6NG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.51Å | 1.54Å | |
| C6 | C1 | doub | 1.38Å | 1.41Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C7 | O8 | sing | 1.45Å | 1.47Å | |
| O8 | C9 | sing | 1.35Å | 1.34Å | |
| C9 | O10 | doub | 1.22Å | 1.22Å | |
| C9 | N11 | sing | 1.35Å | 1.32Å | |
| N11 | C12 | sing | 1.46Å | 1.44Å | |
| C12 | P13 | sing | 1.82Å | 1.82Å | |
| O14 | P13 | doub | 1.48Å | 1.51Å | |
| O15 | P13 | sing | 1.61Å | 1.49Å | |
| P13 | N16 | sing | 1.68Å | 1.75Å | |
| C30 | C28 | sing | 1.53Å | 1.56Å | |
| C25 | N24 | sing | 1.46Å | 1.46Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| N16 | C17 | sing | 1.47Å | 1.45Å | |
| N24 | C22 | sing | 1.35Å | 1.33Å | |
| C28 | C26 | sing | 1.53Å | 1.57Å | |
| C28 | C31 | sing | 1.53Å | 1.54Å | |
| C28 | C29 | sing | 1.53Å | 1.55Å | |
| O23 | C22 | doub | 1.21Å | 1.23Å | |
| C22 | C17 | sing | 1.51Å | 1.52Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C21 | C19 | sing | 1.53Å | 1.52Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C27 | H15 | sing | 1.09Å | 1.10Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| N16 | H18 | sing | 1.01Å | 1.00Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| N24 | H20 | sing | 0.97Å | 1.00Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å | |
| C30 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H29 | sing | 1.09Å | 1.10Å | |
| C31 | H30 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H32 | sing | 1.09Å | 1.10Å | |
| C18 | H33 | sing | 1.09Å | 1.10Å | |
| C18 | H34 | sing | 1.09Å | 1.10Å | |
| C5 | H35 | sing | 1.08Å | 1.08Å | |
| C4 | H36 | sing | 1.08Å | 1.08Å | |
| O15 | H37 | sing | 0.97Å | 0.95Å | |
| N11 | H38 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C3 | 122.2° | 120.0° |
| C4 | C5 | C6 | 119.1° | 120.0° |
| C4 | C5 | H35 | 120.5° | 120.0° |
| C5 | C4 | H36 | 118.9° | 120.0° |
| C4 | C3 | C2 | 118.6° | 120.0° |
| C4 | C3 | H3 | 120.7° | 120.0° |
| C3 | C4 | H36 | 118.9° | 120.0° |
| C5 | C6 | C7 | 121.0° | 120.0° |
| C5 | C6 | C1 | 119.0° | 120.0° |
| C6 | C5 | H35 | 120.5° | 120.0° |
| C3 | C2 | C1 | 119.0° | 120.0° |
| C3 | C2 | H2 | 120.5° | 120.0° |
| C2 | C3 | H3 | 120.7° | 120.0° |
| C7 | C6 | C1 | 120.0° | 120.0° |
| C6 | C7 | O8 | 101.8° | 109.5° |
| C6 | C7 | H4 | 111.4° | 109.4° |
| C6 | C7 | H5 | 111.3° | 109.4° |
| C6 | C1 | C2 | 122.1° | 120.0° |
| C6 | C1 | H1 | 118.9° | 120.0° |
