567
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C2 | doub | 1.21Å | 1.23Å | |
| N3 | C2 | sing | 1.35Å | 1.34Å | |
| C2 | C19 | sing | 1.51Å | 1.53Å | |
| C19 | C18 | sing | 1.53Å | 1.53Å | |
| C18 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C20 | sing | 1.51Å | 1.54Å | |
| C15 | N5 | sing | 1.46Å | 1.46Å | |
| O5 | C20 | doub | 1.21Å | 1.23Å | |
| C20 | N6 | sing | 1.35Å | 1.35Å | |
| N5 | C14 | sing | 1.35Å | 1.34Å | |
| N6 | C21 | sing | 1.47Å | 1.44Å | |
| C21 | C25 | sing | 1.51Å | 1.49Å | |
| O6 | C8 | doub | 1.21Å | 1.23Å | |
| O3 | S1 | doub | 1.42Å | 1.42Å | |
| C13 | N7 | sing | 1.37Å | 1.36Å | Aromatic |
| C13 | C12 | doub | 1.34Å | 1.40Å | Aromatic |
| C14 | C5 | sing | 1.51Å | 1.58Å | |
| C14 | O1 | doub | 1.21Å | 1.23Å | |
| N7 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.51Å | 1.58Å | |
| C8 | O7 | sing | 1.34Å | 1.23Å | |
| C5 | C1 | sing | 1.53Å | 1.55Å | |
| C5 | N4 | sing | 1.47Å | 1.45Å | |
| C9 | S1 | sing | 1.81Å | 1.78Å | |
| C1 | C12 | sing | 1.51Å | 1.52Å | |
| C25 | C24 | doub | 1.38Å | 1.40Å | Aromatic |
| C25 | C16 | sing | 1.38Å | 1.41Å | Aromatic |
| C12 | C4 | sing | 1.46Å | 1.44Å | Aromatic |
| S1 | N4 | sing | 1.66Å | 1.72Å | |
| S1 | O4 | doub | 1.42Å | 1.41Å | |
| C24 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | doub | 1.41Å | 1.44Å | Aromatic |
| C3 | C7 | sing | 1.39Å | 1.41Å | Aromatic |
| C4 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| C7 | C10 | doub | 1.38Å | 1.43Å | Aromatic |
| C23 | C22 | doub | 1.39Å | 1.42Å | Aromatic |
| C17 | C22 | sing | 1.40Å | 1.41Å | Aromatic |
| C11 | C6 | doub | 1.37Å | 1.43Å | Aromatic |
| C22 | C26 | sing | 1.48Å | 1.48Å | |
| C10 | C6 | sing | 1.39Å | 1.43Å | Aromatic |
| C26 | N2 | doub | 1.30Å | 1.32Å | |
| C26 | N1 | sing | 1.38Å | 1.33Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| N1 | HN1A | sing | 0.97Å | 1.00Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| N3 | HN3 | sing | 0.97Å | 1.00Å | |
| N3 | HN3A | sing | 0.97Å | 1.00Å | |
| N5 | HN5 | sing | 0.97Å | 1.00Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| N6 | HN6 | sing | 0.97Å | 1.00Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| N4 | HN4 | sing | 0.97Å | 1.00Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| O7 | HO7 | sing | 0.97Å | 0.95Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| N7 | HN7 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C2 | N3 | 124.0° | 120.0° |
