YG8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N2 | doub | 1.32Å | 1.33Å | Aromatic |
| N2 | C3 | sing | 1.33Å | 1.35Å | Aromatic |
| C3 | C4 | doub | 1.41Å | 1.41Å | Aromatic |
| C4 | C5 | sing | 1.41Å | 1.39Å | Aromatic |
| C5 | N6 | doub | 1.33Å | 1.33Å | Aromatic |
| C5 | N7 | sing | 1.37Å | 1.37Å | Aromatic |
| N7 | C8 | sing | 1.36Å | 1.37Å | Aromatic |
| C8 | N9 | doub | 1.30Å | 1.31Å | Aromatic |
| N7 | C10 | sing | 1.47Å | 1.45Å | |
| C10 | C11 | sing | 1.55Å | 1.52Å | |
| C11 | C12 | sing | 1.55Å | 1.53Å | |
| C12 | C13 | sing | 1.54Å | 1.54Å | |
| C13 | O14 | sing | 1.44Å | 1.45Å | |
| C13 | C15 | sing | 1.53Å | 1.51Å | |
| C15 | O16 | sing | 1.43Å | 1.45Å | |
| O16 | P17 | sing | 1.61Å | 1.56Å | |
| P17 | O18 | doub | 1.48Å | 1.49Å | |
| P17 | O19 | sing | 1.61Å | 1.48Å | |
| P17 | O20 | sing | 1.61Å | 1.60Å | |
| O20 | P21 | sing | 1.61Å | 1.60Å | |
| P21 | O22 | doub | 1.48Å | 1.48Å | |
| P21 | O23 | sing | 1.61Å | 1.48Å | |
| P21 | O24 | sing | 1.61Å | 1.56Å | |
| O24 | C25 | sing | 1.43Å | 1.43Å | |
| C25 | C26 | sing | 1.53Å | 1.51Å | |
| C26 | C27 | sing | 1.54Å | 1.53Å | |
| C27 | C28 | sing | 1.54Å | 1.53Å | |
| C28 | C29 | sing | 1.54Å | 1.53Å | |
| C29 | O30 | sing | 1.44Å | 1.41Å | |
| C29 | N31 | sing | 1.47Å | 1.45Å | |
| N31 | C32 | sing | 1.35Å | 1.35Å | Aromatic |
| C32 | N33 | doub | 1.30Å | 1.32Å | Aromatic |
| N33 | C34 | sing | 1.34Å | 1.37Å | Aromatic |
| C34 | C35 | doub | 1.35Å | 1.36Å | Aromatic |
| C28 | O36 | sing | 1.43Å | 1.42Å | |
| C27 | O37 | sing | 1.43Å | 1.43Å | |
| C12 | O38 | sing | 1.43Å | 1.43Å | |
| C11 | O39 | sing | 1.43Å | 1.42Å | |
| C3 | N40 | sing | 1.38Å | 1.34Å | |
| N6 | C1 | sing | 1.32Å | 1.33Å | Aromatic |
| N9 | C4 | sing | 1.35Å | 1.38Å | Aromatic |
| O14 | C10 | sing | 1.44Å | 1.41Å | |
| O30 | C26 | sing | 1.44Å | 1.45Å | |
| C35 | N31 | sing | 1.37Å | 1.37Å | Aromatic |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| N40 | H40B | sing | 0.97Å | 1.00Å | |
| N40 | H40A | sing | 0.97Å | 1.00Å | |
| O19 | H2 | sing | 0.97Å | 0.95Å | |
| O23 | H3 | sing | 0.97Å | 0.95Å | |
| O36 | H36 | sing | 0.97Å | 0.95Å | |
| O37 | H37 | sing | 0.97Å | 0.95Å | |
| O38 | H38 | sing | 0.97Å | 0.95Å | |
| O39 | H39 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N2 | C3 | 119.1° | 121.2° |
| N2 | C1 | N6 | 128.7° | 122.5° |
| N2 | C1 | H1 | 115.6° | 118.8° |
| N2 | C3 | C4 | 117.7° | 118.5° |