| C2 | C1 | H1 | 118.9° | 120.1° |
| C1 | C2 | H2 | 120.5° | 120.0° |
| C7 | O8 | C9 | 116.5° | 117.0° |
| O8 | C7 | H4 | 111.4° | 109.5° |
| O8 | C7 | H5 | 111.4° | 109.5° |
| O8 | C9 | O10 | 124.7° | 120.0° |
| O8 | C9 | N11 | 109.0° | 120.0° |
| O10 | C9 | N11 | 126.0° | 120.0° |
| C9 | N11 | C12 | 120.3° | 120.0° |
| C9 | N11 | H38 | 119.9° | 120.0° |
| N11 | C12 | P13 | 112.2° | 109.5° |
| N11 | C12 | H6 | 108.8° | 109.5° |
| N11 | C12 | H7 | 108.8° | 109.5° |
| C12 | N11 | H38 | 119.9° | 120.0° |
| C12 | P13 | O14 | 109.3° | 109.4° |
| C12 | P13 | O15 | 110.8° | 109.5° |
| C12 | P13 | N16 | 102.4° | 109.5° |
| P13 | C12 | H6 | 108.8° | 109.4° |
| P13 | C12 | H7 | 108.8° | 109.5° |
| O14 | P13 | O15 | 113.1° | 109.5° |
| O14 | P13 | N16 | 108.3° | 109.5° |
| O15 | P13 | N16 | 112.5° | 109.5° |
| P13 | O15 | H37 | 109.5° | 114.0° |
| P13 | N16 | C17 | 118.4° | 111.0° |
| P13 | N16 | H18 | 107.2° | 111.0° |
| C30 | C28 | C26 | 111.7° | 109.5° |
| C30 | C28 | C31 | 108.7° | 109.5° |
| C30 | C28 | C29 | 105.0° | 109.5° |
| C28 | C30 | H27 | 109.5° | 109.5° |
| C28 | C30 | H28 | 109.4° | 109.4° |
| C28 | C30 | H29 | 109.5° | 109.4° |
| N24 | C25 | C26 | 111.6° | 109.5° |
| C25 | N24 | C22 | 121.0° | 120.0° |
| C25 | N24 | H20 | 119.5° | 120.0° |
| N24 | C25 | H21 | 109.0° | 109.5° |
| N24 | C25 | H22 | 108.9° | 109.5° |
| C25 | C26 | C28 | 110.5° | 109.5° |
| C25 | C26 | C27 | 112.8° | 109.4° |
| C26 | C25 | H21 | 108.9° | 109.5° |
| C26 | C25 | H22 | 109.0° | 109.5° |
| C25 | C26 | H23 | 106.8° | 109.5° |
| N16 | C17 | C22 | 112.8° | 109.5° |
| N16 | C17 | C18 | 105.2° | 109.5° |
| C17 | N16 | H18 | 107.2° | 111.0° |
| N16 | C17 | H19 | 110.5° | 109.4° |
| N24 | C22 | O23 | 123.4° | 120.0° |
| N24 | C22 | C17 | 116.9° | 120.0° |
| C22 | N24 | H20 | 119.5° | 120.0° |
| C26 | C28 | C31 | 110.8° | 109.5° |
| C26 | C28 | C29 | 111.3° | 109.5° |
| C28 | C26 | C27 | 113.1° | 109.5° |
| C28 | C26 | H23 | 106.4° | 109.5° |
| C31 | C28 | C29 | 109.1° | 109.5° |
| C28 | C31 | H30 | 109.5° | 109.5° |
| C28 | C31 | H31 | 109.5° | 109.5° |
| C28 | C31 | H32 | 109.5° | 109.5° |
| C28 | C29 | H24 | 109.5° | 109.4° |
| C28 | C29 | H25 | 109.5° | 109.5° |
| C28 | C29 | H26 | 109.5° | 109.5° |
| O23 | C22 | C17 | 119.7° | 120.0° |
| C22 | C17 | C18 | 109.2° | 109.5° |
| C22 | C17 | H19 | 109.6° | 109.5° |
| C26 | C27 | H15 | 109.5° | 109.5° |
| C26 | C27 | H16 | 109.5° | 109.4° |
