JSJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | doub | 1.32Å | 1.33Å | Aromatic |
| N1 | C6 | sing | 1.33Å | 1.34Å | Aromatic |
| N6 | C6 | sing | 1.38Å | 1.35Å | |
| C2 | N3 | sing | 1.32Å | 1.33Å | Aromatic |
| C6 | C5 | doub | 1.41Å | 1.48Å | Aromatic |
| N3 | C4 | doub | 1.33Å | 1.34Å | Aromatic |
| C5 | C4 | sing | 1.41Å | 1.46Å | Aromatic |
| C5 | N7 | sing | 1.35Å | 1.35Å | Aromatic |
| C4 | N9 | sing | 1.37Å | 1.32Å | Aromatic |
| N7 | C8 | doub | 1.30Å | 1.35Å | Aromatic |
| N9 | C8 | sing | 1.36Å | 1.33Å | Aromatic |
| N9 | C1' | sing | 1.46Å | 1.46Å | |
| C1' | O4' | sing | 1.44Å | 1.42Å | |
| C1' | C2' | sing | 1.54Å | 1.51Å | |
| O2' | C2' | sing | 1.43Å | 1.43Å | |
| O4' | C4' | sing | 1.44Å | 1.42Å | |
| C2' | C3' | sing | 1.55Å | 1.50Å | |
| O3' | C3' | sing | 1.43Å | 1.43Å | |
| C4' | C3' | sing | 1.54Å | 1.52Å | |
| C4' | C5' | sing | 1.53Å | 1.53Å | |
| C5' | O5' | sing | 1.43Å | 1.43Å | |
| O5' | PA | sing | 1.61Å | 1.61Å | |
| O1A | PA | doub | 1.48Å | 1.50Å | |
| PA | O2A | sing | 1.61Å | 1.50Å | |
| PA | O3A | sing | 1.61Å | 1.60Å | |
| O3A | PB | sing | 1.61Å | 1.60Å | |
| O2B | PB | doub | 1.48Å | 1.50Å | |
| C18 | C10 | sing | 1.53Å | 1.52Å | |
| O1B | PB | sing | 1.61Å | 1.51Å | |
| PB | S1 | sing | 2.12Å | 1.88Å | |
| C10 | C17 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.51Å | 1.51Å | |
| C10 | N10 | sing | 1.48Å | 1.48Å | |
| S1 | S2 | sing | 2.05Å | 2.06Å | |
| C11 | C12 | doub | 1.31Å | 1.34Å | |
| S2 | C13 | sing | 1.81Å | 1.71Å | |
| N10 | O6 | sing | 1.46Å | 1.47Å | |
| N10 | C14 | sing | 1.48Å | 1.48Å | |
| C12 | C13 | sing | 1.51Å | 1.18Å | |
| C12 | C14 | sing | 1.51Å | 1.52Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | C16 | sing | 1.53Å | 1.53Å | |
| C1' | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.08Å | 1.08Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C2 | H17 | sing | 1.08Å | 1.08Å | |
| C2' | H18 | sing | 1.09Å | 1.10Å | |
| C3' | H19 | sing | 1.09Å | 1.10Å | |
| C4' | H20 | sing | 1.09Å | 1.10Å | |
| C5' | H21 | sing | 1.09Å | 1.10Å | |
| C5' | H22 | sing | 1.09Å | 1.10Å | |
| C8 | H23 | sing | 1.08Å | 1.08Å | |
| N6 | H24 | sing | 0.97Å | 1.00Å | |
| N6 | H25 | sing | 0.97Å | 1.00Å | |
| O1B | H26 | sing | 0.97Å | 0.95Å | |
| O2' | H27 | sing | 0.97Å | 0.95Å | |
| O2A | H28 | sing | 0.97Å | 0.95Å | |
| O3' | H29 | sing | 0.97Å | 0.95Å | |
| O6 | H30 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C6 | 121.6° | 121.1° |
| N1 | C2 | N3 | 123.3° | 122.5° |
| N1 | C2 | H17 | 118.4° | 118.7° |