| N2 | C3 | N40 | 119.0° | 120.8° |
| C3 | C4 | C5 | 116.2° | 118.1° |
| C4 | C3 | N40 | 123.3° | 120.7° |
| C3 | C4 | N9 | 132.8° | 134.7° |
| C4 | C5 | N6 | 127.3° | 119.1° |
| C4 | C5 | N7 | 105.2° | 105.9° |
| C5 | C4 | N9 | 111.0° | 107.1° |
| N6 | C5 | N7 | 127.6° | 135.0° |
| C5 | N6 | C1 | 111.0° | 120.6° |
| C5 | N7 | C8 | 106.4° | 107.5° |
| C5 | N7 | C10 | 124.0° | 126.2° |
| N7 | C8 | N9 | 113.5° | 109.9° |
| C8 | N7 | C10 | 129.6° | 126.3° |
| N7 | C8 | H8 | 123.2° | 125.0° |
| C8 | N9 | C4 | 103.9° | 109.5° |
| N9 | C8 | H8 | 123.3° | 125.1° |
| N7 | C10 | C11 | 116.7° | 110.7° |
| N7 | C10 | O14 | 107.7° | 110.7° |
| N7 | C10 | H10 | 109.0° | 110.5° |
| C10 | C11 | C12 | 99.8° | 102.1° |
| C10 | C11 | O39 | 111.1° | 110.9° |
| C11 | C10 | O14 | 105.6° | 103.5° |
| C10 | C11 | H11 | 110.2° | 110.9° |
| C11 | C10 | H10 | 108.2° | 110.6° |
| C11 | C12 | C13 | 102.4° | 104.2° |
| C11 | C12 | O38 | 112.5° | 110.5° |
| C12 | C11 | O39 | 113.4° | 110.9° |
| C12 | C11 | H11 | 110.1° | 111.0° |
| C11 | C12 | H12 | 110.3° | 110.5° |
| C12 | C13 | O14 | 106.1° | 107.3° |
| C12 | C13 | C15 | 114.0° | 109.9° |
| C13 | C12 | O38 | 109.4° | 110.5° |
| C13 | C12 | H12 | 110.1° | 110.5° |
| C12 | C13 | H13 | 108.1° | 109.9° |
| O14 | C13 | C15 | 110.8° | 109.9° |
| C13 | O14 | C10 | 108.4° | 107.0° |
| O14 | C13 | H13 | 109.2° | 109.9° |
| C13 | C15 | O16 | 111.0° | 109.4° |
| C15 | C13 | H13 | 108.5° | 110.0° |
| C13 | C15 | H15A | 109.1° | 109.5° |
| C13 | C15 | H15B | 109.1° | 109.5° |
| C15 | O16 | P17 | 123.3° | 123.0° |
| O16 | C15 | H15A | 109.1° | 109.4° |
| O16 | C15 | H15B | 109.1° | 109.5° |
| O16 | P17 | O18 | 106.1° | 109.5° |
| O16 | P17 | O19 | 111.5° | 109.5° |
| O16 | P17 | O20 | 101.1° | 109.5° |
| O18 | P17 | O19 | 118.2° | 109.4° |
| O18 | P17 | O20 | 107.0° | 109.5° |
| O19 | P17 | O20 | 111.4° | 109.5° |
| P17 | O19 | H2 | 109.5° | 114.0° |
| P17 | O20 | P21 | 134.0° | 134.0° |
| O20 | P21 | O22 | 102.3° | 109.5° |
| O20 | P21 | O23 | 111.3° | 109.5° |
| O20 | P21 | O24 | 103.1° | 109.5° |
| O22 | P21 | O23 | 119.1° | 109.5° |
| O22 | P21 | O24 | 111.0° | 109.5° |
| O23 | P21 | O24 | 108.8° | 109.5° |
| P21 | O23 | H3 | 109.5° | 114.0° |
| P21 | O24 | C25 | 124.2° | 123.0° |
| O24 | C25 | C26 | 106.9° | 109.5° |
| O24 | C25 | H25B | 110.1° | 109.4° |
| O24 | C25 | H25A | 110.1° | 109.5° |
| C25 | C26 | C27 | 113.8° | 110.4° |
| C25 | C26 | O30 | 109.2° | 110.4° |