| O2 | C2 | C19 | 121.3° | 120.0° |
| N3 | C2 | C19 | 114.6° | 120.0° |
| C2 | N3 | HN3 | 113.0° | 120.0° |
| C2 | N3 | HN3A | 123.5° | 120.0° |
| C2 | C19 | C18 | 108.0° | 109.4° |
| C2 | C19 | H19 | 110.0° | 109.4° |
| C2 | C19 | H19A | 110.3° | 109.5° |
| C19 | C18 | C15 | 112.7° | 109.5° |
| C19 | C18 | H18 | 108.4° | 109.5° |
| C19 | C18 | H18A | 107.7° | 109.5° |
| C18 | C19 | H19 | 110.0° | 109.5° |
| C18 | C19 | H19A | 110.3° | 109.5° |
| C18 | C15 | C20 | 110.4° | 109.5° |
| C18 | C15 | N5 | 110.9° | 109.5° |
| C18 | C15 | H15 | 108.1° | 109.4° |
| C15 | C18 | H18 | 108.4° | 109.4° |
| C15 | C18 | H18A | 107.6° | 109.5° |
| C20 | C15 | N5 | 110.2° | 109.5° |
| C15 | C20 | O5 | 121.7° | 120.0° |
| C15 | C20 | N6 | 113.7° | 120.0° |
| C20 | C15 | H15 | 108.8° | 109.4° |
| C15 | N5 | C14 | 119.0° | 120.0° |
| C15 | N5 | HN5 | 120.5° | 120.0° |
| N5 | C15 | H15 | 108.3° | 109.5° |
| O5 | C20 | N6 | 124.6° | 119.9° |
| C20 | N6 | C21 | 117.1° | 120.0° |
| C20 | N6 | HN6 | 121.4° | 120.0° |
| N5 | C14 | C5 | 115.2° | 120.0° |
| N5 | C14 | O1 | 122.9° | 120.0° |
| C14 | N5 | HN5 | 120.5° | 120.0° |
| N6 | C21 | C25 | 112.9° | 109.4° |
| C21 | N6 | HN6 | 121.5° | 120.0° |
| N6 | C21 | H21 | 108.3° | 109.5° |
| N6 | C21 | H21A | 107.6° | 109.5° |
| C21 | C25 | C24 | 118.7° | 119.9° |
| C21 | C25 | C16 | 121.2° | 119.8° |
| C25 | C21 | H21 | 108.3° | 109.5° |
| C25 | C21 | H21A | 107.6° | 109.5° |
| O6 | C8 | C9 | 118.7° | 120.0° |
| O6 | C8 | O7 | 122.8° | 120.0° |
| O3 | S1 | C9 | 111.7° | 110.5° |
| O3 | S1 | N4 | 103.1° | 104.3° |
| O3 | S1 | O4 | 118.2° | 121.0° |
| N7 | C13 | C12 | 110.3° | 109.9° |
| C13 | N7 | C3 | 110.0° | 109.8° |
| N7 | C13 | H13 | 124.9° | 125.0° |
| C13 | N7 | HN7 | 125.0° | 125.1° |
| C13 | C12 | C1 | 126.2° | 126.5° |
| C13 | C12 | C4 | 106.0° | 107.0° |
| C12 | C13 | H13 | 124.9° | 125.1° |
| C5 | C14 | O1 | 121.9° | 119.9° |
| C14 | C5 | C1 | 111.8° | 109.5° |
| C14 | C5 | N4 | 110.6° | 109.5° |
| C14 | C5 | H5 | 107.3° | 109.5° |
| N7 | C3 | C4 | 106.7° | 107.2° |
| N7 | C3 | C7 | 134.5° | 133.5° |
| C3 | N7 | HN7 | 125.0° | 125.1° |
| C9 | C8 | O7 | 118.5° | 120.0° |
| C8 | C9 | S1 | 110.7° | 109.5° |
| C8 | C9 | H9 | 109.1° | 109.5° |
| C8 | C9 | H9A | 108.8° | 109.5° |
| C8 | O7 | HO7 | 109.5° | 117.0° |
| C1 | C5 | N4 | 110.1° | 109.4° |
| C5 | C1 | C12 | 112.3° | 109.5° |
| C1 | C5 | H5 | 107.9° | 109.4° |
