A1A1B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C13 | C12 | sing | 1.39Å | 1.38Å | Aromatic |
| C10 | C11 | doub | 1.39Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.39Å | 1.38Å | Aromatic |
| C5 | C1 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.40Å | 1.39Å | Aromatic |
| C4 | C8 | sing | 1.48Å | 1.48Å | |
| C3 | C2 | doub | 1.37Å | 1.37Å | Aromatic |
| C3 | C7 | sing | 1.51Å | 1.49Å | |
| C12 | C14 | sing | 1.48Å | 1.45Å | |
| C12 | N5 | doub | 1.33Å | 1.34Å | Aromatic |
| C2 | C6 | sing | 1.51Å | 1.50Å | |
| C2 | N1 | sing | 1.32Å | 1.36Å | Aromatic |
| C11 | N5 | sing | 1.32Å | 1.35Å | Aromatic |
| C11 | N3 | sing | 1.39Å | 1.40Å | |
| C1 | N1 | doub | 1.32Å | 1.37Å | Aromatic |
| C1 | N2 | sing | 1.39Å | 1.39Å | |
| C14 | N4 | doub | 1.31Å | 1.33Å | Aromatic |
| C14 | N6 | sing | 1.37Å | 1.35Å | Aromatic |
| C15 | C25 | sing | 1.51Å | 1.47Å | |
| C15 | N7 | doub | 1.31Å | 1.30Å | Aromatic |
| C15 | N6 | sing | 1.35Å | 1.36Å | Aromatic |
| C8 | N3 | sing | 1.35Å | 1.41Å | |
| C8 | O1 | doub | 1.21Å | 1.22Å | |
| C7 | N3 | sing | 1.47Å | 1.46Å | |
| C25 | C24 | sing | 1.55Å | 1.56Å | |
| C24 | C23 | sing | 1.55Å | 1.56Å | |
| C19 | C18 | sing | 1.55Å | 1.52Å | |
| C19 | C20 | sing | 1.55Å | 1.54Å | |
| C18 | C17 | sing | 1.54Å | 1.55Å | |
| C20 | N2 | sing | 1.49Å | 1.47Å | |
| C23 | C26 | sing | 1.53Å | 1.51Å | |
| C23 | N6 | sing | 1.47Å | 1.46Å | |
| C17 | C21 | sing | 1.53Å | 1.50Å | |
| C17 | N2 | sing | 1.48Å | 1.47Å | |
| C22 | C16 | sing | 1.53Å | 1.50Å | |
| C16 | C6 | sing | 1.53Å | 1.50Å | |
| C6 | N8 | sing | 1.47Å | 1.48Å | |
| N4 | N7 | sing | 1.28Å | 1.39Å | Aromatic |
| C9 | H5 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | H6 | sing | 1.08Å | 1.08Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.09Å | 1.10Å | |
| C24 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| C26 | H31 | sing | 1.09Å | 1.10Å | |
| C26 | H32 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H2 | sing | 1.09Å | 1.10Å | |
| N8 | H69 | sing | 1.01Å | 1.00Å | |
| N8 | H9 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C9 | C10 | 120.7° | 118.6° |
| C9 | C13 | C12 | 117.6° | 119.2° |
| C13 | C9 | H5 | 119.7° | 120.7° |
| C9 | C13 | H7 | 121.2° | 120.3° |
| C9 | C10 | C11 | 117.4° | 119.3° |
| C10 | C9 | H5 | 119.7° | 120.7° |
| C9 | C10 | H6 | 121.3° | 120.3° |
| C13 | C12 | C14 | 123.7° | 119.7° |
| C13 | C12 | N5 | 122.8° | 120.7° |
| C12 | C13 | H7 | 121.2° | 120.5° |
| C10 | C11 | N5 | 122.4° | 120.8° |
| C10 | C11 | N3 | 124.0° | 119.6° |
| C11 | C10 | H6 | 121.3° | 120.4° |