| N1 | C6 | N6 | 119.1° | 120.7° |
| N1 | C6 | C5 | 118.4° | 118.5° |
| N6 | C6 | C5 | 122.4° | 120.8° |
| C6 | N6 | H24 | 109.5° | 119.9° |
| C6 | N6 | H25 | 109.5° | 120.0° |
| C2 | N3 | C4 | 121.5° | 120.7° |
| N3 | C2 | H17 | 118.3° | 118.8° |
| C6 | C5 | C4 | 116.2° | 118.1° |
| C6 | C5 | N7 | 137.7° | 134.7° |
| N3 | C4 | C5 | 119.0° | 119.1° |
| N3 | C4 | N9 | 134.8° | 135.0° |
| C4 | C5 | N7 | 106.1° | 107.2° |
| C5 | C4 | N9 | 106.2° | 105.9° |
| C5 | N7 | C8 | 108.1° | 109.4° |
| C4 | N9 | C8 | 109.8° | 107.4° |
| C4 | N9 | C1' | 124.5° | 126.2° |
| N7 | C8 | N9 | 109.9° | 110.0° |
| N7 | C8 | H23 | 125.1° | 125.0° |
| C8 | N9 | C1' | 125.7° | 126.3° |
| N9 | C8 | H23 | 125.1° | 125.0° |
| N9 | C1' | O4' | 108.1° | 110.3° |
| N9 | C1' | C2' | 104.6° | 110.4° |
| N9 | C1' | H1 | 111.9° | 110.4° |
| O4' | C1' | C2' | 108.1° | 104.8° |
| C1' | O4' | C4' | 110.9° | 105.3° |
| O4' | C1' | H1 | 112.6° | 110.3° |
| C1' | C2' | O2' | 109.4° | 110.5° |
| C1' | C2' | C3' | 104.1° | 104.0° |
| C2' | C1' | H1 | 111.2° | 110.4° |
| C1' | C2' | H18 | 110.5° | 110.5° |
| O2' | C2' | C3' | 110.1° | 110.5° |
| O2' | C2' | H18 | 111.7° | 110.6° |
| C2' | O2' | H27 | 109.5° | 114.0° |
| O4' | C4' | C3' | 106.3° | 104.8° |
| O4' | C4' | C5' | 108.5° | 110.4° |
| O4' | C4' | H20 | 110.6° | 110.5° |
| C2' | C3' | O3' | 106.7° | 110.5° |
| C2' | C3' | C4' | 105.2° | 104.0° |
| C3' | C2' | H18 | 110.7° | 110.6° |
| C2' | C3' | H19 | 111.1° | 110.4° |
| O3' | C3' | C4' | 110.6° | 110.7° |
| O3' | C3' | H19 | 112.2° | 110.5° |
| C3' | O3' | H29 | 109.5° | 114.1° |
| C3' | C4' | C5' | 113.1° | 110.3° |
| C4' | C3' | H19 | 110.8° | 110.6° |
| C3' | C4' | H20 | 109.2° | 110.4° |
| C4' | C5' | O5' | 110.3° | 109.5° |
| C5' | C4' | H20 | 109.1° | 110.3° |
| C4' | C5' | H21 | 109.3° | 109.5° |
| C4' | C5' | H22 | 109.3° | 109.4° |
| C5' | O5' | PA | 123.4° | 123.0° |
| O5' | C5' | H21 | 109.2° | 109.5° |
| O5' | C5' | H22 | 109.3° | 109.5° |
| O5' | PA | O1A | 108.1° | 109.5° |
| O5' | PA | O2A | 110.0° | 109.4° |
| O5' | PA | O3A | 104.1° | 109.5° |
| O1A | PA | O2A | 120.2° | 109.4° |
| O1A | PA | O3A | 105.0° | 109.5° |
| O2A | PA | O3A | 108.2° | 109.5° |
| PA | O2A | H28 | 109.5° | 114.0° |
| PA | O3A | PB | 117.3° | 134.0° |
| O3A | PB | O2B | 101.9° | 109.5° |
| O3A | PB | O1B | 100.9° | 109.5° |
| O3A | PB | S1 | 106.2° | 109.5° |
| O2B | PB | O1B | 114.0° | 109.5° |
| O2B | PB | S1 | 114.0° | 109.5° |
| C18 | C10 | C17 | 111.5° | 110.3° |
| C18 | C10 | C11 | 110.3° | 110.3° |