| C26 | C25 | H25B | 110.1° | 109.5° |
| C26 | C25 | H25A | 110.1° | 109.5° |
| C25 | C26 | H26 | 108.8° | 110.3° |
| C26 | C27 | C28 | 102.6° | 104.1° |
| C26 | C27 | O37 | 110.0° | 110.5° |
| C27 | C26 | O30 | 106.8° | 104.8° |
| C27 | C26 | H26 | 108.6° | 110.4° |
| C26 | C27 | H27 | 110.5° | 110.5° |
| C27 | C28 | C29 | 100.5° | 104.0° |
| C27 | C28 | O36 | 111.8° | 110.5° |
| C28 | C27 | O37 | 110.9° | 110.5° |
| C28 | C27 | H27 | 110.5° | 110.5° |
| C27 | C28 | H28 | 111.0° | 110.5° |
| C28 | C29 | O30 | 105.7° | 104.8° |
| C28 | C29 | N31 | 115.5° | 110.4° |
| C29 | C28 | O36 | 109.3° | 110.5° |
| C29 | C28 | H28 | 111.0° | 110.5° |
| C28 | C29 | H29 | 108.6° | 110.4° |
| O30 | C29 | N31 | 107.1° | 110.4° |
| C29 | O30 | C26 | 108.7° | 105.2° |
| O30 | C29 | H29 | 110.3° | 110.3° |
| C29 | N31 | C32 | 128.1° | 126.4° |
| C29 | N31 | C35 | 124.9° | 126.4° |
| N31 | C29 | H29 | 109.5° | 110.4° |
| N31 | C32 | N33 | 111.7° | 108.7° |
| C32 | N31 | C35 | 107.0° | 107.2° |
| N31 | C32 | H32 | 124.2° | 125.6° |
| C32 | N33 | C34 | 105.0° | 109.3° |
| N33 | C32 | H32 | 124.2° | 125.7° |
| N33 | C34 | C35 | 110.6° | 108.0° |
| N33 | C34 | H34 | 124.7° | 126.0° |
| C34 | C35 | N31 | 105.8° | 106.8° |
| C35 | C34 | H34 | 124.7° | 126.0° |
| C34 | C35 | H35 | 127.1° | 126.5° |
| O36 | C28 | H28 | 112.7° | 110.6° |
| C28 | O36 | H36 | 109.5° | 113.9° |
| O37 | C27 | H27 | 112.0° | 110.5° |
| C27 | O37 | H37 | 109.5° | 114.0° |
| O38 | C12 | H12 | 111.7° | 110.5° |
| C12 | O38 | H38 | 109.5° | 114.1° |
| O39 | C11 | H11 | 111.6° | 110.8° |
| C11 | O39 | H39 | 109.5° | 113.9° |
| C3 | N40 | H40B | 109.5° | 120.0° |
| C3 | N40 | H40A | 109.5° | 119.9° |
| N6 | C1 | H1 | 115.6° | 118.8° |
| O14 | C10 | H10 | 109.5° | 110.6° |
| O30 | C26 | H26 | 109.6° | 110.5° |
| N31 | C35 | H35 | 127.1° | 126.7° |
| H15A | C15 | H15B | 109.5° | 109.6° |
| H25B | C25 | H25A | 109.5° | 109.4° |
| H40B | N40 | H40A | 109.5° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N2 | C3 | C4 | 0.1° | 0.0° |
| N2 | C1 | N6 | C5 | 0.7° | 0.8° |
| C1 | N2 | C3 | N40 | 178.1° | 179.7° |
| N2 | C1 | N6 | H1 | 180.0° | 179.4° |
| N2 | C3 | C4 | N40 | 178.1° | 179.6° |
| N2 | C3 | C4 | C5 | 0.2° | 0.3° |
| C3 | N2 | C1 | N6 | 0.4° | 0.5° |
| N2 | C3 | C4 | N9 | 179.9° | 179.7° |
| C3 | N2 | C1 | H1 | 179.6° | 180.0° |
| N2 | C3 | N40 | H40B | 0.0° | 179.7° |
| N2 | C3 | N40 | H40A | 120.0° | 0.4° |
| C3 | C4 | C5 | N9 | 179.9° | 180.0° |