| C5 | C1 | H1 | 108.5° | 109.4° |
| C5 | C1 | H1A | 107.9° | 109.4° |
| C5 | N4 | S1 | 120.0° | 120.0° |
| N4 | C5 | H5 | 109.1° | 109.5° |
| C5 | N4 | HN4 | 106.1° | 120.0° |
| C9 | S1 | N4 | 111.9° | 104.5° |
| C9 | S1 | O4 | 108.2° | 110.6° |
| S1 | C9 | H9 | 109.1° | 109.5° |
| S1 | C9 | H9A | 108.7° | 109.5° |
| C1 | C12 | C4 | 127.8° | 126.5° |
| C12 | C1 | H1 | 108.5° | 109.5° |
| C12 | C1 | H1A | 107.9° | 109.5° |
| C24 | C25 | C16 | 120.2° | 120.3° |
| C25 | C24 | C23 | 120.0° | 120.2° |
| C25 | C24 | H24 | 120.0° | 119.9° |
| C25 | C16 | C17 | 119.8° | 120.1° |
| C25 | C16 | H16 | 120.1° | 120.0° |
| C12 | C4 | C3 | 107.0° | 106.0° |
| C12 | C4 | C11 | 134.0° | 134.1° |
| N4 | S1 | O4 | 103.3° | 104.2° |
| S1 | N4 | HN4 | 106.1° | 120.0° |
| C24 | C23 | C22 | 120.7° | 119.9° |
| C24 | C23 | H23 | 119.7° | 120.1° |
| C23 | C24 | H24 | 120.0° | 119.9° |
| C16 | C17 | C22 | 120.3° | 119.8° |
| C17 | C16 | H16 | 120.1° | 119.9° |
| C16 | C17 | H17 | 119.9° | 120.1° |
| C4 | C3 | C7 | 118.8° | 119.3° |
| C3 | C4 | C11 | 119.0° | 119.9° |
| C3 | C7 | C10 | 122.6° | 119.8° |
| C3 | C7 | H7 | 118.7° | 120.1° |
| C4 | C11 | C6 | 122.4° | 119.8° |
| C4 | C11 | H11 | 118.8° | 120.1° |
| C7 | C10 | C6 | 118.6° | 120.7° |
| C10 | C7 | H7 | 118.7° | 120.1° |
| C7 | C10 | H10 | 120.8° | 119.7° |
| C23 | C22 | C17 | 119.0° | 119.7° |
| C23 | C22 | C26 | 120.1° | 120.2° |
| C22 | C23 | H23 | 119.6° | 120.0° |
| C17 | C22 | C26 | 120.9° | 120.1° |
| C22 | C17 | H17 | 119.8° | 120.1° |
| C11 | C6 | C10 | 118.7° | 120.5° |
| C11 | C6 | H6 | 120.6° | 119.7° |
| C6 | C11 | H11 | 118.8° | 120.1° |
| C22 | C26 | N2 | 120.7° | 120.0° |
| C22 | C26 | N1 | 122.5° | 120.0° |
| C10 | C6 | H6 | 120.7° | 119.8° |
| C6 | C10 | H10 | 120.7° | 119.6° |
| N2 | C26 | N1 | 116.7° | 120.0° |
| C26 | N2 | HN2 | 109.0° | 120.0° |
| C26 | N1 | HN1 | 109.0° | 120.0° |
| C26 | N1 | HN1A | 125.5° | 120.0° |
| HN1 | N1 | HN1A | 125.5° | 120.0° |
| HN3 | N3 | HN3A | 123.5° | 120.0° |
| H18 | C18 | H18A | 112.1° | 109.5° |
| H19 | C19 | H19A | 108.3° | 109.5° |
| H21 | C21 | H21A | 112.2° | 109.5° |
| H1 | C1 | H1A | 111.7° | 109.5° |
| H9 | C9 | H9A | 110.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C2 | N3 | C19 | 177.9° | 179.9° |
| O2 | C2 | C19 | C18 | 49.4° | 0.1° |
| O2 | C2 | N3 | HN3 | 180.0° | 180.0° |
| O2 | C2 | N3 | HN3A | 0.0° | 0.1° |
| O2 | C2 | C19 | H19 | 70.5° | 120.0° |
| O2 | C2 | C19 | H19A | 170.0° | 120.0° |
