J7W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C13 | sing | 1.51Å | 1.50Å | |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C8 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | N6 | sing | 1.40Å | 1.40Å | |
| C8 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| N4 | C4 | sing | 1.39Å | 1.33Å | |
| N6 | C6 | sing | 1.39Å | 1.35Å | |
| C4 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
| C4 | N2 | sing | 1.33Å | 1.34Å | Aromatic |
| C10 | C9 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | N7 | sing | 1.40Å | 1.41Å | |
| N5 | C6 | doub | 1.30Å | 1.30Å | Aromatic |
| N5 | C5 | sing | 1.33Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.41Å | Aromatic |
| N2 | C1 | doub | 1.33Å | 1.34Å | Aromatic |
| C6 | S1 | sing | 1.76Å | 1.72Å | Aromatic |
| C2 | N3 | sing | 1.39Å | 1.33Å | |
| C2 | N1 | doub | 1.33Å | 1.33Å | Aromatic |
| C1 | N1 | sing | 1.33Å | 1.34Å | Aromatic |
| C1 | C5 | sing | 1.48Å | 1.45Å | |
| C5 | C7 | doub | 1.35Å | 1.36Å | Aromatic |
| N7 | C15 | sing | 1.35Å | 1.35Å | |
| S1 | C7 | sing | 1.76Å | 1.72Å | Aromatic |
| C27 | N9 | sing | 1.47Å | 1.47Å | |
| C24 | N9 | sing | 1.47Å | 1.46Å | |
| C24 | C23 | sing | 1.53Å | 1.51Å | |
| N9 | C25 | sing | 1.47Å | 1.46Å | |
| C23 | N8 | sing | 1.47Å | 1.47Å | |
| C15 | C16 | sing | 1.48Å | 1.49Å | |
| C15 | O1 | doub | 1.22Å | 1.23Å | |
| C17 | C16 | doub | 1.40Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C21 | sing | 1.40Å | 1.39Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C26 | sing | 1.53Å | 1.51Å | |
| N8 | C26 | sing | 1.47Å | 1.46Å | |
| N8 | C22 | sing | 1.47Å | 1.47Å | |
| C19 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C22 | sing | 1.51Å | 1.51Å | |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| N3 | H2 | sing | 0.97Å | 1.00Å | |
| C7 | H3 | sing | 1.08Å | 1.08Å | |
| C17 | H4 | sing | 1.08Å | 1.08Å | |
| C20 | H5 | sing | 1.08Å | 1.08Å | |
| C21 | H6 | sing | 1.08Å | 1.08Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H13 | sing | 1.08Å | 1.08Å | |
| N4 | H14 | sing | 0.97Å | 1.00Å | |
| N4 | H15 | sing | 0.97Å | 1.00Å | |
| N6 | H16 | sing | 0.97Å | 1.00Å | |
| C9 | H17 | sing | 1.08Å | 1.08Å | |
| C11 | H18 | sing | 1.08Å | 1.08Å | |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| N7 | H23 | sing | 0.97Å | 1.00Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C27 | H32 | sing | 1.09Å | 1.10Å | |