| C3 | C4 | C5 | N6 | 0.6° | 0.1° |
| C3 | C4 | C5 | N7 | 179.8° | 180.0° |
| C3 | C4 | N9 | C8 | 179.8° | 180.0° |
| C4 | C3 | N40 | H40B | 178.1° | 0.1° |
| C4 | C3 | N40 | H40A | 58.1° | 180.0° |
| C4 | C5 | N6 | N7 | 179.5° | 179.9° |
| C4 | C5 | N7 | C8 | 0.0° | 0.0° |
| C5 | C4 | N9 | C8 | 0.1° | 0.0° |
| C4 | C5 | N7 | C10 | 178.0° | 179.9° |
| C5 | C4 | C3 | N40 | 177.9° | 179.9° |
| C4 | C5 | N6 | C1 | 0.8° | 0.5° |
| N6 | C5 | N7 | C8 | 179.6° | 180.0° |
| N6 | C5 | N7 | C10 | 2.4° | 0.1° |
| N6 | C5 | C4 | N9 | 179.5° | 180.0° |
| C5 | N6 | C1 | H1 | 179.3° | 179.8° |
| C5 | N7 | C8 | C10 | 177.9° | 179.9° |
| C5 | N7 | C8 | N9 | 0.0° | 0.0° |
| C5 | N7 | C10 | C11 | 176.1° | 85.0° |
| N7 | C5 | N6 | C1 | 179.7° | 179.5° |
| N7 | C5 | C4 | N9 | 0.1° | 0.0° |
| C5 | N7 | C10 | O14 | 65.5° | 160.9° |
| C5 | N7 | C10 | H10 | 53.2° | 38.0° |
| C5 | N7 | C8 | H8 | 179.9° | 179.9° |
| N7 | C8 | N9 | H8 | 180.0° | 179.9° |
| C8 | N7 | C10 | C11 | 6.3° | 94.9° |
| N7 | C8 | N9 | C4 | 0.1° | 0.0° |
| C8 | N7 | C10 | O14 | 112.1° | 19.2° |
| C8 | N7 | C10 | H10 | 129.1° | 142.1° |
| N9 | C8 | N7 | C10 | 177.9° | 179.9° |
| N7 | C10 | C11 | O14 | 119.5° | 118.7° |
| N7 | C10 | C11 | H10 | 123.3° | 122.9° |
| N7 | C10 | C11 | C12 | 161.1° | 155.7° |
| N7 | C10 | O14 | C13 | 154.6° | 158.7° |
| N7 | C10 | C11 | O39 | 79.0° | 86.1° |
| N7 | C10 | O14 | H10 | 118.4° | 122.9° |
| N7 | C10 | C11 | H11 | 45.3° | 37.4° |
| C10 | N7 | C8 | H8 | 2.0° | 0.0° |
| C10 | C11 | C12 | O39 | 118.2° | 118.2° |
| C10 | C11 | C12 | H11 | 115.9° | 118.2° |
| C10 | C11 | C12 | C13 | 37.0° | 20.9° |
| C11 | C10 | O14 | C13 | 29.3° | 40.0° |
| C10 | C11 | C12 | O38 | 80.3° | 97.8° |
| C10 | C11 | O39 | H11 | 123.5° | 123.6° |
| C11 | C10 | O14 | H10 | 116.3° | 118.5° |
| C10 | C11 | C12 | H12 | 154.2° | 139.6° |
| C10 | C11 | O39 | H39 | 180.0° | 174.2° |
| C11 | C12 | C13 | O38 | 119.5° | 118.7° |
| C11 | C12 | C13 | H12 | 117.3° | 118.6° |
| C11 | C12 | C13 | O14 | 21.5° | 2.0° |
| C11 | C12 | C13 | C15 | 100.7° | 121.4° |
| C11 | C12 | O38 | H12 | 124.7° | 122.6° |
| C12 | C11 | O39 | H11 | 125.1° | 123.7° |
| C12 | C11 | C10 | O14 | 41.6° | 37.0° |
| C12 | C11 | C10 | H10 | 75.6° | 81.4° |
| C11 | C12 | C13 | H13 | 138.6° | 117.4° |
| C11 | C12 | O38 | H38 | 180.0° | 61.4° |
| C12 | C11 | O39 | H39 | 68.6° | 61.5° |
| C12 | C13 | O14 | C15 | 124.2° | 119.4° |
