PRD_001179
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | C19 | sing | 1.53Å | 1.54Å | |
| C19 | C20 | sing | 1.53Å | 1.55Å | |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| C27 | C26 | sing | 1.53Å | 1.55Å | |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| C26 | C28 | sing | 1.53Å | 1.55Å | |
| C26 | C25 | sing | 1.53Å | 1.55Å | |
| C28 | C29 | sing | 1.53Å | 1.55Å | |
| C17 | C22 | sing | 1.51Å | 1.52Å | |
| C17 | N16 | sing | 1.47Å | 1.46Å | |
| C22 | O23 | doub | 1.21Å | 1.23Å | |
| C22 | N24 | sing | 1.35Å | 1.35Å | |
| N24 | C25 | sing | 1.47Å | 1.46Å | |
| N16 | P13 | sing | 1.68Å | 1.76Å | |
| P13 | O14 | doub | 1.48Å | 1.49Å | |
| P13 | O15 | sing | 1.61Å | 1.51Å | |
| P13 | C12 | sing | 1.82Å | 1.83Å | |
| C12 | N11 | sing | 1.47Å | 1.45Å | |
| N11 | C9 | sing | 1.35Å | 1.35Å | |
| O10 | C9 | doub | 1.21Å | 1.23Å | |
| C9 | O8 | sing | 1.35Å | 1.34Å | |
| O8 | C7 | sing | 1.45Å | 1.44Å | |
| C1 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.40Å | Aromatic |
| C7 | C6 | sing | 1.51Å | 1.54Å | |
| C2 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| N16 | H1 | sing | 1.01Å | 1.00Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C18 | H3 | sing | 1.09Å | 1.10Å | |
| C18 | H4 | sing | 1.09Å | 1.10Å | |
| C19 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| N24 | H12 | sing | 0.97Å | 1.00Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.09Å | 1.10Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C28 | H19 | sing | 1.09Å | 1.10Å | |
| C28 | H20 | sing | 1.09Å | 1.10Å | |
| C29 | H21 | sing | 1.09Å | 1.10Å | |
| C29 | H22 | sing | 1.09Å | 1.10Å | |
| C29 | H23 | sing | 1.09Å | 1.10Å | |
| O15 | H24 | sing | 0.97Å | 0.95Å | |
| C12 | H25 | sing | 1.09Å | 1.10Å | |
| C12 | H26 | sing | 1.09Å | 1.10Å | |
| C7 | H27 | sing | 1.09Å | 1.10Å | |
| C7 | H28 | sing | 1.09Å | 1.10Å | |
| C1 | H29 | sing | 1.08Å | 1.08Å | |
| C2 | H30 | sing | 1.08Å | 1.08Å | |
| C3 | H31 | sing | 1.08Å | 1.08Å | |
| C4 | H32 | sing | 1.08Å | 1.08Å | |
| C5 | H33 | sing | 1.08Å | 1.08Å | |
| N11 | H34 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C19 | C20 | 110.4° | 109.5° |
| C21 | C19 | C18 | 111.6° | 109.5° |
| C21 | C19 | H5 | 108.5° | 109.5° |
| C19 | C21 | H9 | 109.5° | 109.5° |
| C19 | C21 | H10 | 109.5° | 109.5° |
| C19 | C21 | H11 | 109.4° | 109.5° |
| C20 | C19 | C18 | 109.2° | 109.5° |
| C20 | C19 | H5 | 108.4° | 109.4° |
| C19 | C20 | H6 | 109.5° | 109.4° |
| C19 | C20 | H7 | 109.5° | 109.4° |
| C19 | C20 | H8 | 109.5° | 109.5° |
| C19 | C18 | C17 | 115.7° | 109.5° |
| C19 | C18 | H3 | 107.9° | 109.5° |