| C18 | C10 | N10 | 110.1° | 110.3° |
| C10 | C18 | H14 | 109.5° | 109.4° |
| C10 | C18 | H15 | 109.5° | 109.5° |
| C10 | C18 | H16 | 109.5° | 109.5° |
| O1B | PB | S1 | 117.3° | 109.5° |
| PB | O1B | H26 | 109.5° | 114.0° |
| PB | S1 | S2 | 105.4° | 103.0° |
| C17 | C10 | C11 | 109.8° | 110.3° |
| C17 | C10 | N10 | 112.0° | 110.2° |
| C10 | C17 | H11 | 109.5° | 109.4° |
| C10 | C17 | H12 | 109.5° | 109.5° |
| C10 | C17 | H13 | 109.5° | 109.5° |
| C11 | C10 | N10 | 102.8° | 105.4° |
| C10 | C11 | C12 | 111.2° | 109.4° |
| C10 | C11 | H2 | 124.4° | 125.3° |
| C10 | N10 | O6 | 123.8° | 111.0° |
| C10 | N10 | C14 | 111.9° | 102.8° |
| S1 | S2 | C13 | 129.6° | 103.0° |
| C11 | C12 | C13 | 110.9° | 125.3° |
| C11 | C12 | C14 | 111.8° | 109.4° |
| C12 | C11 | H2 | 124.4° | 125.3° |
| S2 | C13 | C12 | 119.0° | 109.5° |
| S2 | C13 | H3 | 107.0° | 109.5° |
| S2 | C13 | H4 | 107.0° | 109.5° |
| O6 | N10 | C14 | 124.3° | 111.0° |
| N10 | O6 | H30 | 109.5° | 114.0° |
| N10 | C14 | C12 | 102.3° | 105.4° |
| N10 | C14 | C15 | 109.8° | 110.3° |
| N10 | C14 | C16 | 110.5° | 110.4° |
| C13 | C12 | C14 | 136.8° | 125.3° |
| C12 | C13 | H3 | 107.0° | 109.5° |
| C12 | C13 | H4 | 107.0° | 109.4° |
| C12 | C14 | C15 | 112.1° | 110.2° |
| C12 | C14 | C16 | 110.5° | 110.2° |
| C15 | C14 | C16 | 111.3° | 110.2° |
| C14 | C15 | H5 | 109.5° | 109.5° |
| C14 | C15 | H6 | 109.5° | 109.5° |
| C14 | C15 | H7 | 109.5° | 109.5° |
| C14 | C16 | H8 | 109.5° | 109.5° |
| C14 | C16 | H9 | 109.5° | 109.4° |
| C14 | C16 | H10 | 109.5° | 109.5° |
| H3 | C13 | H4 | 109.5° | 109.5° |
| H5 | C15 | H6 | 109.4° | 109.5° |
| H5 | C15 | H7 | 109.5° | 109.5° |
| H6 | C15 | H7 | 109.5° | 109.4° |
| H8 | C16 | H9 | 109.5° | 109.4° |
| H8 | C16 | H10 | 109.5° | 109.5° |
| H9 | C16 | H10 | 109.5° | 109.5° |
| H11 | C17 | H12 | 109.5° | 109.4° |
| H11 | C17 | H13 | 109.4° | 109.4° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H14 | C18 | H15 | 109.4° | 109.5° |
| H14 | C18 | H16 | 109.5° | 109.5° |
| H15 | C18 | H16 | 109.5° | 109.4° |
| H21 | C5' | H22 | 109.5° | 109.5° |
| H24 | N6 | H25 | 109.5° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | C6 | N6 | 179.8° | 179.7° |
| N1 | C2 | N3 | H17 | 180.0° | 179.7° |
| C2 | N1 | C6 | C5 | 0.3° | 0.5° |
| N1 | C2 | N3 | C4 | 0.3° | 0.3° |
| N1 | C6 | N6 | C5 | 179.9° | 179.2° |
| C6 | N1 | C2 | N3 | 0.2° | 0.0° |
| N1 | C6 | C5 | C4 | 0.4° | 0.8° |
| N1 | C6 | C5 | N7 | 179.7° | 179.9° |
| C6 | N1 | C2 | H17 | 179.8° | 179.7° |
| N1 | C6 | N6 | H24 | 0.0° | 179.2° |