| C12 | C13 | O14 | H13 | 116.3° | 119.4° |
| C12 | C13 | C15 | H13 | 120.5° | 121.1° |
| C12 | C13 | C15 | O16 | 54.0° | 175.0° |
| C13 | C12 | O38 | H12 | 122.2° | 122.6° |
| C13 | C12 | C11 | O39 | 155.2° | 139.1° |
| C12 | C13 | O14 | C10 | 4.5° | 26.5° |
| C13 | C12 | C11 | H11 | 78.9° | 97.3° |
| C12 | C13 | C15 | H15A | 174.2° | 55.1° |
| C12 | C13 | C15 | H15B | 66.2° | 65.0° |
| C13 | C12 | O38 | H38 | 66.9° | 176.3° |
| O14 | C13 | C15 | H13 | 119.9° | 121.1° |
| O14 | C13 | C15 | O16 | 65.6° | 67.2° |
| O14 | C13 | C12 | O38 | 98.0° | 120.7° |
| C13 | O14 | C10 | H10 | 87.0° | 78.5° |
| O14 | C13 | C12 | H12 | 138.8° | 116.7° |
| O14 | C13 | C15 | H15A | 54.6° | 172.9° |
| O14 | C13 | C15 | H15B | 174.2° | 52.8° |
| C13 | C15 | O16 | H15A | 120.2° | 119.9° |
| C13 | C15 | O16 | H15B | 120.2° | 120.0° |
| C13 | C15 | O16 | P17 | 174.2° | 180.0° |
| C15 | C13 | C12 | O38 | 139.7° | 119.9° |
| C15 | C13 | O14 | C10 | 128.7° | 145.8° |
| C15 | C13 | C12 | H12 | 16.6° | 2.7° |
| C13 | C15 | H15A | H15B | 119.3° | 120.1° |
| C15 | O16 | P17 | O18 | 169.8° | 55.0° |
| C15 | O16 | P17 | O19 | 60.2° | 64.9° |
| C15 | O16 | P17 | O20 | 58.3° | 175.0° |
| O16 | C15 | C13 | H13 | 174.5° | 53.9° |
| O16 | C15 | H15A | H15B | 119.3° | 120.0° |
| O16 | P17 | O18 | O19 | 126.0° | 120.0° |
| O16 | P17 | O18 | O20 | 107.3° | 120.0° |
| O16 | P17 | O19 | O20 | 112.1° | 120.0° |
| O16 | P17 | O20 | P21 | 113.8° | 165.0° |
| P17 | O16 | C15 | H15A | 65.5° | 60.1° |
| P17 | O16 | C15 | H15B | 54.0° | 60.0° |
| O16 | P17 | O19 | H2 | 123.3° | 60.0° |
| O18 | P17 | O19 | O20 | 124.6° | 120.0° |
| O18 | P17 | O20 | P21 | 135.4° | 45.0° |
| O18 | P17 | O19 | H2 | 0.0° | 180.0° |
| O19 | P17 | O20 | P21 | 4.7° | 75.0° |
| P17 | O20 | P21 | O22 | 179.4° | 45.0° |
| P17 | O20 | P21 | O23 | 52.4° | 75.0° |
| P17 | O20 | P21 | O24 | 64.1° | 165.0° |
| O20 | P17 | O19 | H2 | 124.6° | 60.0° |
| O20 | P21 | O22 | O23 | 123.2° | 120.0° |
| O20 | P21 | O22 | O24 | 109.4° | 120.0° |
| O20 | P21 | O23 | O24 | 113.0° | 120.0° |
| O20 | P21 | O24 | C25 | 53.1° | 175.0° |
| O20 | P21 | O23 | H3 | 118.6° | 60.0° |
| O22 | P21 | O23 | O24 | 128.4° | 120.0° |
| O22 | P21 | O24 | C25 | 55.8° | 55.0° |
| O22 | P21 | O23 | H3 | 0.0° | 180.0° |
| O23 | P21 | O24 | C25 | 171.4° | 65.0° |
| P21 | O24 | C25 | C26 | 145.8° | 180.0° |
| P21 | O24 | C25 | H25B | 26.3° | 60.0° |
| P21 | O24 | C25 | H25A | 94.5° | 60.0° |