| C19 | C18 | H4 | 107.9° | 109.5° |
| C18 | C19 | H5 | 108.6° | 109.5° |
| C27 | C26 | C28 | 111.3° | 109.5° |
| C27 | C26 | C25 | 112.1° | 109.4° |
| C27 | C26 | H15 | 107.6° | 109.4° |
| C26 | C27 | H16 | 109.5° | 109.5° |
| C26 | C27 | H17 | 109.5° | 109.5° |
| C26 | C27 | H18 | 109.5° | 109.4° |
| C18 | C17 | C22 | 109.1° | 109.5° |
| C18 | C17 | N16 | 105.0° | 109.5° |
| C18 | C17 | H2 | 109.5° | 109.5° |
| C17 | C18 | H3 | 107.9° | 109.4° |
| C17 | C18 | H4 | 107.9° | 109.5° |
| C28 | C26 | C25 | 110.4° | 109.5° |
| C26 | C28 | C29 | 114.6° | 109.5° |
| C28 | C26 | H15 | 107.5° | 109.5° |
| C26 | C28 | H19 | 108.2° | 109.4° |
| C26 | C28 | H20 | 108.2° | 109.4° |
| C26 | C25 | N24 | 112.2° | 109.5° |
| C26 | C25 | H13 | 108.8° | 109.5° |
| C26 | C25 | H14 | 108.8° | 109.5° |
| C25 | C26 | H15 | 107.6° | 109.5° |
| C29 | C28 | H19 | 108.2° | 109.5° |
| C29 | C28 | H20 | 108.2° | 109.5° |
| C28 | C29 | H21 | 109.5° | 109.5° |
| C28 | C29 | H22 | 109.5° | 109.5° |
| C28 | C29 | H23 | 109.5° | 109.5° |
| C22 | C17 | N16 | 112.9° | 109.5° |
| C17 | C22 | O23 | 120.4° | 120.0° |
| C17 | C22 | N24 | 116.4° | 120.1° |
| C22 | C17 | H2 | 109.8° | 109.5° |
| C17 | N16 | P13 | 117.4° | 111.0° |
| C17 | N16 | H1 | 107.4° | 111.0° |
| N16 | C17 | H2 | 110.5° | 109.4° |
| O23 | C22 | N24 | 123.2° | 120.0° |
| C22 | N24 | C25 | 122.0° | 120.0° |
| C22 | N24 | H12 | 119.0° | 120.0° |
| C25 | N24 | H12 | 119.0° | 120.0° |
| N24 | C25 | H13 | 108.8° | 109.4° |
| N24 | C25 | H14 | 108.8° | 109.5° |
| N16 | P13 | O14 | 112.4° | 109.5° |
| N16 | P13 | O15 | 109.3° | 109.5° |
| N16 | P13 | C12 | 101.8° | 109.5° |
| P13 | N16 | H1 | 107.4° | 111.0° |
| O14 | P13 | O15 | 113.0° | 109.5° |
| O14 | P13 | C12 | 109.3° | 109.4° |
| O15 | P13 | C12 | 110.5° | 109.5° |
| P13 | O15 | H24 | 109.5° | 114.0° |
| P13 | C12 | N11 | 107.3° | 109.5° |
| P13 | C12 | H25 | 110.0° | 109.5° |
| P13 | C12 | H26 | 110.0° | 109.5° |
| C12 | N11 | C9 | 120.1° | 120.0° |
| N11 | C12 | H25 | 110.0° | 109.5° |
| N11 | C12 | H26 | 110.0° | 109.4° |
| C12 | N11 | H34 | 120.0° | 119.9° |
| N11 | C9 | O10 | 121.8° | 120.0° |
| N11 | C9 | O8 | 119.4° | 120.0° |
| C9 | N11 | H34 | 119.9° | 120.1° |
| O10 | C9 | O8 | 115.3° | 120.0° |
| C9 | O8 | C7 | 121.0° | 117.0° |
| O8 | C7 | C6 | 110.7° | 109.5° |
| O8 | C7 | H27 | 109.1° | 109.4° |
| O8 | C7 | H28 | 109.1° | 109.4° |
| C2 | C1 | C6 | 120.3° | 120.0° |
| C1 | C2 | C3 | 120.2° | 120.0° |
| C2 | C1 | H29 | 119.8° | 120.0° |
| C1 | C2 | H30 | 119.9° | 120.0° |
| C1 | C6 | C7 | 121.2° | 120.0° |
| C1 | C6 | C5 | 119.3° | 120.0° |