| N1 | C6 | N6 | H25 | 120.0° | 0.9° |
| N6 | C6 | C5 | C4 | 179.7° | 180.0° |
| N6 | C6 | C5 | N7 | 0.2° | 0.7° |
| C6 | N6 | H24 | H25 | 120.0° | 179.9° |
| C2 | N3 | C4 | C5 | 0.4° | 0.0° |
| C2 | N3 | C4 | N9 | 179.1° | 180.0° |
| C6 | C5 | C4 | N3 | 0.5° | 0.5° |
| C6 | C5 | C4 | N7 | 180.0° | 179.5° |
| C6 | C5 | C4 | N9 | 179.5° | 179.5° |
| C6 | C5 | N7 | C8 | 179.9° | 179.3° |
| C5 | C6 | N6 | H24 | 179.9° | 0.1° |
| C5 | C6 | N6 | H25 | 59.9° | 180.0° |
| N3 | C4 | C5 | N9 | 179.1° | 180.0° |
| N3 | C4 | C5 | N7 | 179.6° | 180.0° |
| N3 | C4 | N9 | C8 | 179.7° | 180.0° |
| N3 | C4 | N9 | C1' | 2.0° | 0.0° |
| C4 | N3 | C2 | H17 | 179.7° | 180.0° |
| C4 | C5 | N7 | C8 | 0.0° | 0.0° |
| C5 | C4 | N9 | C8 | 0.9° | 0.0° |
| C5 | C4 | N9 | C1' | 179.2° | 180.0° |
| N7 | C5 | C4 | N9 | 0.5° | 0.0° |
| C5 | N7 | C8 | N9 | 0.6° | 0.0° |
| C5 | N7 | C8 | H23 | 179.4° | 180.0° |
| C4 | N9 | C8 | N7 | 0.9° | 0.0° |
| C4 | N9 | C8 | C1' | 178.3° | 180.0° |
| C4 | N9 | C1' | O4' | 170.4° | 156.5° |
| C4 | N9 | C1' | C2' | 55.4° | 88.1° |
| C4 | N9 | C1' | H1 | 65.1° | 34.2° |
| C4 | N9 | C8 | H23 | 179.1° | 180.0° |
| N7 | C8 | N9 | H23 | 180.0° | 180.0° |
| N7 | C8 | N9 | C1' | 179.2° | 180.0° |
| C8 | N9 | C1' | O4' | 7.6° | 23.5° |
| C8 | N9 | C1' | C2' | 122.6° | 91.9° |
| C8 | N9 | C1' | H1 | 116.9° | 145.8° |
| N9 | C1' | O4' | C2' | 112.7° | 118.9° |
| N9 | C1' | O4' | H1 | 124.1° | 122.3° |
| N9 | C1' | C2' | H1 | 120.9° | 122.4° |
| N9 | C1' | C2' | O2' | 111.5° | 98.6° |
| N9 | C1' | O4' | C4' | 114.8° | 159.4° |
| N9 | C1' | C2' | C3' | 130.9° | 142.8° |
| N9 | C1' | C2' | H18 | 12.0° | 24.1° |
| C1' | N9 | C8 | H23 | 0.8° | 0.0° |
| O4' | C1' | C2' | H1 | 124.1° | 118.8° |
| O4' | C1' | C2' | O2' | 133.6° | 142.6° |
| O4' | C1' | C2' | C3' | 15.9° | 24.0° |
| C1' | O4' | C4' | C3' | 12.4° | 40.5° |
| C1' | O4' | C4' | C5' | 109.5° | 159.3° |
| O4' | C1' | C2' | H18 | 103.0° | 94.7° |
| C1' | O4' | C4' | H20 | 130.8° | 78.4° |
| C1' | C2' | O2' | C3' | 113.8° | 114.6° |
| C1' | C2' | O2' | H18 | 122.8° | 122.6° |
| C2' | C1' | O4' | C4' | 2.2° | 40.5° |
| C1' | C2' | C3' | H18 | 118.8° | 118.6° |
| C1' | C2' | C3' | O3' | 94.8° | 118.8° |
| C1' | C2' | C3' | C4' | 22.7° | 0.0° |
| C1' | C2' | C3' | H19 | 142.6° | 118.7° |
| C1' | C2' | O2' | H27 | 180.0° | 180.0° |
| O2' | C2' | C3' | H18 | 124.0° | 122.7° |
| O2' | C2' | C3' | O3' | 22.4° | 0.2° |
| O2' | C2' | C3' | C4' | 139.9° | 118.6° |
| O2' | C2' | C1' | H1 | 9.5° | 23.8° |