| C26 | C27 | H17 | 109.4° | 109.4° |
| C27 | C26 | H23 | 106.7° | 109.5° |
| C17 | C18 | C19 | 114.8° | 109.4° |
| C18 | C17 | H19 | 109.3° | 109.4° |
| C17 | C18 | H33 | 108.2° | 109.4° |
| C17 | C18 | H34 | 108.2° | 109.5° |
| C18 | C19 | C21 | 110.5° | 109.4° |
| C18 | C19 | C20 | 110.7° | 109.5° |
| C18 | C19 | H8 | 108.0° | 109.5° |
| C19 | C18 | H33 | 108.1° | 109.5° |
| C19 | C18 | H34 | 108.1° | 109.5° |
| C21 | C19 | C20 | 111.6° | 109.5° |
| C21 | C19 | H8 | 108.0° | 109.5° |
| C19 | C21 | H12 | 109.5° | 109.5° |
| C19 | C21 | H13 | 109.5° | 109.5° |
| C19 | C21 | H14 | 109.4° | 109.5° |
| C20 | C19 | H8 | 107.9° | 109.5° |
| C19 | C20 | H9 | 109.5° | 109.4° |
| C19 | C20 | H10 | 109.5° | 109.4° |
| C19 | C20 | H11 | 109.5° | 109.4° |
| H4 | C7 | H5 | 109.4° | 109.5° |
| H6 | C12 | H7 | 109.5° | 109.5° |
| H9 | C20 | H10 | 109.4° | 109.5° |
| H9 | C20 | H11 | 109.5° | 109.5° |
| H10 | C20 | H11 | 109.5° | 109.5° |
| H12 | C21 | H13 | 109.5° | 109.5° |
| H12 | C21 | H14 | 109.5° | 109.4° |
| H13 | C21 | H14 | 109.5° | 109.4° |
| H15 | C27 | H16 | 109.5° | 109.4° |
| H15 | C27 | H17 | 109.4° | 109.5° |
| H16 | C27 | H17 | 109.5° | 109.5° |
| H21 | C25 | H22 | 109.4° | 109.4° |
| H24 | C29 | H25 | 109.5° | 109.4° |
| H24 | C29 | H26 | 109.5° | 109.5° |
| H25 | C29 | H26 | 109.4° | 109.5° |
| H27 | C30 | H28 | 109.4° | 109.5° |
| H27 | C30 | H29 | 109.5° | 109.5° |
| H28 | C30 | H29 | 109.5° | 109.5° |
| H30 | C31 | H31 | 109.5° | 109.4° |
| H30 | C31 | H32 | 109.5° | 109.5° |
| H31 | C31 | H32 | 109.5° | 109.5° |
| H33 | C18 | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C3 | H36 | 180.0° | 179.7° |
| C4 | C5 | C6 | H35 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.6° | 0.3° |
| C4 | C5 | C6 | C7 | 179.8° | 180.0° |
| C4 | C5 | C6 | C1 | 0.1° | 0.1° |
| C5 | C4 | C3 | H3 | 179.4° | 179.7° |
| C3 | C4 | C5 | C6 | 0.2° | 0.3° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.8° | 0.1° |
| C4 | C3 | C2 | H2 | 179.2° | 179.9° |
| C3 | C4 | C5 | H35 | 179.8° | 179.7° |
| C5 | C6 | C7 | C1 | 179.8° | 179.9° |
| C5 | C6 | C1 | C2 | 0.3° | 0.4° |
| C5 | C6 | C7 | O8 | 111.6° | 90.0° |
| C5 | C6 | C1 | H1 | 179.7° | 180.0° |
| C5 | C6 | C7 | H4 | 129.6° | 30.1° |
| C5 | C6 | C7 | H5 | 7.2° | 150.1° |
| C6 | C5 | C4 | H36 | 179.8° | 180.0° |
| C3 | C2 | C1 | C6 | 0.7° | 0.4° |
| C3 | C2 | C1 | H2 | 180.0° | 179.9° |