| C27 | H33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | C13 | C12 | 120.3° | 120.0° |
| C14 | C13 | C8 | 121.5° | 119.9° |
| C13 | C14 | H20 | 109.5° | 109.5° |
| C13 | C14 | H21 | 109.5° | 109.5° |
| C13 | C14 | H22 | 109.5° | 109.5° |
| C13 | C12 | C11 | 121.3° | 120.1° |
| C12 | C13 | C8 | 118.1° | 120.1° |
| C13 | C12 | H19 | 119.4° | 120.0° |
| C12 | C11 | C10 | 120.0° | 120.1° |
| C12 | C11 | H18 | 120.0° | 119.9° |
| C11 | C12 | H19 | 119.4° | 119.9° |
| C13 | C8 | N6 | 117.7° | 120.0° |
| C13 | C8 | C9 | 121.3° | 119.9° |
| C11 | C10 | C9 | 120.1° | 119.9° |
| C11 | C10 | N7 | 114.6° | 120.1° |
| C10 | C11 | H18 | 120.0° | 120.0° |
| N6 | C8 | C9 | 121.0° | 120.0° |
| C8 | N6 | C6 | 128.1° | 120.0° |
| C8 | N6 | H16 | 115.9° | 120.0° |
| C8 | C9 | C10 | 119.2° | 119.8° |
| C8 | C9 | H17 | 120.4° | 120.1° |
| N4 | C4 | C3 | 121.1° | 120.4° |
| N4 | C4 | N2 | 117.4° | 120.4° |
| C4 | N4 | H14 | 109.5° | 120.0° |
| C4 | N4 | H15 | 109.5° | 120.0° |
| N6 | C6 | N5 | 123.9° | 125.3° |
| N6 | C6 | S1 | 120.9° | 125.2° |
| C6 | N6 | H16 | 116.0° | 120.0° |
| C3 | C4 | N2 | 121.4° | 119.1° |
| C4 | C3 | C2 | 116.3° | 118.5° |
| C4 | C3 | H13 | 121.8° | 120.8° |
| C4 | N2 | C1 | 118.4° | 120.8° |
| C9 | C10 | N7 | 125.2° | 120.0° |
| C10 | C9 | H17 | 120.4° | 120.1° |
| C10 | N7 | C15 | 128.9° | 120.0° |
| C10 | N7 | H23 | 115.5° | 120.0° |
| C6 | N5 | C5 | 110.7° | 116.9° |
| N5 | C6 | S1 | 115.2° | 109.5° |
| N5 | C5 | C1 | 119.5° | 122.3° |
| N5 | C5 | C7 | 114.3° | 115.2° |
| C3 | C2 | N3 | 122.6° | 120.5° |
| C3 | C2 | N1 | 121.4° | 119.1° |
| C2 | C3 | H13 | 121.9° | 120.7° |
| N2 | C1 | N1 | 123.8° | 121.7° |
| N2 | C1 | C5 | 120.1° | 119.1° |
| C6 | S1 | C7 | 89.1° | 90.1° |
| N3 | C2 | N1 | 116.0° | 120.4° |
| C2 | N3 | H1 | 109.5° | 120.1° |
| C2 | N3 | H2 | 109.4° | 120.0° |
| C2 | N1 | C1 | 118.7° | 120.8° |
| N1 | C1 | C5 | 116.1° | 119.2° |
| C1 | C5 | C7 | 126.2° | 122.4° |
| C5 | C7 | S1 | 110.6° | 108.3° |
| C5 | C7 | H3 | 124.7° | 125.9° |
| N7 | C15 | C16 | 113.9° | 120.0° |
| N7 | C15 | O1 | 124.3° | 120.0° |
| C15 | N7 | H23 | 115.6° | 120.1° |
| S1 | C7 | H3 | 124.7° | 125.9° |
| C27 | N9 | C24 | 111.1° | 111.0° |
| C27 | N9 | C25 | 111.3° | 110.9° |
| N9 | C27 | H31 | 109.5° | 109.4° |
| N9 | C27 | H32 | 109.4° | 109.5° |