| C6 | C1 | H29 | 119.8° | 120.0° |
| C7 | C6 | C5 | 119.5° | 120.0° |
| C6 | C7 | H27 | 109.2° | 109.5° |
| C6 | C7 | H28 | 109.2° | 109.5° |
| C2 | C3 | C4 | 119.8° | 120.0° |
| C3 | C2 | H30 | 119.9° | 120.0° |
| C2 | C3 | H31 | 120.1° | 120.0° |
| C6 | C5 | C4 | 120.5° | 120.0° |
| C6 | C5 | H33 | 119.8° | 120.0° |
| C3 | C4 | C5 | 119.9° | 120.0° |
| C4 | C3 | H31 | 120.1° | 120.0° |
| C3 | C4 | H32 | 120.0° | 120.0° |
| C5 | C4 | H32 | 120.0° | 120.0° |
| C4 | C5 | H33 | 119.7° | 120.0° |
| H3 | C18 | H4 | 109.5° | 109.5° |
| H6 | C20 | H7 | 109.4° | 109.5° |
| H6 | C20 | H8 | 109.5° | 109.5° |
| H7 | C20 | H8 | 109.5° | 109.5° |
| H9 | C21 | H10 | 109.5° | 109.5° |
| H9 | C21 | H11 | 109.5° | 109.5° |
| H10 | C21 | H11 | 109.5° | 109.4° |
| H13 | C25 | H14 | 109.5° | 109.4° |
| H16 | C27 | H17 | 109.5° | 109.5° |
| H16 | C27 | H18 | 109.4° | 109.5° |
| H17 | C27 | H18 | 109.4° | 109.4° |
| H19 | C28 | H20 | 109.5° | 109.5° |
| H21 | C29 | H22 | 109.5° | 109.4° |
| H21 | C29 | H23 | 109.5° | 109.4° |
| H22 | C29 | H23 | 109.4° | 109.5° |
| H25 | C12 | H26 | 109.5° | 109.5° |
| H27 | C7 | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C19 | C20 | C18 | 123.1° | 120.0° |
| C21 | C19 | C20 | H5 | 118.7° | 120.0° |
| C21 | C19 | C18 | H5 | 119.6° | 120.0° |
| C21 | C19 | C18 | C17 | 165.9° | 65.9° |
| C21 | C19 | C18 | H3 | 45.0° | 174.1° |
| C21 | C19 | C18 | H4 | 73.1° | 54.1° |
| C21 | C19 | C20 | H6 | 180.0° | 60.0° |
| C21 | C19 | C20 | H7 | 60.0° | 59.9° |
| C21 | C19 | C20 | H8 | 60.0° | 180.0° |
| C19 | C21 | H9 | H10 | 120.0° | 120.0° |
| C19 | C21 | H9 | H11 | 120.0° | 120.0° |
| C19 | C21 | H10 | H11 | 120.0° | 120.0° |
| C20 | C19 | C18 | H5 | 118.1° | 119.9° |
| C20 | C19 | C18 | C17 | 71.7° | 174.0° |
| C20 | C19 | C18 | H3 | 167.3° | 54.1° |
| C20 | C19 | C18 | H4 | 49.2° | 66.0° |
| C19 | C20 | H6 | H7 | 120.0° | 119.9° |
| C19 | C20 | H6 | H8 | 120.0° | 120.0° |
| C19 | C20 | H7 | H8 | 120.0° | 120.0° |
| C20 | C19 | C21 | H9 | 180.0° | 180.0° |
| C20 | C19 | C21 | H10 | 60.0° | 59.9° |
| C20 | C19 | C21 | H11 | 60.0° | 60.0° |
| C19 | C18 | C17 | H3 | 120.9° | 120.0° |
| C19 | C18 | C17 | H4 | 120.9° | 120.0° |
| C19 | C18 | C17 | C22 | 62.5° | 175.9° |
| C19 | C18 | C17 | N16 | 176.3° | 64.1° |
| C19 | C18 | C17 | H2 | 57.7° | 55.9° |
| C19 | C18 | H3 | H4 | 117.1° | 120.0° |
| C18 | C19 | C20 | H6 | 56.9° | 60.0° |
| C18 | C19 | C20 | H7 | 63.1° | 180.0° |
| C18 | C19 | C20 | H8 | 177.0° | 60.0° |
| C18 | C19 | C21 | H9 | 58.3° | 60.0° |
| C18 | C19 | C21 | H10 | 178.4° | 180.0° |
| C18 | C19 | C21 | H11 | 61.7° | 60.0° |
