6CE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O21 | C19 | doub | 1.22Å | 1.26Å | |
| N18 | C19 | sing | 1.34Å | 1.34Å | |
| N18 | C17 | doub | 1.32Å | 1.35Å | |
| C19 | C14 | sing | 1.47Å | 1.47Å | |
| N20 | C17 | sing | 1.37Å | 1.46Å | |
| C17 | N16 | sing | 1.36Å | 1.35Å | |
| C14 | N13 | sing | 1.35Å | 1.35Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.46Å | Aromatic |
| N13 | C12 | doub | 1.30Å | 1.36Å | Aromatic |
| N16 | C15 | sing | 1.37Å | 1.35Å | |
| C15 | N11 | sing | 1.36Å | 1.32Å | Aromatic |
| C12 | N11 | sing | 1.36Å | 1.34Å | Aromatic |
| N11 | C9 | sing | 1.47Å | 1.47Å | |
| C9 | C8 | sing | 1.55Å | 1.52Å | |
| C9 | O10 | sing | 1.44Å | 1.41Å | |
| O23 | C8 | sing | 1.43Å | 1.43Å | |
| C8 | C7 | sing | 1.55Å | 1.53Å | |
| O10 | C6 | sing | 1.44Å | 1.42Å | |
| C7 | C6 | sing | 1.54Å | 1.53Å | |
| C7 | O22 | sing | 1.43Å | 1.44Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| S4 | C5 | sing | 1.81Å | 1.76Å | |
| S4 | P1 | sing | 2.12Å | 2.07Å | |
| C13 | N23 | sing | 1.37Å | 1.37Å | Aromatic |
| C13 | C3 | doub | 1.34Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.51Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| P1 | O3 | doub | 1.48Å | 1.51Å | |
| P1 | NE2 | sing | 1.68Å | 1.73Å | |
| P1 | O2 | sing | 1.61Å | 1.51Å | |
| N23 | C22 | sing | 1.38Å | 1.34Å | Aromatic |
| C3 | C4 | sing | 1.46Å | 1.48Å | Aromatic |
| NE2 | C1 | sing | 1.47Å | 1.45Å | |
| C22 | C4 | doub | 1.41Å | 1.48Å | Aromatic |
| C22 | C27 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C24 | sing | 1.40Å | 1.38Å | Aromatic |
| C27 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C25 | doub | 1.37Å | 1.39Å | Aromatic |
| C26 | C25 | sing | 1.39Å | 1.40Å | Aromatic |
| C8 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| NE2 | H7 | sing | 1.01Å | 1.00Å | |
| O2 | H8 | sing | 0.97Å | 0.95Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.08Å | 1.08Å | |
| N16 | H12 | sing | 0.97Å | 1.00Å | |
| N20 | H13 | sing | 0.97Å | 1.00Å | |
| N20 | H14 | sing | 0.97Å | 1.00Å | |
| O22 | H15 | sing | 0.97Å | 0.95Å | |
| O23 | H16 | sing | 0.97Å | 0.95Å | |
| C1 | H17 | sing | 1.09Å | 1.10Å | |
| C1 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.08Å | 1.08Å | |
| N23 | H20 | sing | 0.97Å | 1.00Å | |
| C24 | H21 | sing | 1.08Å | 1.08Å | |
| C25 | H22 | sing | 1.08Å | 1.08Å | |
| C26 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H24 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O21 | C19 | N18 | 120.7° | 120.7° |
| O21 | C19 | C14 | 121.6° | 120.7° |