| O24 | P21 | O23 | H3 | 128.4° | 60.0° |
| O24 | C25 | C26 | H25B | 119.6° | 120.0° |
| O24 | C25 | C26 | H25A | 119.6° | 120.0° |
| O24 | C25 | C26 | C27 | 72.6° | 175.0° |
| O24 | C25 | C26 | O30 | 168.2° | 69.6° |
| O24 | C25 | H25B | H25A | 121.2° | 120.0° |
| O24 | C25 | C26 | H26 | 48.6° | 52.8° |
| C25 | C26 | C27 | O30 | 120.6° | 118.8° |
| C25 | C26 | C27 | H26 | 121.3° | 122.2° |
| C25 | C26 | C27 | C28 | 99.8° | 142.8° |
| C25 | C26 | O30 | C29 | 127.3° | 159.3° |
| C25 | C26 | C27 | O37 | 142.1° | 98.6° |
| C25 | C26 | O30 | H26 | 119.1° | 122.3° |
| C26 | C25 | H25B | H25A | 121.2° | 120.0° |
| C25 | C26 | C27 | H27 | 17.9° | 24.1° |
| C26 | C27 | C28 | O37 | 117.4° | 118.7° |
| C26 | C27 | C28 | H27 | 117.8° | 118.7° |
| C26 | C27 | C28 | C29 | 35.2° | 0.0° |
| C27 | C26 | O30 | C29 | 3.9° | 40.5° |
| C26 | C27 | C28 | O36 | 151.0° | 118.6° |
| C26 | C27 | O37 | H27 | 123.3° | 122.7° |
| C27 | C26 | O30 | H26 | 117.5° | 118.9° |
| C27 | C26 | C25 | H25B | 167.8° | 55.0° |
| C27 | C26 | C25 | H25A | 47.0° | 65.0° |
| C26 | C27 | C28 | H28 | 82.3° | 118.6° |
| C26 | C27 | O37 | H37 | 180.0° | 180.0° |
| C27 | C28 | C29 | O36 | 117.7° | 118.6° |
| C27 | C28 | C29 | H28 | 117.5° | 118.7° |
| C27 | C28 | C29 | O30 | 39.2° | 24.0° |
| C27 | C28 | C29 | N31 | 157.4° | 142.8° |
| C27 | C28 | O36 | H28 | 125.8° | 122.7° |
| C28 | C27 | O37 | H27 | 123.9° | 122.6° |
| C28 | C27 | C26 | O30 | 20.8° | 24.0° |
| C28 | C27 | C26 | H26 | 138.9° | 95.0° |
| C27 | C28 | C29 | H29 | 79.1° | 94.9° |
| C27 | C28 | O36 | H36 | 180.0° | 61.5° |
| C28 | C27 | O37 | H37 | 67.2° | 65.3° |
| C28 | C29 | O30 | N31 | 123.7° | 118.9° |
| C28 | C29 | O30 | H29 | 117.1° | 118.8° |
| C28 | C29 | N31 | H29 | 123.0° | 122.3° |
| C28 | C29 | N31 | C32 | 37.8° | 80.0° |
| C29 | C28 | O36 | H28 | 123.9° | 122.7° |
| C29 | C28 | C27 | O37 | 82.2° | 118.7° |
| C28 | C29 | O30 | C26 | 27.3° | 40.5° |
| C28 | C29 | N31 | C35 | 145.8° | 100.0° |
| C29 | C28 | C27 | H27 | 153.0° | 118.7° |
| C29 | C28 | O36 | H36 | 69.7° | 176.1° |
| O30 | C29 | N31 | H29 | 119.6° | 122.2° |
| O30 | C29 | N31 | C32 | 79.7° | 35.4° |
| O30 | C29 | C28 | O36 | 156.9° | 142.6° |
| O30 | C29 | N31 | C35 | 96.8° | 144.6° |
| C29 | O30 | C26 | H26 | 113.6° | 78.4° |
| O30 | C29 | C28 | H28 | 78.3° | 94.7° |
| C29 | N31 | C32 | C35 | 177.0° | 180.0° |
| C29 | N31 | C32 | N33 | 176.8° | 180.0° |
| C29 | N31 | C35 | C34 | 177.0° | 179.7° |