| C27 | C26 | C28 | C25 | 125.3° | 120.0° |
| C27 | C26 | C28 | H15 | 117.6° | 120.0° |
| C27 | C26 | C25 | H15 | 118.1° | 120.0° |
| C27 | C26 | C28 | C29 | 179.3° | 65.0° |
| C27 | C26 | C25 | N24 | 53.1° | 65.0° |
| C27 | C26 | C25 | H13 | 173.5° | 55.0° |
| C27 | C26 | C25 | H14 | 67.4° | 175.0° |
| C26 | C27 | H16 | H17 | 120.0° | 120.0° |
| C26 | C27 | H16 | H18 | 120.0° | 120.0° |
| C26 | C27 | H17 | H18 | 120.0° | 119.9° |
| C27 | C26 | C28 | H19 | 59.9° | 55.0° |
| C27 | C26 | C28 | H20 | 58.6° | 175.0° |
| C18 | C17 | C22 | N16 | 116.3° | 120.1° |
| C18 | C17 | C22 | H2 | 119.9° | 120.0° |
| C18 | C17 | N16 | H2 | 117.9° | 120.0° |
| C18 | C17 | C22 | O23 | 94.0° | 120.1° |
| C18 | C17 | C22 | N24 | 84.9° | 60.0° |
| C18 | C17 | N16 | P13 | 163.2° | 145.1° |
| C18 | C17 | N16 | H1 | 75.7° | 90.9° |
| C17 | C18 | H3 | H4 | 117.1° | 120.0° |
| C17 | C18 | C19 | H5 | 46.3° | 54.1° |
| C28 | C26 | C25 | H15 | 117.1° | 120.0° |
| C26 | C28 | C29 | H19 | 120.7° | 120.0° |
| C26 | C28 | C29 | H20 | 120.8° | 120.0° |
| C28 | C26 | C25 | N24 | 177.9° | 175.0° |
| C28 | C26 | C25 | H13 | 61.7° | 65.0° |
| C28 | C26 | C25 | H14 | 57.5° | 55.0° |
| C28 | C26 | C27 | H16 | 180.0° | 180.0° |
| C28 | C26 | C27 | H17 | 60.0° | 60.0° |
| C28 | C26 | C27 | H18 | 60.0° | 60.0° |
| C26 | C28 | H19 | H20 | 117.7° | 120.0° |
| C26 | C28 | C29 | H21 | 180.0° | 60.0° |
| C26 | C28 | C29 | H22 | 60.0° | 60.0° |
| C26 | C28 | C29 | H23 | 60.0° | 180.0° |
| C25 | C26 | C28 | C29 | 54.1° | 175.0° |
| C26 | C25 | N24 | C22 | 83.5° | 180.0° |
| C26 | C25 | N24 | H13 | 120.4° | 120.0° |
| C26 | C25 | N24 | H14 | 120.4° | 120.0° |
| C26 | C25 | N24 | H12 | 96.5° | 0.0° |
| C26 | C25 | H13 | H14 | 118.7° | 120.0° |
| C25 | C26 | C27 | H16 | 55.7° | 60.0° |
| C25 | C26 | C27 | H17 | 64.3° | 60.0° |
| C25 | C26 | C27 | H18 | 175.7° | 180.0° |
| C25 | C26 | C28 | H19 | 174.8° | 65.0° |
| C25 | C26 | C28 | H20 | 66.7° | 55.0° |
| C29 | C28 | C26 | H15 | 63.0° | 55.0° |
| C29 | C28 | H19 | H20 | 117.7° | 120.1° |
| C28 | C29 | H21 | H22 | 120.0° | 120.0° |
| C28 | C29 | H21 | H23 | 120.0° | 120.0° |
| C28 | C29 | H22 | H23 | 120.0° | 120.0° |
| C22 | C17 | N16 | H2 | 123.4° | 120.0° |
| C17 | C22 | O23 | N24 | 178.8° | 180.0° |
| C17 | C22 | N24 | C25 | 179.1° | 180.0° |
| C22 | C17 | N16 | P13 | 78.1° | 94.8° |
| C22 | C17 | N16 | H1 | 43.0° | 29.2° |
| C22 | C17 | C18 | H3 | 58.5° | 64.2° |
| C22 | C17 | C18 | H4 | 176.6° | 55.8° |
| C17 | C22 | N24 | H12 | 0.9° | 0.0° |
| N16 | C17 | C22 | O23 | 149.7° | 0.0° |
| N16 | C17 | C22 | N24 | 31.4° | 180.0° |
| C17 | N16 | P13 | H1 | 121.1° | 124.0° |