| C19 | N18 | C17 | 122.2° | 121.3° |
| N18 | C19 | C14 | 117.7° | 118.6° |
| N18 | C17 | N20 | 118.1° | 118.8° |
| N18 | C17 | N16 | 124.4° | 122.5° |
| C19 | C14 | N13 | 136.5° | 134.5° |
| C19 | C14 | C15 | 116.3° | 118.2° |
| N20 | C17 | N16 | 117.5° | 118.7° |
| C17 | N20 | H13 | 120.0° | 120.0° |
| C17 | N20 | H14 | 120.0° | 119.9° |
| C17 | N16 | C15 | 117.9° | 120.5° |
| C17 | N16 | H12 | 121.1° | 119.7° |
| N13 | C14 | C15 | 107.2° | 107.4° |
| C14 | N13 | C12 | 107.3° | 109.2° |
| C14 | C15 | N16 | 121.5° | 118.8° |
| C14 | C15 | N11 | 105.4° | 106.4° |
| N13 | C12 | N11 | 109.8° | 109.5° |
| N13 | C12 | H11 | 125.1° | 125.3° |
| N16 | C15 | N11 | 133.1° | 134.7° |
| C15 | N16 | H12 | 121.1° | 119.7° |
| C15 | N11 | C12 | 110.4° | 107.5° |
| C15 | N11 | C9 | 122.8° | 126.2° |
| C12 | N11 | C9 | 126.9° | 126.2° |
| N11 | C12 | H11 | 125.1° | 125.2° |
| N11 | C9 | C8 | 112.1° | 110.6° |
| N11 | C9 | O10 | 109.9° | 110.6° |
| N11 | C9 | H10 | 109.9° | 110.6° |
| C8 | C9 | O10 | 105.0° | 103.5° |
| C9 | C8 | O23 | 110.9° | 111.0° |
| C9 | C8 | C7 | 102.1° | 102.1° |
| C9 | C8 | H1 | 109.0° | 110.9° |
| C8 | C9 | H10 | 109.2° | 110.6° |
| C9 | O10 | C6 | 104.3° | 107.0° |
| O10 | C9 | H10 | 110.7° | 110.6° |
| O23 | C8 | C7 | 115.3° | 110.9° |
| O23 | C8 | H1 | 110.2° | 110.8° |
| C8 | O23 | H16 | 109.5° | 114.0° |
| C8 | C7 | C6 | 104.4° | 104.2° |
| C8 | C7 | O22 | 114.0° | 110.5° |
| C7 | C8 | H1 | 108.9° | 110.9° |
| C8 | C7 | H9 | 109.3° | 110.6° |
| O10 | C6 | C7 | 105.4° | 107.2° |
| O10 | C6 | C5 | 109.5° | 109.9° |
| O10 | C6 | H4 | 109.6° | 110.0° |
| C6 | C7 | O22 | 109.0° | 110.4° |
| C7 | C6 | C5 | 116.0° | 109.9° |
| C7 | C6 | H4 | 108.2° | 109.9° |
| C6 | C7 | H9 | 109.3° | 110.5° |
| O22 | C7 | H9 | 110.6° | 110.5° |
| C7 | O22 | H15 | 109.5° | 114.0° |
| C6 | C5 | S4 | 114.0° | 109.5° |
| C6 | C5 | H2 | 108.3° | 109.5° |
| C6 | C5 | H3 | 108.4° | 109.5° |
| C5 | C6 | H4 | 108.1° | 109.9° |
| C5 | S4 | P1 | 104.1° | 103.0° |
| S4 | C5 | H2 | 108.3° | 109.4° |
| S4 | C5 | H3 | 108.3° | 109.4° |
| S4 | P1 | O3 | 106.2° | 109.5° |
| S4 | P1 | NE2 | 105.7° | 109.5° |
| S4 | P1 | O2 | 110.8° | 109.4° |
| N23 | C13 | C3 | 111.4° | 109.9° |
| C13 | N23 | C22 | 111.3° | 109.8° |
| N23 | C13 | H19 | 124.3° | 125.1° |
| C13 | N23 | H20 | 124.4° | 125.1° |
| C13 | C3 | C2 | 126.8° | 126.5° |
| C13 | C3 | C4 | 104.4° | 107.0° |
| C3 | C13 | H19 | 124.3° | 125.0° |
| C3 | C2 | C1 | 113.1° | 109.5° |
| C2 | C3 | C4 | 128.8° | 126.5° |
| C3 | C2 | H5 | 108.6° | 109.5° |
| C3 | C2 | H6 | 108.6° | 109.5° |