| N31 | C29 | C28 | O36 | 84.9° | 98.5° |
| N31 | C29 | O30 | C26 | 151.0° | 159.4° |
| N31 | C29 | C28 | H28 | 40.0° | 24.2° |
| C29 | N31 | C32 | H32 | 3.2° | 0.3° |
| C29 | N31 | C35 | H35 | 3.0° | 0.3° |
| N31 | C32 | N33 | H32 | 180.0° | 179.8° |
| N31 | C32 | N33 | C34 | 0.1° | 0.2° |
| C32 | N31 | C35 | C34 | 0.1° | 0.3° |
| C32 | N31 | C29 | H29 | 160.7° | 157.7° |
| C32 | N31 | C35 | H35 | 179.9° | 179.7° |
| C32 | N33 | C34 | C35 | 0.0° | 0.4° |
| N33 | C32 | N31 | C35 | 0.1° | 0.0° |
| C32 | N33 | C34 | H34 | 180.0° | 179.9° |
| N33 | C34 | C35 | H34 | 180.0° | 179.7° |
| N33 | C34 | C35 | N31 | 0.1° | 0.4° |
| C34 | N33 | C32 | H32 | 179.9° | 180.0° |
| N33 | C34 | C35 | H35 | 179.9° | 179.6° |
| C34 | C35 | N31 | H35 | 180.0° | 179.9° |
| O36 | C28 | C27 | O37 | 33.6° | 0.1° |
| O36 | C28 | C27 | H27 | 91.2° | 122.7° |
| O36 | C28 | C29 | H29 | 38.6° | 23.8° |
| O37 | C27 | C26 | O30 | 97.3° | 142.6° |
| O37 | C27 | C26 | H26 | 20.8° | 23.7° |
| O37 | C27 | C28 | H28 | 160.3° | 122.7° |
| O38 | C12 | C11 | O39 | 37.8° | 20.3° |
| O38 | C12 | C11 | H11 | 163.7° | 143.9° |
| O38 | C12 | C13 | H13 | 19.0° | 1.3° |
| O39 | C11 | C10 | O14 | 161.4° | 155.2° |
| O39 | C11 | C10 | H10 | 44.2° | 36.8° |
| O39 | C11 | C12 | H12 | 87.6° | 102.3° |
| N40 | C3 | C4 | N9 | 1.9° | 0.1° |
| C3 | N40 | H40B | H40A | 120.0° | 179.9° |
| C4 | N9 | C8 | H8 | 179.9° | 179.9° |
| O14 | C10 | C11 | H11 | 74.3° | 81.3° |
| C10 | O14 | C13 | H13 | 111.8° | 93.0° |
| O30 | C26 | C25 | H25B | 48.6° | 170.4° |
| O30 | C26 | C25 | H25A | 72.2° | 50.4° |
| O30 | C26 | C27 | H27 | 138.5° | 94.7° |
| C26 | O30 | C29 | H29 | 89.8° | 78.4° |
| C35 | N31 | C29 | H29 | 22.8° | 22.3° |
| C35 | N31 | C32 | H32 | 179.9° | 179.7° |
| N31 | C35 | C34 | H34 | 179.9° | 179.9° |
| H11 | C11 | C10 | H10 | 168.5° | 160.3° |
| H11 | C11 | C12 | H12 | 38.3° | 21.3° |
| H11 | C11 | O39 | H39 | 56.5° | 62.2° |
| H12 | C12 | C13 | H13 | 104.1° | 123.9° |
| H12 | C12 | O38 | H38 | 55.3° | 61.1° |
| H13 | C13 | C15 | H15A | 65.3° | 66.0° |
| H13 | C13 | C15 | H15B | 54.3° | 173.9° |
| H25B | C25 | C26 | H26 | 71.0° | 67.2° |
| H25A | C25 | C26 | H26 | 168.2° | 172.8° |
| H26 | C26 | C27 | H27 | 103.3° | 146.4° |
| H27 | C27 | C28 | H28 | 35.5° | 0.1° |
| H27 | C27 | O37 | H37 | 56.7° | 57.3° |
| H28 | C28 | C29 | H29 | 163.5° | 146.5° |
| H28 | C28 | O36 | H36 | 54.2° | 61.2° |
| H34 | C34 | C35 | H35 | 0.1° | 0.1° |