| C17 | N16 | P13 | O14 | 114.1° | 65.0° |
| C17 | N16 | P13 | O15 | 12.2° | 55.1° |
| C17 | N16 | P13 | C12 | 129.1° | 175.1° |
| N16 | C17 | C18 | H3 | 62.8° | 55.9° |
| N16 | C17 | C18 | H4 | 55.4° | 175.9° |
| O23 | C22 | N24 | C25 | 0.3° | 0.0° |
| O23 | C22 | C17 | H2 | 25.9° | 119.9° |
| O23 | C22 | N24 | H12 | 179.7° | 180.0° |
| C22 | N24 | C25 | H12 | 180.0° | 180.0° |
| N24 | C22 | C17 | H2 | 155.2° | 60.0° |
| C22 | N24 | C25 | H13 | 36.9° | 60.0° |
| C22 | N24 | C25 | H14 | 156.1° | 60.0° |
| N24 | C25 | H13 | H14 | 118.7° | 120.0° |
| N24 | C25 | C26 | H15 | 65.1° | 55.0° |
| N16 | P13 | O14 | O15 | 124.3° | 120.0° |
| N16 | P13 | O14 | C12 | 112.3° | 120.0° |
| N16 | P13 | O15 | C12 | 111.2° | 120.0° |
| N16 | P13 | C12 | N11 | 176.7° | 179.9° |
| P13 | N16 | C17 | H2 | 45.3° | 25.1° |
| N16 | P13 | O15 | H24 | 125.9° | 60.0° |
| N16 | P13 | C12 | H25 | 57.1° | 60.0° |
| N16 | P13 | C12 | H26 | 63.6° | 60.0° |
| O14 | P13 | O15 | C12 | 122.8° | 119.9° |
| O14 | P13 | C12 | N11 | 64.2° | 60.0° |
| O14 | P13 | N16 | H1 | 124.8° | 171.0° |
| O14 | P13 | O15 | H24 | 0.0° | 180.0° |
| O14 | P13 | C12 | H25 | 176.1° | 60.0° |
| O14 | P13 | C12 | H26 | 55.4° | 180.0° |
| O15 | P13 | C12 | N11 | 60.7° | 59.9° |
| O15 | P13 | N16 | H1 | 108.9° | 68.9° |
| O15 | P13 | C12 | H25 | 58.9° | 180.0° |
| O15 | P13 | C12 | H26 | 179.6° | 60.0° |
| P13 | C12 | N11 | H25 | 119.7° | 120.1° |
| P13 | C12 | N11 | H26 | 119.7° | 120.0° |
| P13 | C12 | N11 | C9 | 157.8° | 94.9° |
| C12 | P13 | N16 | H1 | 8.0° | 51.1° |
| C12 | P13 | O15 | H24 | 122.9° | 60.0° |
| P13 | C12 | H25 | H26 | 121.0° | 120.0° |
| P13 | C12 | N11 | H34 | 22.2° | 85.1° |
| C12 | N11 | C9 | H34 | 180.0° | 180.0° |
| C12 | N11 | C9 | O10 | 16.6° | 0.1° |
| C12 | N11 | C9 | O8 | 174.2° | 180.0° |
| N11 | C12 | H25 | H26 | 121.0° | 119.9° |
| N11 | C9 | O10 | O8 | 158.5° | 179.9° |
| N11 | C9 | O8 | C7 | 169.2° | 180.0° |
| C9 | N11 | C12 | H25 | 82.5° | 145.0° |
| C9 | N11 | C12 | H26 | 38.1° | 25.0° |
| O10 | C9 | O8 | C7 | 31.8° | 0.1° |
| O10 | C9 | N11 | H34 | 163.4° | 179.9° |
| C9 | O8 | C7 | C6 | 112.1° | 180.0° |
| C9 | O8 | C7 | H27 | 127.7° | 60.0° |
| C9 | O8 | C7 | H28 | 8.1° | 60.0° |
| O8 | C9 | N11 | H34 | 5.8° | 0.0° |
| O8 | C7 | C6 | C1 | 81.3° | 89.7° |
| O8 | C7 | C6 | H27 | 120.2° | 120.0° |
| O8 | C7 | C6 | H28 | 120.2° | 120.0° |
| O8 | C7 | C6 | C5 | 98.8° | 90.0° |
| O8 | C7 | H27 | H28 | 119.4° | 119.9° |
| C2 | C1 | C6 | H29 | 180.0° | 180.0° |
| C2 | C1 | C6 | C7 | 179.7° | 180.0° |
| C1 | C2 | C3 | H30 | 180.0° | 179.9° |
| C2 | C1 | C6 | C5 | 0.2° | 0.3° |