| C2 | C1 | NE2 | 112.9° | 109.5° |
| C1 | C2 | H5 | 108.6° | 109.5° |
| C1 | C2 | H6 | 108.6° | 109.5° |
| C2 | C1 | H17 | 108.6° | 109.5° |
| C2 | C1 | H18 | 108.6° | 109.5° |
| O3 | P1 | NE2 | 107.5° | 109.5° |
| O3 | P1 | O2 | 116.7° | 109.5° |
| NE2 | P1 | O2 | 109.3° | 109.5° |
| P1 | NE2 | C1 | 121.8° | 111.0° |
| P1 | NE2 | H7 | 106.3° | 111.0° |
| P1 | O2 | H8 | 109.5° | 114.0° |
| N23 | C22 | C4 | 106.9° | 107.2° |
| N23 | C22 | C27 | 134.4° | 133.5° |
| C22 | N23 | H20 | 124.4° | 125.1° |
| C3 | C4 | C22 | 106.0° | 106.0° |
| C3 | C4 | C24 | 132.9° | 134.0° |
| C1 | NE2 | H7 | 106.3° | 111.0° |
| NE2 | C1 | H17 | 108.6° | 109.5° |
| NE2 | C1 | H18 | 108.6° | 109.4° |
| C4 | C22 | C27 | 118.6° | 119.4° |
| C22 | C4 | C24 | 121.1° | 119.9° |
| C22 | C27 | C26 | 119.0° | 119.8° |
| C22 | C27 | H24 | 120.5° | 120.1° |
| C4 | C24 | C25 | 117.9° | 119.8° |
| C4 | C24 | H21 | 121.1° | 120.1° |
| C27 | C26 | C25 | 121.6° | 120.7° |
| C27 | C26 | H23 | 119.2° | 119.7° |
| C26 | C27 | H24 | 120.5° | 120.1° |
| C24 | C25 | C26 | 121.7° | 120.5° |
| C25 | C24 | H21 | 121.0° | 120.1° |
| C24 | C25 | H22 | 119.2° | 119.8° |
| C26 | C25 | H22 | 119.2° | 119.7° |
| C25 | C26 | H23 | 119.2° | 119.6° |
| H2 | C5 | H3 | 109.5° | 109.5° |
| H5 | C2 | H6 | 109.5° | 109.4° |
| H13 | N20 | H14 | 120.0° | 120.1° |
| H17 | C1 | H18 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O21 | C19 | N18 | C14 | 178.5° | 179.6° |
| O21 | C19 | N18 | C17 | 179.4° | 179.9° |
| O21 | C19 | C14 | N13 | 1.4° | 0.4° |
| O21 | C19 | C14 | C15 | 179.0° | 180.0° |
| C19 | N18 | C17 | N20 | 179.3° | 179.8° |
| C19 | N18 | C17 | N16 | 1.2° | 0.1° |
| N18 | C19 | C14 | N13 | 179.8° | 180.0° |
| N18 | C19 | C14 | C15 | 0.5° | 0.4° |
| C17 | N18 | C19 | C14 | 0.9° | 0.3° |
| N18 | C17 | N20 | N16 | 179.5° | 179.9° |
| N18 | C17 | N16 | C15 | 1.0° | 0.2° |
| N18 | C17 | N16 | H12 | 179.0° | 180.0° |
| N18 | C17 | N20 | H13 | 0.0° | 179.9° |
| N18 | C17 | N20 | H14 | 180.0° | 0.0° |
| C19 | C14 | N13 | C15 | 179.7° | 179.7° |
| C19 | C14 | N13 | C12 | 179.6° | 179.9° |
| C19 | C14 | C15 | N16 | 0.4° | 0.2° |
| C19 | C14 | C15 | N11 | 179.7° | 179.9° |
| N20 | C17 | N16 | C15 | 179.5° | 180.0° |
| N20 | C17 | N16 | H12 | 0.5° | 0.1° |
| C17 | N20 | H13 | H14 | 180.0° | 180.0° |
| C17 | N16 | C15 | C14 | 0.6° | 0.1° |
| C17 | N16 | C15 | H12 | 180.0° | 179.9° |
| C17 | N16 | C15 | N11 | 179.7° | 179.5° |
| N16 | C17 | N20 | H13 | 179.5° | 0.0° |
| N16 | C17 | N20 | H14 | 0.5° | 179.9° |
| N13 | C14 | C15 | N16 | 179.9° | 179.9° |
| N13 | C14 | C15 | N11 | 0.5° | 0.4° |