| N9 | C27 | H33 | 109.4° | 109.4° |
| N9 | C24 | C23 | 110.6° | 109.3° |
| C24 | N9 | C25 | 109.2° | 110.9° |
| N9 | C24 | H9 | 109.2° | 109.5° |
| N9 | C24 | H10 | 109.2° | 109.5° |
| C24 | C23 | N8 | 110.6° | 109.3° |
| C23 | C24 | H9 | 109.2° | 109.5° |
| C23 | C24 | H10 | 109.2° | 109.5° |
| C24 | C23 | H26 | 109.2° | 109.4° |
| C24 | C23 | H27 | 109.2° | 109.5° |
| N9 | C25 | C26 | 111.3° | 109.3° |
| N9 | C25 | H29 | 109.0° | 109.5° |
| N9 | C25 | H30 | 109.0° | 109.5° |
| C23 | N8 | C26 | 108.6° | 110.9° |
| C23 | N8 | C22 | 113.0° | 110.9° |
| N8 | C23 | H26 | 109.2° | 109.5° |
| N8 | C23 | H27 | 109.2° | 109.5° |
| C16 | C15 | O1 | 121.8° | 120.0° |
| C15 | C16 | C17 | 120.5° | 120.1° |
| C15 | C16 | C21 | 120.2° | 120.2° |
| C16 | C17 | C18 | 120.0° | 119.8° |
| C17 | C16 | C21 | 119.4° | 119.7° |
| C16 | C17 | H4 | 120.0° | 120.1° |
| C17 | C18 | C19 | 120.8° | 120.1° |
| C18 | C17 | H4 | 120.0° | 120.0° |
| C17 | C18 | H24 | 119.6° | 119.9° |
| C16 | C21 | C20 | 120.5° | 119.9° |
| C16 | C21 | H6 | 119.7° | 120.1° |
| C18 | C19 | C20 | 118.6° | 120.3° |
| C18 | C19 | C22 | 120.8° | 119.8° |
| C19 | C18 | H24 | 119.6° | 120.0° |
| C21 | C20 | C19 | 120.6° | 120.2° |
| C21 | C20 | H5 | 119.7° | 119.9° |
| C20 | C21 | H6 | 119.7° | 120.1° |
| C25 | C26 | N8 | 110.4° | 109.3° |
| C25 | C26 | H11 | 109.2° | 109.5° |
| C25 | C26 | H12 | 109.3° | 109.5° |
| C26 | C25 | H29 | 109.0° | 109.4° |
| C26 | C25 | H30 | 109.0° | 109.4° |
| C26 | N8 | C22 | 111.4° | 111.0° |
| N8 | C26 | H11 | 109.2° | 109.4° |
| N8 | C26 | H12 | 109.2° | 109.5° |
| N8 | C22 | C19 | 114.4° | 109.5° |
| N8 | C22 | H7 | 108.2° | 109.5° |
| N8 | C22 | H8 | 108.2° | 109.5° |
| C20 | C19 | C22 | 120.6° | 119.9° |
| C19 | C20 | H5 | 119.7° | 119.9° |
| C19 | C22 | H7 | 108.2° | 109.5° |
| C19 | C22 | H8 | 108.2° | 109.5° |
| H1 | N3 | H2 | 109.5° | 119.9° |
| H7 | C22 | H8 | 109.5° | 109.4° |
| H9 | C24 | H10 | 109.5° | 109.5° |
| H11 | C26 | H12 | 109.5° | 109.5° |
| H14 | N4 | H15 | 109.5° | 120.0° |
| H20 | C14 | H21 | 109.4° | 109.4° |
| H20 | C14 | H22 | 109.5° | 109.5° |
| H21 | C14 | H22 | 109.5° | 109.5° |
| H26 | C23 | H27 | 109.5° | 109.5° |
| H29 | C25 | H30 | 109.5° | 109.6° |
| H31 | C27 | H32 | 109.5° | 109.5° |
| H31 | C27 | H33 | 109.5° | 109.5° |
| H32 | C27 | H33 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | C13 | C12 | C8 | 178.7° | 180.0° |