| C1 | C2 | C3 | C4 | 0.4° | 0.0° |
| C1 | C2 | C3 | H31 | 179.6° | 179.9° |
| C1 | C6 | C7 | C5 | 179.8° | 179.8° |
| C6 | C1 | C2 | C3 | 0.5° | 0.0° |
| C1 | C6 | C5 | C4 | 0.2° | 0.5° |
| C1 | C6 | C7 | H27 | 158.5° | 30.2° |
| C1 | C6 | C7 | H28 | 38.9° | 150.3° |
| C6 | C1 | C2 | H30 | 179.5° | 180.0° |
| C1 | C6 | C5 | H33 | 179.8° | 179.7° |
| C7 | C6 | C5 | C4 | 179.9° | 179.8° |
| C6 | C7 | H27 | H28 | 119.4° | 120.0° |
| C7 | C6 | C1 | H29 | 0.3° | 0.0° |
| C7 | C6 | C5 | H33 | 0.1° | 0.1° |
| C2 | C3 | C4 | H31 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.0° | 0.3° |
| C3 | C2 | C1 | H29 | 179.5° | 179.9° |
| C2 | C3 | C4 | H32 | 180.0° | 179.9° |
| C6 | C5 | C4 | C3 | 0.3° | 0.5° |
| C6 | C5 | C4 | H33 | 180.0° | 179.8° |
| C5 | C6 | C7 | H27 | 21.3° | 150.0° |
| C5 | C6 | C7 | H28 | 141.0° | 30.0° |
| C5 | C6 | C1 | H29 | 179.9° | 179.7° |
| C6 | C5 | C4 | H32 | 179.7° | 179.7° |
| C3 | C4 | C5 | H32 | 180.0° | 179.8° |
| C4 | C3 | C2 | H30 | 179.6° | 180.0° |
| C3 | C4 | C5 | H33 | 179.7° | 179.7° |
| C5 | C4 | C3 | H31 | 180.0° | 179.9° |
| H1 | N16 | C17 | H2 | 166.4° | 149.1° |
| H2 | C17 | C18 | H3 | 178.6° | 175.9° |
| H2 | C17 | C18 | H4 | 63.3° | 64.2° |
| H3 | C18 | C19 | H5 | 74.6° | 65.9° |
| H4 | C18 | C19 | H5 | 167.3° | 174.1° |
| H5 | C19 | C20 | H6 | 61.3° | 180.0° |
| H5 | C19 | C20 | H7 | 178.8° | 60.0° |
| H5 | C19 | C20 | H8 | 58.8° | 60.0° |
| H5 | C19 | C21 | H9 | 61.3° | 60.0° |
| H5 | C19 | C21 | H10 | 58.7° | 60.0° |
| H5 | C19 | C21 | H11 | 178.7° | 179.9° |
| H6 | C20 | H7 | H8 | 120.0° | 120.1° |
| H9 | C21 | H10 | H11 | 120.0° | 120.0° |
| H12 | N24 | C25 | H13 | 143.1° | 120.0° |
| H12 | N24 | C25 | H14 | 23.9° | 120.0° |
| H13 | C25 | C26 | H15 | 55.4° | 175.0° |
| H14 | C25 | C26 | H15 | 174.5° | 65.0° |
| H15 | C26 | C27 | H16 | 62.4° | 60.0° |
| H15 | C26 | C27 | H17 | 177.6° | 180.0° |
| H15 | C26 | C27 | H18 | 57.6° | 60.0° |
| H15 | C26 | C28 | H19 | 57.7° | 175.0° |
| H15 | C26 | C28 | H20 | 176.2° | 65.0° |
| H16 | C27 | H17 | H18 | 119.9° | 120.1° |
| H19 | C28 | C29 | H21 | 59.3° | 179.9° |
| H19 | C28 | C29 | H22 | 179.3° | 60.0° |
| H19 | C28 | C29 | H23 | 60.8° | 60.1° |
| H20 | C28 | C29 | H21 | 59.2° | 60.0° |
| H20 | C28 | C29 | H22 | 60.8° | 180.0° |
| H20 | C28 | C29 | H23 | 179.3° | 60.0° |
| H21 | C29 | H22 | H23 | 120.0° | 120.0° |
| H25 | C12 | N11 | H34 | 97.5° | 35.0° |
| H26 | C12 | N11 | H34 | 141.9° | 155.0° |
| H29 | C1 | C2 | H30 | 0.5° | 0.0° |
| H30 | C2 | C3 | H31 | 0.4° | 0.1° |
| H31 | C3 | C4 | H32 | 0.0° | 0.0° |
| H32 | C4 | C5 | H33 | 0.3° | 0.1° |