| C14 | N13 | C12 | N11 | 0.7° | 0.0° |
| C14 | N13 | C12 | H11 | 179.3° | 179.9° |
| C15 | C14 | N13 | C12 | 0.1° | 0.3° |
| C14 | C15 | N16 | N11 | 179.1° | 179.6° |
| C14 | C15 | N11 | C12 | 1.0° | 0.4° |
| C14 | C15 | N11 | C9 | 179.8° | 179.9° |
| C14 | C15 | N16 | H12 | 179.4° | 180.0° |
| N13 | C12 | N11 | C15 | 1.1° | 0.2° |
| N13 | C12 | N11 | H11 | 180.0° | 180.0° |
| N13 | C12 | N11 | C9 | 179.7° | 179.9° |
| N16 | C15 | N11 | C12 | 179.8° | 180.0° |
| N16 | C15 | N11 | C9 | 0.5° | 0.3° |
| C15 | N11 | C12 | C9 | 179.2° | 179.7° |
| C15 | N11 | C9 | C8 | 136.7° | 84.7° |
| C15 | N11 | C9 | O10 | 107.0° | 161.2° |
| C15 | N11 | C9 | H10 | 15.0° | 38.3° |
| C15 | N11 | C12 | H11 | 178.9° | 179.8° |
| N11 | C15 | N16 | H12 | 0.3° | 0.4° |
| C12 | N11 | C9 | C8 | 44.2° | 95.0° |
| C12 | N11 | C9 | O10 | 72.1° | 19.2° |
| C12 | N11 | C9 | H10 | 165.8° | 142.1° |
| N11 | C9 | C8 | O10 | 119.3° | 118.5° |
| N11 | C9 | C8 | H10 | 122.0° | 123.0° |
| N11 | C9 | O10 | H10 | 121.6° | 123.0° |
| N11 | C9 | C8 | O23 | 85.3° | 86.3° |
| N11 | C9 | C8 | C7 | 151.4° | 155.5° |
| N11 | C9 | O10 | C6 | 165.4° | 158.6° |
| N11 | C9 | C8 | H1 | 36.3° | 37.3° |
| C9 | N11 | C12 | H11 | 0.3° | 0.1° |
| C8 | C9 | O10 | H10 | 117.7° | 118.5° |
| C9 | C8 | O23 | C7 | 115.4° | 112.7° |
| C9 | C8 | O23 | H1 | 120.9° | 123.6° |
| C9 | C8 | C7 | H1 | 115.2° | 118.2° |
| C8 | C9 | O10 | C6 | 44.7° | 40.0° |
| C9 | C8 | C7 | C6 | 8.5° | 20.8° |
| C9 | C8 | C7 | O22 | 110.4° | 97.8° |
| C9 | C8 | C7 | H9 | 125.4° | 139.6° |
| C9 | C8 | O23 | H16 | 180.0° | 174.2° |
| O10 | C9 | C8 | O23 | 155.5° | 155.2° |
| O10 | C9 | C8 | C7 | 32.1° | 37.0° |
| C9 | O10 | C6 | C7 | 38.5° | 26.5° |
| C9 | O10 | C6 | C5 | 163.9° | 145.9° |
| O10 | C9 | C8 | H1 | 83.0° | 81.2° |
| C9 | O10 | C6 | H4 | 77.7° | 93.0° |
| O23 | C8 | C7 | H1 | 124.4° | 123.6° |
| O23 | C8 | C7 | C6 | 128.9° | 139.1° |
| O23 | C8 | C7 | O22 | 10.0° | 20.5° |
| O23 | C8 | C7 | H9 | 114.3° | 102.2° |
| O23 | C8 | C9 | H10 | 36.7° | 36.7° |
| C8 | C7 | C6 | O10 | 17.4° | 2.0° |
| C8 | C7 | C6 | O22 | 122.1° | 118.7° |
| C8 | C7 | C6 | H9 | 116.9° | 118.8° |
| C8 | C7 | O22 | H9 | 123.6° | 122.7° |
| C8 | C7 | C6 | C5 | 138.6° | 121.5° |
| C8 | C7 | C6 | H4 | 99.7° | 117.5° |
| C7 | C8 | C9 | H10 | 86.6° | 81.5° |
| C8 | C7 | O22 | H15 | 180.0° | 61.5° |
| C7 | C8 | O23 | H16 | 64.5° | 61.5° |
| O10 | C6 | C7 | C5 | 121.2° | 119.4° |
| O10 | C6 | C7 | H4 | 117.1° | 119.5° |
| O10 | C6 | C7 | O22 | 139.5° | 120.7° |
| O10 | C6 | C5 | H4 | 119.3° | 121.1° |
