 | H92 | 67.2° | 12.1° |
| C5 | C8 | C9 | H93 | 172.2° | 132.2° |
| C8 | C5 | O10 | HO1 | 64.4° | 172.6° |
| O7 | P | O2 | O12 | 121.7° | 120.3° |
| O7 | P | O2 | O3 | 116.6° | 120.1° |
| O7 | P | O2 | C9 | 94.5° | 93.0° |
| O7 | P | O12 | O3 | 122.5° | 120.0° |
| P | O7 | C15 | H15 | 36.0° | 33.6° |
| O7 | P | O3 | H3 | 124.8° | 179.9° |
| C2 | N3 | C4 | N2 | 0.4° | 0.1° |
| C2 | N3 | C4 | H4 | 179.6° | 179.9° |
| N2 | C7 | O1 | H7 | 120.3° | 121.2° |
| C7 | N2 | C4 | N3 | 178.7° | 180.0° |
| N2 | C7 | O1 | C8 | 130.6° | 121.9° |
| C7 | N2 | C4 | H4 | 1.3° | 0.1° |
| N2 | C7 | C6 | H6 | 21.5° | 18.5° |
| O1 | C7 | N2 | C4 | 57.6° | 23.5° |
| C7 | O1 | C8 | C9 | 110.8° | 143.3° |
| O1 | C7 | C6 | H6 | 97.3° | 137.9° |
| C7 | O1 | C8 | H8 | 126.5° | 94.1° |
| N2 | C4 | N3 | H4 | 180.0° | 179.9° |
| C4 | N2 | C7 | H7 | 178.6° | 144.4° |
| O2 | P | O12 | O3 | 120.6° | 119.6° |
| P | O2 | C9 | C8 | 152.3° | 73.2° |
| P | O2 | C9 | H92 | 32.6° | 47.1° |
| P | O2 | C9 | H93 | 88.0° | 166.7° |
| O2 | P | O3 | H3 | 120.8° | 59.7° |
| C9 | O2 | P | O12 | 143.8° | 27.3° |
| O2 | C9 | C8 | O1 | 65.3° | 135.2° |
| O2 | C9 | C8 | H92 | 119.7° | 120.1° |
| O2 | C9 | C8 | H93 | 119.7° | 119.8° |
| C9 | O2 | P | O3 | 22.1° | 146.9° |
| O2 | C9 | H92 | H93 | 120.8° | 119.7° |
| O2 | C9 | C8 | H8 | 171.4° | 13.0° |
| O12 | P | O3 | H3 | 0.0° | 60.0° |
| O1 | C8 | C9 | H8 | 123.3° | 122.2° |
| O1 | C8 | C5 | H5 | 134.1° | 82.6° |
| C8 | O1 | C7 | H7 | 109.0° | 117.0° |
| O1 | C8 | C9 | H92 | 175.0° | 104.8° |
| O1 | C8 | C9 | H93 | 54.4° | 15.3° |
| C9 | C8 | C5 | H5 | 14.2° | 37.7° |
| C8 | C9 | H92 | H93 | 120.9° | 120.3° |
| H5 | C5 | C6 | H6 | 22.5° | 32.9° |
| H5 | C5 | C8 | H8 | 104.6° | 159.3° |
| H5 | C5 | O10 | HO1 | 55.1° | 48.8° |
| H6 | C6 | C7 | H7 | 144.0° | 102.5° |
| H92 | C9 | C8 | H8 | 51.7° | 133.1° |
| H93 | C9 | C8 | H8 | 68.9° | 106.9° |
| H14 | C14 | C21 | H21 | 0.5° | 0.2° |
| H15 | C15 | C16 | H16 | 36.2° | 5.8° |
| H15 | C15 | C18 | H18 | 160.7° | 136.3° |
| H16 | C16 | C17 | H17 | 98.1° | 125.8° |
| H16 | C16 | O6 | HO6 | 58.6° | 57.7° |
| H18 | C18 | C19 | H192 | 62.0° | 114.1° |
| H18 | C18 | C19 | H193 | 57.0° | 126.4° |