| N3 | C2 | C19 | C18 | 128.5° | 180.0° |
| C2 | N3 | HN3 | HN3A | 180.0° | 179.9° |
| N3 | C2 | C19 | H19 | 111.5° | 60.0° |
| N3 | C2 | C19 | H19A | 7.9° | 59.9° |
| C2 | C19 | C18 | H19 | 120.0° | 120.0° |
| C2 | C19 | C18 | H19A | 120.6° | 120.0° |
| C2 | C19 | C18 | C15 | 174.8° | 180.0° |
| C19 | C2 | N3 | HN3 | 2.1° | 0.1° |
| C19 | C2 | N3 | HN3A | 177.9° | 180.0° |
| C2 | C19 | C18 | H18 | 54.8° | 60.0° |
| C2 | C19 | C18 | H18A | 66.6° | 60.0° |
| C2 | C19 | H19 | H19A | 120.6° | 120.0° |
| C19 | C18 | C15 | H18 | 120.0° | 120.0° |
| C19 | C18 | C15 | H18A | 118.6° | 120.1° |
| C19 | C18 | C15 | C20 | 176.2° | 175.0° |
| C19 | C18 | C15 | N5 | 61.3° | 65.0° |
| C19 | C18 | C15 | H15 | 57.3° | 55.1° |
| C19 | C18 | H18 | H18A | 118.7° | 120.1° |
| C18 | C19 | H19 | H19A | 120.6° | 120.1° |
| C18 | C15 | C20 | N5 | 122.9° | 120.0° |
| C18 | C15 | C20 | H15 | 118.5° | 119.9° |
| C18 | C15 | N5 | H15 | 118.5° | 120.0° |
| C18 | C15 | C20 | O5 | 85.0° | 120.0° |
| C18 | C15 | C20 | N6 | 95.5° | 60.0° |
| C18 | C15 | N5 | C14 | 179.7° | 85.0° |
| C18 | C15 | N5 | HN5 | 0.4° | 95.0° |
| C15 | C18 | H18 | H18A | 118.7° | 120.0° |
| C15 | C18 | C19 | H19 | 65.2° | 60.1° |
| C15 | C18 | C19 | H19A | 54.2° | 60.0° |
| C20 | C15 | N5 | H15 | 118.9° | 120.0° |
| C15 | C20 | O5 | N6 | 179.5° | 180.0° |
| C20 | C15 | N5 | C14 | 57.0° | 155.0° |
| C15 | C20 | N6 | C21 | 176.4° | 180.0° |
| C20 | C15 | N5 | HN5 | 123.0° | 25.0° |
| C20 | C15 | C18 | H18 | 56.2° | 65.0° |
| C20 | C15 | C18 | H18A | 65.2° | 55.0° |
| C15 | C20 | N6 | HN6 | 3.6° | 0.0° |
| N5 | C15 | C20 | O5 | 37.9° | 0.0° |
| N5 | C15 | C20 | N6 | 141.6° | 180.0° |
| C15 | N5 | C14 | HN5 | 180.0° | 180.0° |
| C15 | N5 | C14 | C5 | 179.8° | 180.0° |
| C15 | N5 | C14 | O1 | 0.8° | 0.0° |
| N5 | C15 | C18 | H18 | 178.7° | 55.0° |
| N5 | C15 | C18 | H18A | 57.3° | 175.0° |
| O5 | C20 | N6 | C21 | 4.1° | 0.1° |
| O5 | C20 | C15 | H15 | 156.5° | 120.0° |
| O5 | C20 | N6 | HN6 | 175.9° | 180.0° |
| C20 | N6 | C21 | HN6 | 180.0° | 180.0° |
| C20 | N6 | C21 | C25 | 101.3° | 180.0° |
| N6 | C20 | C15 | H15 | 23.0° | 59.9° |
| C20 | N6 | C21 | H21 | 138.7° | 60.0° |
| C20 | N6 | C21 | H21A | 17.2° | 60.0° |
| N5 | C14 | C5 | O1 | 179.4° | 180.0° |
| N5 | C14 | C5 | C1 | 91.4° | 80.0° |
| N5 | C14 | C5 | N4 | 145.6° | 160.0° |
| N5 | C14 | C5 | H5 | 26.7° | 40.0° |
| C14 | N5 | C15 | H15 | 61.9° | 35.0° |