| O2' | C2' | C3' | H19 | 100.2° | 122.7° |
| O4' | C4' | C3' | C2' | 22.0° | 24.0° |
| O4' | C4' | C3' | O3' | 92.9° | 142.7° |
| O4' | C4' | C3' | C5' | 118.9° | 118.8° |
| O4' | C4' | C3' | H20 | 119.4° | 119.0° |
| O4' | C4' | C5' | H20 | 120.6° | 122.4° |
| O4' | C4' | C5' | O5' | 82.3° | 69.6° |
| C4' | O4' | C1' | H1 | 121.0° | 78.3° |
| O4' | C4' | C3' | H19 | 142.2° | 94.6° |
| O4' | C4' | C5' | H21 | 157.6° | 170.4° |
| O4' | C4' | C5' | H22 | 37.8° | 50.3° |
| C2' | C3' | O3' | C4' | 113.9° | 114.7° |
| C2' | C3' | O3' | H19 | 121.9° | 122.5° |
| C2' | C3' | C4' | H19 | 120.1° | 118.6° |
| C2' | C3' | C4' | C5' | 96.9° | 142.8° |
| C3' | C2' | C1' | H1 | 108.2° | 94.8° |
| C2' | C3' | C4' | H20 | 141.4° | 95.0° |
| C3' | C2' | O2' | H27 | 66.2° | 65.3° |
| C2' | C3' | O3' | H29 | 180.0° | 61.4° |
| O3' | C3' | C4' | H19 | 125.0° | 122.7° |
| O3' | C3' | C4' | C5' | 148.2° | 98.5° |
| O3' | C3' | C2' | H18 | 146.4° | 122.6° |
| O3' | C3' | C4' | H20 | 26.5° | 23.6° |
| C3' | C4' | C5' | H20 | 121.8° | 122.2° |
| C3' | C4' | C5' | O5' | 160.1° | 175.0° |
| C4' | C3' | C2' | H18 | 96.1° | 118.6° |
| C3' | C4' | C5' | H21 | 39.9° | 55.0° |
| C3' | C4' | C5' | H22 | 79.8° | 65.0° |
| C4' | C3' | O3' | H29 | 66.1° | 176.1° |
| C4' | C5' | O5' | H21 | 120.1° | 120.0° |
| C4' | C5' | O5' | H22 | 120.1° | 119.9° |
| C4' | C5' | O5' | PA | 170.4° | 180.0° |
| C5' | C4' | C3' | H19 | 23.2° | 24.2° |
| C4' | C5' | H21 | H22 | 119.6° | 120.0° |
| C5' | O5' | PA | O1A | 169.3° | 55.0° |
| C5' | O5' | PA | O2A | 36.3° | 65.0° |
| C5' | O5' | PA | O3A | 79.4° | 175.0° |
| O5' | C5' | C4' | H20 | 38.3° | 52.8° |
| O5' | C5' | H21 | H22 | 119.6° | 120.0° |
| O5' | PA | O1A | O2A | 127.3° | 119.9° |
| O5' | PA | O1A | O3A | 110.7° | 120.0° |
| O5' | PA | O2A | O3A | 113.1° | 120.0° |
| O5' | PA | O3A | PB | 144.1° | 160.0° |
| PA | O5' | C5' | H21 | 50.3° | 60.0° |
| PA | O5' | C5' | H22 | 69.4° | 60.0° |
| O5' | PA | O2A | H28 | 126.5° | 60.0° |
| O1A | PA | O2A | O3A | 120.4° | 120.1° |
| O1A | PA | O3A | PB | 102.3° | 40.0° |
| O1A | PA | O2A | H28 | 0.0° | 180.0° |
| O2A | PA | O3A | PB | 27.2° | 80.0° |
| PA | O3A | PB | O2B | 42.8° | 60.0° |
| PA | O3A | PB | O1B | 74.9° | 60.0° |
| PA | O3A | PB | S1 | 162.3° | 180.0° |
| O3A | PA | O2A | H28 | 120.4° | 60.0° |
| O3A | PB | O2B | O1B | 107.8° | 120.0° |
| O3A | PB | O2B | S1 | 113.9° | 120.0° |
| O3A | PB | O1B | S1 | 114.7° | 120.0° |
| O3A | PB | S1 | S2 | 69.5° | 180.0° |
| O3A | PB | O1B | H26 | 108.4° | 60.0° |