| C3 | C2 | C1 | H1 | 179.3° | 180.0° |
| C2 | C3 | C4 | H36 | 179.4° | 180.0° |
| C7 | C6 | C1 | C2 | 179.5° | 179.7° |
| C6 | C7 | O8 | H4 | 118.8° | 120.0° |
| C6 | C7 | O8 | H5 | 118.8° | 120.0° |
| C6 | C7 | O8 | C9 | 159.7° | 180.0° |
| C7 | C6 | C1 | H1 | 0.5° | 0.1° |
| C6 | C7 | H4 | H5 | 123.5° | 120.0° |
| C7 | C6 | C5 | H35 | 0.2° | 0.1° |
| C6 | C1 | C2 | H1 | 180.0° | 179.6° |
| C1 | C6 | C7 | O8 | 68.6° | 89.9° |
| C6 | C1 | C2 | H2 | 179.3° | 179.7° |
| C1 | C6 | C7 | H4 | 50.2° | 150.0° |
| C1 | C6 | C7 | H5 | 172.7° | 30.0° |
| C1 | C6 | C5 | H35 | 180.0° | 180.0° |
| C1 | C2 | C3 | H3 | 179.2° | 180.0° |
| C7 | O8 | C9 | O10 | 0.6° | 0.0° |
| C7 | O8 | C9 | N11 | 173.1° | 180.0° |
| O8 | C7 | H4 | H5 | 123.6° | 120.0° |
| O8 | C9 | O10 | N11 | 172.5° | 180.0° |
| O8 | C9 | N11 | C12 | 175.1° | 180.0° |
| C9 | O8 | C7 | H4 | 40.9° | 60.0° |
| C9 | O8 | C7 | H5 | 81.6° | 60.0° |
| O8 | C9 | N11 | H38 | 4.9° | 0.0° |
| O10 | C9 | N11 | C12 | 1.6° | 0.0° |
| O10 | C9 | N11 | H38 | 178.4° | 180.0° |
| C9 | N11 | C12 | H38 | 180.0° | 179.9° |
| C9 | N11 | C12 | P13 | 149.8° | 95.0° |
| C9 | N11 | C12 | H6 | 89.7° | 24.9° |
| C9 | N11 | C12 | H7 | 29.5° | 145.0° |
| N11 | C12 | P13 | H6 | 120.4° | 120.0° |
| N11 | C12 | P13 | H7 | 120.4° | 120.0° |
| N11 | C12 | P13 | O14 | 89.7° | 60.0° |
| N11 | C12 | P13 | O15 | 35.5° | 60.0° |
| N11 | C12 | P13 | N16 | 155.7° | 180.0° |
| N11 | C12 | H6 | H7 | 118.8° | 120.0° |
| C12 | P13 | O14 | O15 | 123.9° | 120.0° |
| C12 | P13 | O14 | N16 | 110.8° | 120.0° |
| C12 | P13 | O15 | N16 | 113.9° | 120.0° |
| C12 | P13 | N16 | C17 | 132.5° | 175.3° |
| P13 | C12 | H6 | H7 | 118.7° | 120.0° |
| C12 | P13 | N16 | H18 | 106.2° | 51.4° |
| C12 | P13 | O15 | H37 | 123.0° | 64.8° |
| P13 | C12 | N11 | H38 | 30.2° | 85.0° |
| O14 | P13 | O15 | N16 | 123.0° | 120.0° |
| O14 | P13 | N16 | C17 | 17.2° | 64.7° |
| O14 | P13 | C12 | H6 | 149.9° | 60.0° |
| O14 | P13 | C12 | H7 | 30.7° | 180.0° |
| O14 | P13 | N16 | H18 | 138.5° | 171.4° |
| O14 | P13 | O15 | H37 | 0.0° | 175.2° |
| O15 | P13 | N16 | C17 | 108.5° | 55.3° |
| O15 | P13 | C12 | H6 | 84.9° | 180.0° |
| O15 | P13 | C12 | H7 | 155.9° | 60.0° |
| O15 | P13 | N16 | H18 | 12.8° | 68.6° |
| P13 | N16 | C17 | H18 | 121.3° | 123.9° |
| P13 | N16 | C17 | C22 | 80.0° | 144.4° |
| P13 | N16 | C17 | C18 | 161.1° | 95.5° |
| N16 | P13 | C12 | H6 | 35.3° | 60.0° |