| C14 | C13 | C12 | C11 | 179.2° | 180.0° |
| C14 | C13 | C8 | N6 | 0.0° | 0.0° |
| C14 | C13 | C8 | C9 | 179.8° | 179.7° |
| C14 | C13 | C12 | H19 | 0.8° | 0.0° |
| C13 | C14 | H20 | H21 | 120.0° | 120.0° |
| C13 | C14 | H20 | H22 | 120.0° | 120.0° |
| C13 | C14 | H21 | H22 | 120.0° | 120.1° |
| C13 | C12 | C11 | H19 | 180.0° | 180.0° |
| C13 | C12 | C11 | C10 | 0.4° | 0.3° |
| C12 | C13 | C8 | N6 | 178.6° | 180.0° |
| C12 | C13 | C8 | C9 | 1.1° | 0.3° |
| C13 | C12 | C11 | H18 | 179.6° | 180.0° |
| C12 | C13 | C14 | H20 | 89.4° | 90.0° |
| C12 | C13 | C14 | H21 | 150.7° | 29.9° |
| C12 | C13 | C14 | H22 | 30.7° | 150.0° |
| C11 | C12 | C13 | C8 | 0.5° | 0.0° |
| C12 | C11 | C10 | H18 | 180.0° | 179.7° |
| C12 | C11 | C10 | C9 | 1.0° | 0.3° |
| C12 | C11 | C10 | N7 | 178.2° | 179.7° |
| C13 | C8 | N6 | C9 | 179.7° | 179.7° |
| C13 | C8 | N6 | C6 | 129.7° | 149.6° |
| C13 | C8 | C9 | C10 | 1.7° | 0.3° |
| C13 | C8 | N6 | H16 | 50.3° | 30.4° |
| C13 | C8 | C9 | H17 | 178.3° | 179.7° |
| C8 | C13 | C12 | H19 | 179.5° | 180.0° |
| C8 | C13 | C14 | H20 | 89.3° | 90.0° |
| C8 | C13 | C14 | H21 | 30.7° | 150.1° |
| C8 | C13 | C14 | H22 | 150.7° | 30.0° |
| C11 | C10 | C9 | C8 | 1.6° | 0.0° |
| C11 | C10 | C9 | N7 | 176.9° | 180.0° |
| C11 | C10 | N7 | C15 | 177.6° | 33.3° |
| C11 | C10 | C9 | H17 | 178.4° | 180.0° |
| C10 | C11 | C12 | H19 | 179.5° | 179.7° |
| C11 | C10 | N7 | H23 | 2.4° | 146.7° |
| C8 | N6 | C6 | H16 | 180.0° | 180.0° |
| N6 | C8 | C9 | C10 | 178.1° | 180.0° |
| C8 | N6 | C6 | N5 | 154.7° | 173.5° |
| C8 | N6 | C6 | S1 | 24.8° | 6.8° |
| N6 | C8 | C9 | H17 | 1.9° | 0.0° |
| C9 | C8 | N6 | C6 | 50.6° | 30.1° |
| C8 | C9 | C10 | H17 | 180.0° | 180.0° |
| C8 | C9 | C10 | N7 | 178.5° | 180.0° |
| C9 | C8 | N6 | H16 | 129.4° | 149.9° |
| N4 | C4 | C3 | N2 | 178.6° | 179.9° |
| N4 | C4 | C3 | C2 | 179.9° | 180.0° |
| N4 | C4 | N2 | C1 | 179.4° | 180.0° |
| N4 | C4 | C3 | H13 | 0.1° | 0.0° |
| C4 | N4 | H14 | H15 | 120.0° | 179.9° |
| N6 | C6 | N5 | S1 | 179.6° | 179.7° |
| N6 | C6 | N5 | C5 | 179.5° | 180.0° |
| N6 | C6 | S1 | C7 | 177.8° | 180.0° |
| C4 | C3 | C2 | H13 | 180.0° | 180.0° |
| C3 | C4 | N2 | C1 | 0.8° | 0.0° |
| C4 | C3 | C2 | N3 | 180.0° | 180.0° |
| C4 | C3 | C2 | N1 | 1.5° | 0.0° |
| C3 | C4 | N4 | H14 | 178.7° | 0.1° |