| O10 | C6 | C5 | S4 | 64.6° | 66.9° |
| O10 | C6 | C5 | H2 | 56.1° | 173.2° |
| O10 | C6 | C5 | H3 | 174.8° | 53.1° |
| O10 | C6 | C7 | H9 | 99.5° | 116.7° |
| C6 | O10 | C9 | H10 | 73.0° | 78.5° |
| C6 | C7 | O22 | H9 | 120.2° | 122.6° |
| C7 | C6 | C5 | H4 | 121.7° | 121.1° |
| C7 | C6 | C5 | S4 | 54.5° | 175.3° |
| C6 | C7 | C8 | H1 | 106.7° | 97.3° |
| C7 | C6 | C5 | H2 | 175.1° | 55.4° |
| C7 | C6 | C5 | H3 | 66.2° | 64.7° |
| C6 | C7 | O22 | H15 | 63.8° | 176.3° |
| O22 | C7 | C6 | C5 | 99.3° | 119.9° |
| O22 | C7 | C8 | H1 | 134.4° | 144.0° |
| O22 | C7 | C6 | H4 | 22.4° | 1.2° |
| C6 | C5 | S4 | H2 | 120.7° | 120.0° |
| C6 | C5 | S4 | H3 | 120.7° | 120.0° |
| C6 | C5 | S4 | P1 | 135.7° | 75.0° |
| C6 | C5 | H2 | H3 | 118.0° | 120.0° |
| C5 | C6 | C7 | H9 | 21.8° | 2.7° |
| C5 | S4 | P1 | O3 | 142.7° | 60.0° |
| C5 | S4 | P1 | NE2 | 103.3° | 180.0° |
| C5 | S4 | P1 | O2 | 15.1° | 60.0° |
| S4 | C5 | H2 | H3 | 117.9° | 119.9° |
| S4 | C5 | C6 | H4 | 176.1° | 54.3° |
| S4 | P1 | O3 | NE2 | 112.8° | 120.0° |
| S4 | P1 | O3 | O2 | 124.1° | 119.9° |
| S4 | P1 | NE2 | O2 | 119.4° | 119.9° |
| S4 | P1 | NE2 | C1 | 81.7° | 180.0° |
| P1 | S4 | C5 | H2 | 103.6° | 45.1° |
| P1 | S4 | C5 | H3 | 15.0° | 165.0° |
| S4 | P1 | NE2 | H7 | 40.0° | 56.0° |
| S4 | P1 | O2 | H8 | 121.6° | 60.1° |
| N23 | C13 | C3 | H19 | 180.0° | 179.8° |
| N23 | C13 | C3 | C2 | 179.2° | 180.0° |
| C13 | N23 | C22 | H20 | 180.0° | 179.8° |
| N23 | C13 | C3 | C4 | 0.8° | 0.0° |
| C13 | N23 | C22 | C4 | 0.1° | 0.4° |
| C13 | N23 | C22 | C27 | 179.8° | 179.8° |
| C13 | C3 | C2 | C4 | 178.0° | 180.0° |
| C13 | C3 | C2 | C1 | 118.3° | 95.0° |
| C3 | C13 | N23 | C22 | 0.6° | 0.3° |
| C13 | C3 | C4 | C22 | 0.7° | 0.3° |
| C13 | C3 | C4 | C24 | 179.9° | 180.0° |
| C13 | C3 | C2 | H5 | 2.2° | 145.0° |
| C13 | C3 | C2 | H6 | 121.2° | 25.0° |
| C3 | C13 | N23 | H20 | 179.4° | 180.0° |
| C3 | C2 | C1 | H5 | 120.5° | 120.0° |
| C3 | C2 | C1 | H6 | 120.6° | 120.0° |
| C3 | C2 | C1 | NE2 | 62.7° | 180.0° |
| C2 | C3 | C4 | C22 | 179.1° | 179.7° |
| C2 | C3 | C4 | C24 | 1.6° | 0.0° |
| C3 | C2 | H5 | H6 | 118.4° | 120.0° |
| C3 | C2 | C1 | H17 | 176.8° | 60.0° |
| C3 | C2 | C1 | H18 | 57.8° | 60.0° |
| C2 | C3 | C13 | H19 | 0.8° | 0.2° |
| C2 | C1 | NE2 | P1 | 139.0° | 135.0° |
| C1 | C2 | C3 | C4 | 63.7° | 85.0° |
| C2 | C1 | NE2 | H17 | 120.5° | 120.0° |
| C2 | C1 | NE2 | H18 | 120.5° | 120.1° |
| C1 | C2 | H5 | H6 | 118.4° | 120.0° |
| C2 | C1 | NE2 | H7 | 17.3° | 11.0° |
| C2 | C1 | H17 | H18 | 118.5° | 120.0° |
| O3 | P1 | NE2 | O2 | 127.5° | 120.0° |