| N16 | P13 | C12 | H7 | 83.9° | 60.0° |
| P13 | N16 | C17 | H19 | 43.2° | 24.4° |
| N16 | P13 | O15 | H37 | 123.1° | 55.2° |
| C30 | C28 | C26 | C25 | 49.1° | 60.0° |
| C30 | C28 | C26 | C31 | 121.4° | 120.0° |
| C30 | C28 | C26 | C29 | 117.1° | 120.0° |
| C30 | C28 | C31 | C29 | 113.9° | 120.0° |
| C30 | C28 | C26 | C27 | 176.8° | 180.0° |
| C30 | C28 | C26 | H23 | 66.4° | 60.0° |
| C30 | C28 | C29 | H24 | 180.0° | 60.0° |
| C30 | C28 | C29 | H25 | 60.0° | 60.0° |
| C30 | C28 | C29 | H26 | 60.0° | 180.0° |
| C28 | C30 | H27 | H28 | 120.0° | 120.0° |
| C28 | C30 | H27 | H29 | 120.0° | 120.0° |
| C28 | C30 | H28 | H29 | 120.0° | 119.9° |
| C30 | C28 | C31 | H30 | 180.0° | 180.0° |
| C30 | C28 | C31 | H31 | 60.0° | 60.1° |
| C30 | C28 | C31 | H32 | 60.0° | 60.0° |
| N24 | C25 | C26 | H21 | 120.3° | 120.0° |
| N24 | C25 | C26 | H22 | 120.3° | 120.0° |
| C25 | N24 | C22 | H20 | 180.0° | 179.9° |
| N24 | C25 | C26 | C28 | 174.9° | 175.0° |
| C25 | N24 | C22 | O23 | 0.6° | 3.0° |
| C25 | N24 | C22 | C17 | 177.8° | 176.9° |
| N24 | C25 | C26 | C27 | 57.3° | 65.0° |
| N24 | C25 | H21 | H22 | 119.0° | 120.0° |
| N24 | C25 | C26 | H23 | 59.6° | 55.0° |
| C26 | C25 | N24 | C22 | 142.4° | 180.0° |
| C25 | C26 | C28 | C27 | 127.7° | 120.0° |
| C25 | C26 | C28 | H23 | 115.5° | 120.0° |
| C25 | C26 | C28 | C31 | 170.5° | 60.0° |
| C25 | C26 | C28 | C29 | 67.9° | 180.0° |
| C25 | C26 | C27 | H23 | 117.0° | 120.0° |
| C25 | C26 | C27 | H15 | 180.0° | 60.0° |
| C25 | C26 | C27 | H16 | 60.0° | 179.9° |
| C25 | C26 | C27 | H17 | 60.0° | 60.0° |
| C26 | C25 | N24 | H20 | 37.6° | 0.1° |
| C26 | C25 | H21 | H22 | 119.0° | 120.0° |
| N16 | C17 | C22 | N24 | 32.6° | 167.6° |
| N16 | C17 | C22 | O23 | 150.0° | 12.4° |
| N16 | C17 | C22 | C18 | 116.6° | 120.0° |
| N16 | C17 | C22 | H19 | 123.7° | 120.0° |
| N16 | C17 | C18 | H19 | 118.7° | 119.9° |
| N16 | C17 | C18 | C19 | 176.7° | 178.1° |
| N16 | C17 | C18 | H33 | 56.0° | 61.9° |
| N16 | C17 | C18 | H34 | 62.5° | 58.1° |
| N24 | C22 | O23 | C17 | 177.2° | 180.0° |
| N24 | C22 | C17 | C18 | 84.0° | 72.3° |
| N24 | C22 | C17 | H19 | 156.3° | 47.7° |
| C22 | N24 | C25 | H21 | 97.2° | 60.0° |
| C22 | N24 | C25 | H22 | 22.1° | 59.9° |
| C26 | C28 | C31 | C29 | 122.9° | 120.0° |
| C28 | C26 | C27 | H23 | 116.6° | 120.0° |
| C28 | C26 | C27 | H15 | 53.6° | 180.0° |
| C28 | C26 | C27 | H16 | 66.4° | 60.0° |
| C28 | C26 | C27 | H17 | 173.6° | 60.0° |