| O2B | PB | O1B | S1 | 136.9° | 120.0° |
| O2B | PB | S1 | S2 | 179.1° | 60.0° |
| O2B | PB | O1B | H26 | 0.0° | 180.0° |
| C18 | C10 | C17 | C11 | 122.5° | 122.0° |
| C18 | C10 | C17 | N10 | 123.9° | 122.1° |
| C18 | C10 | C11 | N10 | 117.4° | 119.1° |
| C18 | C10 | C11 | C12 | 117.5° | 136.0° |
| C18 | C10 | N10 | O6 | 62.9° | 96.1° |
| C18 | C10 | N10 | C14 | 118.5° | 145.2° |
| C18 | C10 | C11 | H2 | 62.5° | 43.9° |
| C18 | C10 | C17 | H11 | 180.0° | 63.0° |
| C18 | C10 | C17 | H12 | 60.0° | 57.0° |
| C18 | C10 | C17 | H13 | 60.0° | 177.1° |
| C10 | C18 | H14 | H15 | 120.0° | 120.0° |
| C10 | C18 | H14 | H16 | 120.0° | 120.0° |
| C10 | C18 | H15 | H16 | 120.0° | 120.0° |
| O1B | PB | S1 | S2 | 42.3° | 60.0° |
| PB | S1 | S2 | C13 | 119.9° | 85.0° |
| S1 | PB | O1B | H26 | 136.9° | 60.0° |
| C17 | C10 | C11 | N10 | 119.4° | 118.9° |
| C17 | C10 | C11 | C12 | 119.2° | 102.0° |
| C17 | C10 | N10 | O6 | 61.7° | 25.9° |
| C17 | C10 | N10 | C14 | 116.8° | 92.8° |
| C17 | C10 | C11 | H2 | 60.8° | 78.1° |
| C10 | C17 | H11 | H12 | 120.0° | 120.0° |
| C10 | C17 | H11 | H13 | 120.0° | 120.0° |
| C10 | C17 | H12 | H13 | 120.0° | 120.1° |
| C17 | C10 | C18 | H14 | 180.0° | 59.3° |
| C17 | C10 | C18 | H15 | 60.0° | 179.3° |
| C17 | C10 | C18 | H16 | 60.0° | 60.7° |
| C10 | C11 | C12 | H2 | 180.0° | 180.0° |
| C11 | C10 | N10 | O6 | 179.5° | 144.9° |
| C11 | C10 | N10 | C14 | 1.0° | 26.2° |
| C10 | C11 | C12 | C13 | 174.0° | 180.0° |
| C10 | C11 | C12 | C14 | 0.7° | 0.0° |
| C11 | C10 | C17 | H11 | 57.5° | 59.0° |
| C11 | C10 | C17 | H12 | 62.6° | 179.0° |
| C11 | C10 | C17 | H13 | 177.5° | 60.9° |
| C11 | C10 | C18 | H14 | 57.8° | 62.7° |
| C11 | C10 | C18 | H15 | 177.7° | 57.3° |
| C11 | C10 | C18 | H16 | 62.2° | 177.3° |
| N10 | C10 | C11 | C12 | 0.2° | 17.0° |
| C10 | N10 | O6 | C14 | 178.4° | 113.6° |
| C10 | N10 | C14 | C12 | 1.3° | 26.2° |
| C10 | N10 | C14 | C15 | 120.6° | 145.1° |
| C10 | N10 | C14 | C16 | 116.4° | 92.8° |
| N10 | C10 | C11 | H2 | 179.9° | 163.0° |
| N10 | C10 | C17 | H11 | 56.1° | 175.0° |
| N10 | C10 | C17 | H12 | 176.1° | 65.0° |
| N10 | C10 | C17 | H13 | 63.9° | 55.0° |
| N10 | C10 | C18 | H14 | 55.0° | 178.7° |
| N10 | C10 | C18 | H15 | 64.9° | 58.7° |
| N10 | C10 | C18 | H16 | 175.0° | 61.3° |
| C10 | N10 | O6 | H30 | 180.0° | 59.9° |
| S1 | S2 | C13 | C12 | 131.8° | 75.8° |
| S1 | S2 | C13 | H3 | 10.5° | 44.2° |
| S1 | S2 | C13 | H4 | 106.9° | 164.2° |
| C11 | C12 | C13 | S2 | 49.1° | 102.5° |
| C11 | C12 | C14 | N10 | 1.2° | 17.0° |
| C11 | C12 | C13 | C14 | 170.9° | 180.0° |