| N6 | C21 | C25 | H21 | 120.0° | 120.0° |
| N6 | C21 | C25 | H21A | 118.5° | 120.0° |
| N6 | C21 | C25 | C24 | 110.1° | 90.0° |
| N6 | C21 | C25 | C16 | 68.7° | 90.5° |
| N6 | C21 | H21 | H21A | 118.6° | 120.0° |
| C21 | C25 | C24 | C16 | 178.8° | 179.4° |
| C21 | C25 | C24 | C23 | 177.4° | 180.0° |
| C21 | C25 | C16 | C17 | 177.0° | 180.0° |
| C25 | C21 | N6 | HN6 | 78.7° | 0.0° |
| C25 | C21 | H21 | H21A | 118.6° | 120.0° |
| C21 | C25 | C16 | H16 | 3.0° | 0.2° |
| C21 | C25 | C24 | H24 | 2.6° | 0.3° |
| O6 | C8 | C9 | O7 | 179.8° | 180.0° |
| O6 | C8 | C9 | S1 | 53.4° | 0.0° |
| O6 | C8 | C9 | H9 | 66.6° | 120.0° |
| O6 | C8 | C9 | H9A | 172.8° | 120.0° |
| O6 | C8 | O7 | HO7 | 0.0° | 0.1° |
| O3 | S1 | C9 | C8 | 70.6° | 68.4° |
| O3 | S1 | N4 | C5 | 45.9° | 51.0° |
| O3 | S1 | C9 | N4 | 115.1° | 111.6° |
| O3 | S1 | C9 | O4 | 131.8° | 136.8° |
| O3 | S1 | N4 | O4 | 123.6° | 127.8° |
| O3 | S1 | N4 | HN4 | 74.1° | 128.9° |
| O3 | S1 | C9 | H9 | 49.4° | 171.6° |
| O3 | S1 | C9 | H9A | 169.9° | 51.6° |
| N7 | C13 | C12 | H13 | 180.0° | 179.7° |
| C13 | N7 | C3 | HN7 | 180.0° | 179.6° |
| N7 | C13 | C12 | C1 | 176.9° | 180.0° |
| N7 | C13 | C12 | C4 | 0.5° | 0.4° |
| C13 | N7 | C3 | C4 | 0.2° | 0.1° |
| C13 | N7 | C3 | C7 | 179.2° | 180.0° |
| C12 | C13 | N7 | C3 | 0.2° | 0.3° |
| C13 | C12 | C1 | C5 | 89.4° | 95.0° |
| C13 | C12 | C1 | C4 | 176.9° | 179.5° |
| C13 | C12 | C4 | C3 | 0.7° | 0.3° |
| C13 | C12 | C4 | C11 | 179.9° | 179.9° |
| C13 | C12 | C1 | H1 | 30.6° | 145.0° |
| C13 | C12 | C1 | H1A | 151.9° | 24.9° |
| C12 | C13 | N7 | HN7 | 179.8° | 179.9° |
| C14 | C5 | C1 | N4 | 123.4° | 120.0° |
| C14 | C5 | C1 | H5 | 117.7° | 120.0° |
| C14 | C5 | N4 | H5 | 117.8° | 120.1° |
| C14 | C5 | C1 | C12 | 169.7° | 175.0° |
| C14 | C5 | N4 | S1 | 80.5° | 95.0° |
| C5 | C14 | N5 | HN5 | 0.2° | 0.0° |
| C14 | C5 | C1 | H1 | 49.7° | 55.0° |
| C14 | C5 | C1 | H1A | 71.5° | 65.0° |
| C14 | C5 | N4 | HN4 | 159.5° | 84.9° |
| O1 | C14 | C5 | C1 | 89.3° | 100.0° |
| O1 | C14 | C5 | N4 | 33.8° | 20.0° |
| O1 | C14 | C5 | H5 | 152.6° | 140.0° |
| O1 | C14 | N5 | HN5 | 179.2° | 180.0° |
| N7 | C3 | C4 | C12 | 0.6° | 0.2° |
| N7 | C3 | C4 | C7 | 179.5° | 180.0° |
| N7 | C3 | C4 | C11 | 179.9° | 180.0° |
| N7 | C3 | C7 | C10 | 179.8° | 179.9° |
| N7 | C3 | C7 | H7 | 0.2° | 0.0° |
| C3 | N7 | C13 | H13 | 179.8° | 180.0° |
| C8 | C9 | S1 | H9 | 120.0° | 120.0° |
| C8 | C9 | S1 | H9A | 119.5° | 120.0° |