| C28 | C26 | C25 | H21 | 54.6° | 54.9° |
| C28 | C26 | C25 | H22 | 64.8° | 65.0° |
| C26 | C28 | C29 | H24 | 58.9° | 60.0° |
| C26 | C28 | C29 | H25 | 178.9° | 180.0° |
| C26 | C28 | C29 | H26 | 61.1° | 60.0° |
| C26 | C28 | C30 | H27 | 180.0° | 60.0° |
| C26 | C28 | C30 | H28 | 60.0° | 180.0° |
| C26 | C28 | C30 | H29 | 60.0° | 60.0° |
| C26 | C28 | C31 | H30 | 56.8° | 60.0° |
| C26 | C28 | C31 | H31 | 63.2° | 180.0° |
| C26 | C28 | C31 | H32 | 176.8° | 60.0° |
| C31 | C28 | C26 | C27 | 61.8° | 60.0° |
| C31 | C28 | C26 | H23 | 55.0° | 180.0° |
| C31 | C28 | C29 | H24 | 63.7° | 180.0° |
| C31 | C28 | C29 | H25 | 56.3° | 60.1° |
| C31 | C28 | C29 | H26 | 176.3° | 60.0° |
| C31 | C28 | C30 | H27 | 57.4° | 60.0° |
| C31 | C28 | C30 | H28 | 62.6° | 60.0° |
| C31 | C28 | C30 | H29 | 177.4° | 180.0° |
| C28 | C31 | H30 | H31 | 120.0° | 120.0° |
| C28 | C31 | H30 | H32 | 120.0° | 120.0° |
| C28 | C31 | H31 | H32 | 120.0° | 120.0° |
| C29 | C28 | C26 | C27 | 59.7° | 60.0° |
| C29 | C28 | C26 | H23 | 176.5° | 60.0° |
| C28 | C29 | H24 | H25 | 120.0° | 119.9° |
| C28 | C29 | H24 | H26 | 120.0° | 120.0° |
| C28 | C29 | H25 | H26 | 120.0° | 120.0° |
| C29 | C28 | C30 | H27 | 59.2° | 180.0° |
| C29 | C28 | C30 | H28 | 179.2° | 60.0° |
| C29 | C28 | C30 | H29 | 60.8° | 60.0° |
| C29 | C28 | C31 | H30 | 66.1° | 60.0° |
| C29 | C28 | C31 | H31 | 173.9° | 60.0° |
| C29 | C28 | C31 | H32 | 53.9° | 180.0° |
| O23 | C22 | C17 | C18 | 93.4° | 107.6° |
| O23 | C22 | C17 | H19 | 26.4° | 132.4° |
| O23 | C22 | N24 | H20 | 179.5° | 176.9° |
| C22 | C17 | C18 | H19 | 119.9° | 120.0° |
| C22 | C17 | C18 | C19 | 61.9° | 61.8° |
| C22 | C17 | N16 | H18 | 158.7° | 91.7° |
| C17 | C22 | N24 | H20 | 2.2° | 3.2° |
| C22 | C17 | C18 | H33 | 177.3° | 58.1° |
| C22 | C17 | C18 | H34 | 58.8° | 178.1° |
| C26 | C27 | H15 | H16 | 120.0° | 119.9° |
| C26 | C27 | H15 | H17 | 120.0° | 120.0° |
| C26 | C27 | H16 | H17 | 120.0° | 120.0° |
| C27 | C26 | C25 | H21 | 177.6° | 175.0° |
| C27 | C26 | C25 | H22 | 63.0° | 55.0° |
| C17 | C18 | C19 | H33 | 120.8° | 119.9° |
| C17 | C18 | C19 | H34 | 120.8° | 120.0° |
| C17 | C18 | C19 | C21 | 68.8° | 173.8° |
| C17 | C18 | C19 | C20 | 167.0° | 66.2° |
| C17 | C18 | C19 | H8 | 49.1° | 53.8° |
| C18 | C17 | N16 | H18 | 39.8° | 28.4° |
| C17 | C18 | H33 | H34 | 117.6° | 120.0° |
| C18 | C19 | C21 | C20 | 123.7° | 120.0° |