| C11 | C12 | C14 | C15 | 118.8° | 136.0° |
| C11 | C12 | C14 | C16 | 116.5° | 102.1° |
| C11 | C12 | C13 | H3 | 170.4° | 17.5° |
| C11 | C12 | C13 | H4 | 72.3° | 137.5° |
| S2 | C13 | C12 | H3 | 121.3° | 120.0° |
| S2 | C13 | C12 | H4 | 121.3° | 120.0° |
| S2 | C13 | C12 | C14 | 140.0° | 77.4° |
| S2 | C13 | H3 | H4 | 115.7° | 120.0° |
| O6 | N10 | C14 | C12 | 179.9° | 144.9° |
| O6 | N10 | C14 | C15 | 60.9° | 96.1° |
| O6 | N10 | C14 | C16 | 62.2° | 25.9° |
| N10 | C14 | C12 | C13 | 172.1° | 163.0° |
| N10 | C14 | C12 | C15 | 117.6° | 119.0° |
| N10 | C14 | C12 | C16 | 117.7° | 119.1° |
| N10 | C14 | C15 | C16 | 122.6° | 122.1° |
| N10 | C14 | C15 | H5 | 180.0° | 175.9° |
| N10 | C14 | C15 | H6 | 60.0° | 64.0° |
| N10 | C14 | C15 | H7 | 60.0° | 55.9° |
| N10 | C14 | C16 | H8 | 180.0° | 63.3° |
| N10 | C14 | C16 | H9 | 60.0° | 56.6° |
| N10 | C14 | C16 | H10 | 60.0° | 176.6° |
| C14 | N10 | O6 | H30 | 1.6° | 173.6° |
| C13 | C12 | C14 | C15 | 70.4° | 44.0° |
| C13 | C12 | C14 | C16 | 54.4° | 77.9° |
| C13 | C12 | C11 | H2 | 6.0° | 0.0° |
| C12 | C13 | H3 | H4 | 115.7° | 119.9° |
| C12 | C14 | C15 | C16 | 124.3° | 121.9° |
| C14 | C12 | C11 | H2 | 179.3° | 180.0° |
| C14 | C12 | C13 | H3 | 18.7° | 162.5° |
| C14 | C12 | C13 | H4 | 98.6° | 42.6° |
| C12 | C14 | C15 | H5 | 67.0° | 60.0° |
| C12 | C14 | C15 | H6 | 173.0° | 180.0° |
| C12 | C14 | C15 | H7 | 53.0° | 60.1° |
| C12 | C14 | C16 | H8 | 67.5° | 52.7° |
| C12 | C14 | C16 | H9 | 52.5° | 172.6° |
| C12 | C14 | C16 | H10 | 172.5° | 67.4° |
| C14 | C15 | H5 | H6 | 120.0° | 120.0° |
| C14 | C15 | H5 | H7 | 120.0° | 120.0° |
| C14 | C15 | H6 | H7 | 120.0° | 120.0° |
| C15 | C14 | C16 | H8 | 57.8° | 174.6° |
| C15 | C14 | C16 | H9 | 177.8° | 65.5° |
| C15 | C14 | C16 | H10 | 62.2° | 54.5° |
| C16 | C14 | C15 | H5 | 57.4° | 62.0° |
| C16 | C14 | C15 | H6 | 62.6° | 58.1° |
| C16 | C14 | C15 | H7 | 177.4° | 178.0° |
| C14 | C16 | H8 | H9 | 120.0° | 119.9° |
| C14 | C16 | H8 | H10 | 120.0° | 120.1° |
| C14 | C16 | H9 | H10 | 120.0° | 120.0° |
| H1 | C1' | C2' | H18 | 133.0° | 146.5° |
| H5 | C15 | H6 | H7 | 120.0° | 120.0° |
| H8 | C16 | H9 | H10 | 120.0° | 120.0° |
| H11 | C17 | H12 | H13 | 119.9° | 119.9° |
| H14 | C18 | H15 | H16 | 120.0° | 120.0° |
| H18 | C2' | C3' | H19 | 23.8° | 0.0° |
| H18 | C2' | O2' | H27 | 57.3° | 57.4° |
| H19 | C3' | C4' | H20 | 98.5° | 146.4° |
| H19 | C3' | O3' | H29 | 58.1° | 61.1° |
| H20 | C4' | C5' | H21 | 81.8° | 67.2° |
| H20 | C4' | C5' | H22 | 158.4° | 172.7° |