| O3 | P1 | NE2 | C1 | 165.2° | 60.0° |
| O3 | P1 | NE2 | H7 | 73.1° | 176.1° |
| O3 | P1 | O2 | H8 | 0.0° | 179.9° |
| P1 | NE2 | C1 | H7 | 121.7° | 124.0° |
| NE2 | P1 | O2 | H8 | 122.2° | 59.9° |
| P1 | NE2 | C1 | H17 | 18.5° | 15.0° |
| P1 | NE2 | C1 | H18 | 100.5° | 104.9° |
| O2 | P1 | NE2 | C1 | 37.6° | 60.0° |
| O2 | P1 | NE2 | H7 | 159.4° | 63.9° |
| N23 | C22 | C4 | C3 | 0.4° | 0.4° |
| N23 | C22 | C4 | C27 | 179.9° | 179.8° |
| N23 | C22 | C4 | C24 | 179.8° | 179.8° |
| N23 | C22 | C27 | C26 | 180.0° | 179.1° |
| C22 | N23 | C13 | H19 | 179.4° | 179.9° |
| N23 | C22 | C27 | H24 | 0.0° | 0.3° |
| C3 | C4 | C22 | C24 | 179.4° | 179.8° |
| C3 | C4 | C22 | C27 | 179.7° | 179.8° |
| C3 | C4 | C24 | C25 | 179.7° | 179.9° |
| C4 | C3 | C2 | H5 | 175.8° | 35.0° |
| C4 | C3 | C2 | H6 | 56.8° | 155.0° |
| C4 | C3 | C13 | H19 | 179.2° | 179.8° |
| C3 | C4 | C24 | H21 | 0.3° | 0.0° |
| NE2 | C1 | C2 | H5 | 57.8° | 60.0° |
| NE2 | C1 | C2 | H6 | 176.7° | 60.0° |
| NE2 | C1 | H17 | H18 | 118.4° | 119.9° |
| C4 | C22 | C27 | C26 | 0.1° | 0.7° |
| C22 | C4 | C24 | C25 | 0.4° | 0.3° |
| C4 | C22 | N23 | H20 | 179.9° | 179.8° |
| C22 | C4 | C24 | H21 | 179.6° | 179.7° |
| C4 | C22 | C27 | H24 | 179.9° | 180.0° |
| C27 | C22 | C4 | C24 | 0.2° | 0.0° |
| C22 | C27 | C26 | H24 | 180.0° | 179.3° |
| C22 | C27 | C26 | C25 | 0.2° | 1.0° |
| C27 | C22 | N23 | H20 | 0.2° | 0.0° |
| C22 | C27 | C26 | H23 | 179.8° | 179.7° |
| C4 | C24 | C25 | H21 | 180.0° | 179.9° |
| C4 | C24 | C25 | C26 | 0.5° | 0.0° |
| C4 | C24 | C25 | H22 | 179.5° | 180.0° |
| C27 | C26 | C25 | C24 | 0.4° | 0.7° |
| C27 | C26 | C25 | H23 | 180.0° | 179.3° |
| C27 | C26 | C25 | H22 | 179.6° | 179.3° |
| C24 | C25 | C26 | H22 | 180.0° | 180.0° |
| C24 | C25 | C26 | H23 | 179.6° | 180.0° |
| C26 | C25 | C24 | H21 | 179.5° | 179.9° |
| C25 | C26 | C27 | H24 | 179.8° | 179.7° |
| H1 | C8 | C7 | H9 | 10.1° | 21.4° |
| H1 | C8 | C9 | H10 | 158.3° | 160.3° |
| H1 | C8 | O23 | H16 | 59.2° | 62.2° |
| H2 | C5 | C6 | H4 | 63.2° | 65.7° |
| H3 | C5 | C6 | H4 | 55.5° | 174.2° |
| H4 | C6 | C7 | H9 | 143.4° | 123.7° |
| H5 | C2 | C1 | H17 | 62.7° | 60.0° |
| H5 | C2 | C1 | H18 | 178.3° | 180.0° |
| H6 | C2 | C1 | H17 | 56.2° | NaN° |
| H6 | C2 | C1 | H18 | 62.8° | 60.0° |
| H7 | NE2 | C1 | H17 | 103.2° | 109.0° |
| H7 | NE2 | C1 | H18 | 137.8° | 131.1° |
| H9 | C7 | O22 | H15 | 56.4° | 61.2° |
| H19 | C13 | N23 | H20 | 0.6° | 0.2° |
| H21 | C24 | C25 | H22 | 0.5° | 0.1° |
| H22 | C25 | C26 | H23 | 0.4° | 0.0° |
| H23 | C26 | C27 | H24 | 0.2° | 0.3° |