| C3 | C4 | N4 | H15 | 58.6° | 180.0° |
| N2 | C4 | C3 | C2 | 1.3° | 0.0° |
| C4 | N2 | C1 | N1 | 0.4° | 0.0° |
| C4 | N2 | C1 | C5 | 179.3° | 180.0° |
| N2 | C4 | C3 | H13 | 178.7° | 180.0° |
| N2 | C4 | N4 | H14 | 0.0° | 180.0° |
| N2 | C4 | N4 | H15 | 120.0° | 0.1° |
| C9 | C10 | N7 | C15 | 5.4° | 146.7° |
| C9 | C10 | C11 | H18 | 179.0° | 180.0° |
| C9 | C10 | N7 | H23 | 174.6° | 33.4° |
| C10 | N7 | C15 | H23 | 180.0° | 180.0° |
| C10 | N7 | C15 | C16 | 173.4° | 174.9° |
| C10 | N7 | C15 | O1 | 4.8° | 5.0° |
| N7 | C10 | C9 | H17 | 1.5° | 0.0° |
| N7 | C10 | C11 | H18 | 1.8° | 0.1° |
| C6 | N5 | C5 | C1 | 178.6° | 179.7° |
| C6 | N5 | C5 | C7 | 1.9° | 0.1° |
| N5 | C6 | S1 | C7 | 2.7° | 0.3° |
| N5 | C6 | N6 | H16 | 25.2° | 6.5° |
| N5 | C5 | C1 | N2 | 151.2° | 179.7° |
| C5 | N5 | C6 | S1 | 1.0° | 0.3° |
| N5 | C5 | C1 | N1 | 27.8° | 0.3° |
| N5 | C5 | C1 | C7 | 179.5° | 179.8° |
| N5 | C5 | C7 | S1 | 3.8° | 0.2° |
| N5 | C5 | C7 | H3 | 176.2° | 179.7° |
| C3 | C2 | N3 | N1 | 178.5° | 179.9° |
| C3 | C2 | N1 | C1 | 1.2° | 0.0° |
| C3 | C2 | N3 | H1 | 178.5° | 180.0° |
| C3 | C2 | N3 | H2 | 61.4° | 0.1° |
| N2 | C1 | N1 | C2 | 0.7° | 0.1° |
| N2 | C1 | N1 | C5 | 178.9° | 180.0° |
| N2 | C1 | C5 | C7 | 29.3° | 0.1° |
| C6 | S1 | C7 | C5 | 3.5° | 0.3° |
| C6 | S1 | C7 | H3 | 176.5° | 179.6° |
| S1 | C6 | N6 | H16 | 155.2° | 173.1° |
| N3 | C2 | N1 | C1 | 179.8° | 180.0° |
| C2 | N3 | H1 | H2 | 120.0° | 180.0° |
| N3 | C2 | C3 | H13 | 0.0° | 0.0° |
| C2 | N1 | C1 | C5 | 179.6° | 179.9° |
| N1 | C2 | N3 | H1 | 0.0° | 0.1° |
| N1 | C2 | N3 | H2 | 120.0° | 180.0° |
| N1 | C2 | C3 | H13 | 178.5° | 180.0° |
| N1 | C1 | C5 | C7 | 151.7° | 179.9° |
| C1 | C5 | C7 | S1 | 176.7° | 180.0° |
| C1 | C5 | C7 | H3 | 3.3° | 0.1° |
| C5 | C7 | S1 | H3 | 180.0° | 179.9° |
| N7 | C15 | C16 | O1 | 178.2° | 179.9° |
| N7 | C15 | C16 | C17 | 38.9° | 180.0° |
| N7 | C15 | C16 | C21 | 141.5° | 0.1° |
| C27 | N9 | C24 | C25 | 123.2° | 123.8° |
| C27 | N9 | C24 | C23 | 179.3° | 176.8° |
| C27 | N9 | C25 | C26 | 179.7° | 176.8° |
| C27 | N9 | C24 | H9 | 60.5° | 56.9° |
| C27 | N9 | C24 | H10 | 59.1° | 63.2° |
| C27 | N9 | C25 | H29 | 59.4° | 63.3° |
| C27 | N9 | C25 | H30 | 60.0° | 56.9° |
| N9 | C27 | H31 | H32 | 120.0° | 120.0° |
| N9 | C27 | H31 | H33 | 120.0° | 119.9° |
| N9 | C27 | H32 | H33 | 120.0° | 120.0° |