| C18 | C19 | C21 | H8 | 117.9° | 120.1° |
| C18 | C19 | C20 | H8 | 118.0° | 120.1° |
| C18 | C19 | C20 | H9 | 180.0° | 54.5° |
| C18 | C19 | C20 | H10 | 60.0° | 174.6° |
| C18 | C19 | C20 | H11 | 60.0° | 65.5° |
| C18 | C19 | C21 | H12 | 180.0° | 60.0° |
| C18 | C19 | C21 | H13 | 60.0° | 60.0° |
| C18 | C19 | C21 | H14 | 60.0° | 180.0° |
| C19 | C18 | C17 | H19 | 58.0° | 58.2° |
| C19 | C18 | H33 | H34 | 117.6° | 120.1° |
| C21 | C19 | C20 | H8 | 118.4° | 120.0° |
| C21 | C19 | C20 | H9 | 56.4° | 65.4° |
| C21 | C19 | C20 | H10 | 63.6° | 54.6° |
| C21 | C19 | C20 | H11 | 176.4° | 174.6° |
| C19 | C21 | H12 | H13 | 120.0° | 120.0° |
| C19 | C21 | H12 | H14 | 120.0° | 120.0° |
| C19 | C21 | H13 | H14 | 120.0° | 120.0° |
| C21 | C19 | C18 | H33 | 51.9° | 53.9° |
| C21 | C19 | C18 | H34 | 170.4° | 66.1° |
| C19 | C20 | H9 | H10 | 120.0° | 120.0° |
| C19 | C20 | H9 | H11 | 120.0° | 120.0° |
| C19 | C20 | H10 | H11 | 120.0° | 119.9° |
| C20 | C19 | C21 | H12 | 56.3° | 60.0° |
| C20 | C19 | C21 | H13 | 176.3° | 180.0° |
| C20 | C19 | C21 | H14 | 63.7° | 60.0° |
| C20 | C19 | C18 | H33 | 72.3° | 173.9° |
| C20 | C19 | C18 | H34 | 46.2° | 53.8° |
| H1 | C1 | C2 | H2 | 0.7° | 0.1° |
| H2 | C2 | C3 | H3 | 0.8° | 0.1° |
| H3 | C3 | C4 | H36 | 0.6° | 0.0° |
| H6 | C12 | N11 | H38 | 90.2° | 155.0° |
| H7 | C12 | N11 | H38 | 150.6° | 35.0° |
| H8 | C19 | C20 | H9 | 62.1° | 174.6° |
| H8 | C19 | C20 | H10 | 178.0° | 65.4° |
| H8 | C19 | C20 | H11 | 58.0° | 54.6° |
| H8 | C19 | C21 | H12 | 62.1° | 179.9° |
| H8 | C19 | C21 | H13 | 57.9° | 60.0° |
| H8 | C19 | C21 | H14 | 177.9° | 60.0° |
| H8 | C19 | C18 | H33 | 169.8° | 66.1° |
| H8 | C19 | C18 | H34 | 71.7° | 173.8° |
| H9 | C20 | H10 | H11 | 120.0° | 120.1° |
| H12 | C21 | H13 | H14 | 120.0° | 120.0° |
| H15 | C27 | H16 | H17 | 120.0° | 120.1° |
| H15 | C27 | C26 | H23 | 63.0° | 60.0° |
| H16 | C27 | C26 | H23 | 177.0° | 60.0° |
| H17 | C27 | C26 | H23 | 57.0° | 180.0° |
| H18 | N16 | C17 | H19 | 78.1° | 148.3° |
| H19 | C17 | C18 | H33 | 62.7° | 178.2° |
| H19 | C17 | C18 | H34 | 178.8° | 61.8° |
| H20 | N24 | C25 | H21 | 82.7° | 120.1° |
| H20 | N24 | C25 | H22 | 157.9° | 119.9° |
| H21 | C25 | C26 | H23 | 60.7° | 65.1° |
| H22 | C25 | C26 | H23 | 179.9° | 175.0° |
| H24 | C29 | H25 | H26 | 120.0° | 120.0° |
| H27 | C30 | H28 | H29 | 120.0° | 120.1° |
| H30 | C31 | H31 | H32 | 120.0° | 120.0° |
| H35 | C5 | C4 | H36 | 0.2° | 0.0° |