| C8 | C9 | S1 | N4 | 174.3° | 180.0° |
| C8 | C9 | S1 | O4 | 61.2° | 68.4° |
| C8 | C9 | H9 | H9A | 119.5° | 120.0° |
| C9 | C8 | O7 | HO7 | 179.7° | 180.0° |
| O7 | C8 | C9 | S1 | 126.8° | 180.0° |
| O7 | C8 | C9 | H9 | 113.1° | 60.0° |
| O7 | C8 | C9 | H9A | 7.4° | 60.0° |
| C1 | C5 | N4 | H5 | 118.2° | 119.9° |
| C5 | C1 | C12 | H1 | 120.0° | 119.9° |
| C5 | C1 | C12 | H1A | 118.8° | 120.0° |
| C5 | C1 | C12 | C4 | 93.8° | 85.4° |
| C1 | C5 | N4 | S1 | 155.5° | 145.0° |
| C5 | C1 | H1 | H1A | 118.8° | 119.9° |
| C1 | C5 | N4 | HN4 | 35.5° | 35.1° |
| C5 | N4 | S1 | C9 | 74.3° | 65.0° |
| N4 | C5 | C1 | C12 | 66.9° | 65.0° |
| C5 | N4 | S1 | HN4 | 120.0° | 179.9° |
| C5 | N4 | S1 | O4 | 169.5° | 178.9° |
| N4 | C5 | C1 | H1 | 173.1° | 175.0° |
| N4 | C5 | C1 | H1A | 51.8° | 55.0° |
| C9 | S1 | N4 | O4 | 116.2° | 116.1° |
| C9 | S1 | N4 | HN4 | 165.7° | 115.0° |
| S1 | C9 | H9 | H9A | 119.5° | 120.0° |
| C1 | C12 | C4 | C3 | 176.7° | 180.0° |
| C1 | C12 | C4 | C11 | 2.8° | 0.3° |
| C12 | C1 | C5 | H5 | 52.0° | 55.0° |
| C1 | C12 | C13 | H13 | 3.1° | 0.3° |
| C12 | C1 | H1 | H1A | 118.8° | 120.1° |
| C25 | C24 | C23 | H24 | 180.0° | 179.7° |
| C24 | C25 | C16 | C17 | 1.8° | 0.5° |
| C25 | C24 | C23 | C22 | 1.1° | 0.2° |
| C24 | C25 | C21 | H21 | 9.9° | 29.9° |
| C24 | C25 | C21 | H21A | 131.4° | 150.0° |
| C24 | C25 | C16 | H16 | 178.2° | 179.7° |
| C25 | C24 | C23 | H23 | 178.8° | 179.7° |
| C16 | C25 | C24 | C23 | 1.4° | 0.5° |
| C25 | C16 | C17 | H16 | 180.0° | 179.8° |
| C25 | C16 | C17 | C22 | 0.3° | 0.2° |
| C16 | C25 | C21 | H21 | 171.3° | 149.5° |
| C16 | C25 | C21 | H21A | 49.8° | 29.4° |
| C25 | C16 | C17 | H17 | 179.7° | 179.8° |
| C16 | C25 | C24 | H24 | 178.6° | 179.7° |
| C12 | C4 | C3 | C11 | 179.6° | 179.8° |
| C12 | C4 | C3 | C7 | 179.0° | 179.8° |
| C12 | C4 | C11 | C6 | 179.1° | 179.7° |
| C12 | C4 | C11 | H11 | 0.9° | 0.2° |
| C4 | C12 | C13 | H13 | 179.4° | 179.9° |
| C4 | C12 | C1 | H1 | 146.3° | 34.5° |
| C4 | C12 | C1 | H1A | 25.0° | 154.6° |
| S1 | N4 | C5 | H5 | 37.3° | 25.1° |
| N4 | S1 | C9 | H9 | 65.7° | 60.0° |
| N4 | S1 | C9 | H9A | 54.8° | 60.0° |
| O4 | S1 | N4 | HN4 | 49.5° | 1.1° |
| O4 | S1 | C9 | H9 | 178.8° | 51.7° |
| O4 | S1 | C9 | H9A | 58.3° | 171.6° |
| C24 | C23 | C22 | H23 | 180.0° | 180.0° |
| C24 | C23 | C22 | C17 | 3.2° | 0.1° |
| C24 | C23 | C22 | C26 | 176.8° | 180.0° |
| C16 | C17 | C22 | C23 | 2.8° | 0.1° |