| N9 | C24 | C23 | H9 | 120.2° | 119.9° |
| N9 | C24 | C23 | H10 | 120.2° | 120.0° |
| N9 | C24 | C23 | N8 | 59.7° | 58.4° |
| C24 | N9 | C25 | C26 | 57.2° | 59.4° |
| N9 | C24 | H9 | H10 | 119.5° | 120.1° |
| N9 | C24 | C23 | H26 | 179.9° | 178.4° |
| N9 | C24 | C23 | H27 | 60.5° | 61.6° |
| C24 | N9 | C25 | H29 | 177.5° | 60.6° |
| C24 | N9 | C25 | H30 | 63.1° | 179.3° |
| C24 | N9 | C27 | H31 | 180.0° | 60.0° |
| C24 | N9 | C27 | H32 | 60.0° | 180.0° |
| C24 | N9 | C27 | H33 | 60.0° | 60.0° |
| C23 | C24 | N9 | C25 | 57.5° | 59.4° |
| C24 | C23 | N8 | H26 | 120.2° | 119.9° |
| C24 | C23 | N8 | H27 | 120.2° | 120.0° |
| C24 | C23 | N8 | C26 | 59.1° | 59.4° |
| C24 | C23 | N8 | C22 | 176.8° | 176.8° |
| C23 | C24 | H9 | H10 | 119.5° | 120.1° |
| C24 | C23 | H26 | H27 | 119.5° | 120.0° |
| N9 | C25 | C26 | H29 | 120.3° | 120.0° |
| N9 | C25 | C26 | H30 | 120.3° | 119.9° |
| N9 | C25 | C26 | N8 | 58.4° | 58.4° |
| C25 | N9 | C24 | H9 | 62.7° | 179.3° |
| C25 | N9 | C24 | H10 | 177.7° | 60.6° |
| N9 | C25 | C26 | H11 | 61.7° | 178.3° |
| N9 | C25 | C26 | H12 | 178.5° | 61.6° |
| N9 | C25 | H29 | H30 | 119.1° | 120.1° |
| C25 | N9 | C27 | H31 | 58.0° | 63.8° |
| C25 | N9 | C27 | H32 | 178.0° | 56.2° |
| C25 | N9 | C27 | H33 | 62.0° | 176.2° |
| C23 | N8 | C26 | C25 | 58.2° | 59.4° |
| C23 | N8 | C26 | C22 | 125.0° | 123.8° |
| C23 | N8 | C22 | C19 | 42.0° | 66.2° |
| C23 | N8 | C22 | H7 | 78.7° | 173.8° |
| C23 | N8 | C22 | H8 | 162.8° | 53.8° |
| N8 | C23 | C24 | H9 | 60.5° | 178.4° |
| N8 | C23 | C24 | H10 | 179.8° | 61.6° |
| C23 | N8 | C26 | H11 | 61.9° | 179.3° |
| C23 | N8 | C26 | H12 | 178.3° | 60.6° |
| N8 | C23 | H26 | H27 | 119.5° | 120.1° |
| C15 | C16 | C17 | C21 | 179.5° | 179.9° |
| C15 | C16 | C17 | C18 | 178.5° | 180.0° |
| C15 | C16 | C21 | C20 | 178.7° | 180.0° |
| C15 | C16 | C17 | H4 | 1.5° | 0.2° |
| C15 | C16 | C21 | H6 | 1.3° | 0.1° |
| C16 | C15 | N7 | H23 | 6.6° | 5.1° |
| O1 | C15 | C16 | C17 | 139.3° | 0.1° |
| O1 | C15 | C16 | C21 | 40.3° | 180.0° |
| O1 | C15 | N7 | H23 | 175.2° | 175.0° |
| C16 | C17 | C18 | H4 | 180.0° | 179.8° |
| C16 | C17 | C18 | C19 | 1.0° | 0.0° |
| C17 | C16 | C21 | C20 | 0.8° | 0.1° |
| C17 | C16 | C21 | H6 | 179.2° | 180.0° |
| C16 | C17 | C18 | H24 | 179.0° | 180.0° |
| C18 | C17 | C16 | C21 | 1.0° | 0.0° |
| C17 | C18 | C19 | H24 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.7° | 0.0° |