| C16 | C17 | C22 | H17 | 180.0° | 180.0° |
| C16 | C17 | C22 | C26 | 177.2° | 180.0° |
| C4 | C3 | C7 | C10 | 0.4° | 0.1° |
| C3 | C4 | C11 | C6 | 0.3° | 0.0° |
| C3 | C4 | C11 | H11 | 179.7° | 179.9° |
| C4 | C3 | C7 | H7 | 179.6° | 179.9° |
| C4 | C3 | N7 | HN7 | 179.8° | 179.7° |
| C7 | C3 | C4 | C11 | 0.6° | 0.0° |
| C3 | C7 | C10 | H7 | 180.0° | 179.9° |
| C3 | C7 | C10 | C6 | 0.1° | 0.1° |
| C3 | C7 | C10 | H10 | 179.9° | 179.9° |
| C7 | C3 | N7 | HN7 | 0.8° | 0.4° |
| C4 | C11 | C6 | H11 | 180.0° | 179.9° |
| C4 | C11 | C6 | C10 | 0.1° | 0.0° |
| C4 | C11 | C6 | H6 | 179.9° | 179.9° |
| C7 | C10 | C6 | C11 | 0.3° | 0.1° |
| C7 | C10 | C6 | H10 | 180.0° | 180.0° |
| C7 | C10 | C6 | H6 | 179.7° | 180.0° |
| C23 | C22 | C17 | C26 | 180.0° | 179.9° |
| C23 | C22 | C26 | N2 | 5.8° | 180.0° |
| C23 | C22 | C26 | N1 | 172.9° | 0.1° |
| C23 | C22 | C17 | H17 | 177.2° | 179.9° |
| C22 | C23 | C24 | H24 | 178.9° | 180.0° |
| C17 | C22 | C26 | N2 | 174.2° | 0.0° |
| C17 | C22 | C26 | N1 | 7.1° | 180.0° |
| C22 | C17 | C16 | H16 | 179.7° | 180.0° |
| C17 | C22 | C23 | H23 | 176.8° | 180.0° |
| C11 | C6 | C10 | H6 | 180.0° | 179.9° |
| C11 | C6 | C10 | H10 | 179.6° | 179.9° |
| C22 | C26 | N2 | N1 | 178.8° | 180.0° |
| C22 | C26 | N1 | HN1 | 0.7° | 0.0° |
| C22 | C26 | N1 | HN1A | 179.3° | 180.0° |
| C22 | C26 | N2 | HN2 | 180.0° | 180.0° |
| C26 | C22 | C17 | H17 | 2.8° | 0.0° |
| C26 | C22 | C23 | H23 | 3.3° | 0.1° |
| C10 | C6 | C11 | H11 | 179.9° | 179.9° |
| C6 | C10 | C7 | H7 | 179.9° | 180.0° |
| N2 | C26 | N1 | HN1 | 179.5° | 180.0° |
| N2 | C26 | N1 | HN1A | 0.6° | 0.0° |
| C26 | N1 | HN1 | HN1A | 179.9° | 180.0° |
| N1 | C26 | N2 | HN2 | 1.2° | 0.0° |
| H5 | C5 | C1 | H1 | 68.0° | 65.0° |
| H5 | C5 | C1 | H1A | 170.8° | 175.0° |
| H5 | C5 | N4 | HN4 | 82.7° | 155.0° |
| H6 | C6 | C11 | H11 | 0.1° | 0.0° |
| H6 | C6 | C10 | H10 | 0.3° | 0.0° |
| H7 | C7 | C10 | H10 | 0.1° | 0.0° |
| H13 | C13 | N7 | HN7 | 0.2° | 0.4° |
| HN5 | N5 | C15 | H15 | 118.1° | 145.0° |
| H15 | C15 | C18 | H18 | 62.7° | 175.1° |
| H15 | C15 | C18 | H18A | 175.9° | 65.0° |
| H18 | C18 | C19 | H19 | 174.8° | 180.0° |
| H18 | C18 | C19 | H19A | 65.8° | 60.0° |
| H18A | C18 | C19 | H19 | 53.4° | 60.0° |
| H18A | C18 | C19 | H19A | 172.8° | 180.0° |
| HN6 | N6 | C21 | H21 | 41.3° | 120.0° |
| HN6 | N6 | C21 | H21A | 162.8° | 120.0° |
| H16 | C16 | C17 | H17 | 0.3° | 0.0° |
| H23 | C23 | C24 | H24 | 1.2° | 0.0° |