| C17 | C18 | C19 | C22 | 178.7° | 179.9° |
| C16 | C21 | C20 | H6 | 180.0° | 179.9° |
| C16 | C21 | C20 | C19 | 0.6° | 0.1° |
| C21 | C16 | C17 | H4 | 179.0° | 179.7° |
| C16 | C21 | C20 | H5 | 179.4° | 180.0° |
| C18 | C19 | C20 | C21 | 0.5° | 0.1° |
| C18 | C19 | C22 | N8 | 128.9° | 90.0° |
| C18 | C19 | C20 | C22 | 179.4° | 180.0° |
| C19 | C18 | C17 | H4 | 179.0° | 179.8° |
| C18 | C19 | C20 | H5 | 179.5° | 180.0° |
| C18 | C19 | C22 | H7 | 8.1° | 150.0° |
| C18 | C19 | C22 | H8 | 110.4° | 30.0° |
| C21 | C20 | C19 | H5 | 180.0° | 179.9° |
| C21 | C20 | C19 | C22 | 178.9° | 179.9° |
| C25 | C26 | N8 | H11 | 120.1° | 119.9° |
| C25 | C26 | N8 | H12 | 120.2° | 120.0° |
| C25 | C26 | N8 | C22 | 176.8° | 176.8° |
| C25 | C26 | H11 | H12 | 119.6° | 120.1° |
| C26 | C25 | H29 | H30 | 119.1° | 120.0° |
| C26 | N8 | C22 | C19 | 164.6° | 170.0° |
| C26 | N8 | C22 | H7 | 43.9° | 50.0° |
| C26 | N8 | C22 | H8 | 74.7° | 69.9° |
| N8 | C26 | H11 | H12 | 119.6° | 120.1° |
| C26 | N8 | C23 | H26 | 179.2° | 179.3° |
| C26 | N8 | C23 | H27 | 61.1° | 60.6° |
| N8 | C26 | C25 | H29 | 178.7° | 61.6° |
| N8 | C26 | C25 | H30 | 61.9° | 178.4° |
| N8 | C22 | C19 | C20 | 50.5° | 90.0° |
| N8 | C22 | C19 | H7 | 120.7° | 120.0° |
| N8 | C22 | C19 | H8 | 120.7° | 120.1° |
| N8 | C22 | H7 | H8 | 117.7° | 120.0° |
| C22 | N8 | C26 | H11 | 63.1° | 56.9° |
| C22 | N8 | C26 | H12 | 56.6° | 63.2° |
| C22 | N8 | C23 | H26 | 56.7° | 56.9° |
| C22 | N8 | C23 | H27 | 63.0° | 63.2° |
| C19 | C20 | C21 | H6 | 179.4° | 180.0° |
| C20 | C19 | C22 | H7 | 171.3° | 30.0° |
| C20 | C19 | C22 | H8 | 70.2° | 149.9° |
| C20 | C19 | C18 | H24 | 179.3° | 180.0° |
| C22 | C19 | C20 | H5 | 1.1° | 0.0° |
| C19 | C22 | H7 | H8 | 117.8° | 120.0° |
| C22 | C19 | C18 | H24 | 1.3° | 0.0° |
| H4 | C17 | C18 | H24 | 1.0° | 0.2° |
| H5 | C20 | C21 | H6 | 0.6° | 0.1° |
| H9 | C24 | C23 | H26 | 59.7° | 61.7° |
| H9 | C24 | C23 | H27 | 179.3° | 58.4° |
| H10 | C24 | C23 | H26 | 60.0° | 58.4° |
| H10 | C24 | C23 | H27 | 59.6° | 178.4° |
| H11 | C26 | C25 | H29 | 58.6° | 58.3° |
| H11 | C26 | C25 | H30 | 178.0° | 61.8° |
| H12 | C26 | C25 | H29 | 61.2° | 178.5° |
| H12 | C26 | C25 | H30 | 58.3° | 58.4° |
| H18 | C11 | C12 | H19 | 0.5° | 0.0° |
| H20 | C14 | H21 | H22 | 120.0° | 120.0° |
| H31 | C27 | H32 | H33 | 120.0° | 120.0° |