| C4 | C5 | C1 | 116.7° | 118.7° |
| C5 | C4 | C3 | 121.0° | 118.2° |
| C5 | C4 | C8 | 130.7° | 133.4° |
| C4 | C5 | H1 | 121.7° | 120.7° |
| C5 | C1 | N1 | 123.1° | 120.9° |
| C5 | C1 | N2 | 121.0° | 119.6° |
| C1 | C5 | H1 | 121.6° | 120.6° |
| C3 | C4 | C8 | 108.3° | 108.4° |
| C4 | C3 | C2 | 119.6° | 119.7° |
| C4 | C3 | C7 | 109.8° | 106.3° |
| C4 | C8 | N3 | 107.2° | 110.2° |
| C4 | C8 | O1 | 123.8° | 124.9° |
| C2 | C3 | C7 | 130.6° | 134.0° |
| C3 | C2 | C6 | 122.8° | 119.7° |
| C3 | C2 | N1 | 121.0° | 120.6° |
| C3 | C7 | N3 | 104.3° | 106.4° |
| C3 | C7 | H4 | 110.7° | 110.1° |
| C3 | C7 | H3 | 110.8° | 110.1° |
| C14 | C12 | N5 | 113.3° | 119.7° |
| C12 | C14 | N4 | 124.5° | 126.6° |
| C12 | C14 | N6 | 127.2° | 126.6° |
| C12 | N5 | C11 | 119.0° | 121.5° |
| C6 | C2 | N1 | 116.2° | 119.7° |
| C2 | C6 | C16 | 111.9° | 109.5° |
| C2 | C6 | N8 | 111.8° | 109.4° |
| C2 | C6 | H2 | 109.6° | 109.5° |
| C2 | N1 | C1 | 118.6° | 122.0° |
| N5 | C11 | N3 | 113.6° | 119.6° |
| C11 | N3 | C8 | 128.9° | 125.6° |
| C11 | N3 | C7 | 120.7° | 125.6° |
| N1 | C1 | N2 | 115.9° | 119.5° |
| C1 | N2 | C20 | 125.1° | 111.0° |
| C1 | N2 | C17 | 124.8° | 111.0° |
| N4 | C14 | N6 | 108.3° | 106.9° |
| C14 | N4 | N7 | 107.8° | 109.6° |
| C14 | N6 | C15 | 107.2° | 106.0° |
| C14 | N6 | C23 | 140.5° | 142.8° |
| C25 | C15 | N7 | 138.2° | 142.6° |
| C25 | C15 | N6 | 112.3° | 109.9° |
| C15 | C25 | C24 | 100.6° | 104.3° |
| C15 | C25 | H29 | 111.6° | 110.4° |
| C15 | C25 | H28 | 111.6° | 110.5° |
| N7 | C15 | N6 | 109.6° | 107.5° |
| C15 | N7 | N4 | 107.1° | 110.0° |
| C15 | N6 | C23 | 112.2° | 111.2° |
| N3 | C8 | O1 | 129.0° | 124.9° |
| C8 | N3 | C7 | 110.0° | 108.8° |
| N3 | C7 | H4 | 110.8° | 110.0° |
| N3 | C7 | H3 | 110.8° | 110.1° |
| C25 | C24 | C23 | 104.7° | 101.6° |
| C24 | C25 | H29 | 111.6° | 110.5° |
| C24 | C25 | H28 | 111.6° | 110.5° |
| C25 | C24 | H27 | 110.6° | 111.0° |
| C25 | C24 | H26 | 110.6° | 110.9° |
| C24 | C23 | C26 | 110.7° | 110.2° |
| C24 | C23 | N6 | 101.1° | 105.4° |
| C23 | C24 | H27 | 110.6° | 111.4° |
| C23 | C24 | H26 | 110.7° | 110.7° |
| C24 | C23 | H25 | 110.6° | 110.2° |
| C18 | C19 | C20 | 107.5° | 102.9° |
| C19 | C18 | C17 | 105.8° | 105.1° |
| C18 | C19 | H16 | 110.0° | 110.7° |
| C18 | C19 | H15 | 109.9° | 110.7° |
| C19 | C18 | H14 | 110.4° | 110.3° |
| C19 | C18 | H13 | 110.4° | 110.3° |
| C19 | C20 | N2 | 105.0° | 103.2° |
| C20 | C19 | H16 | 110.0° | 110.7° |
| C20 | C19 | H15 | 110.0° | 110.8° |
| C19 | C20 | H18 | 110.6° | 110.7° |
| C19 | C20 | H17 | 110.6° | 110.7° |
| C18 | C17 | C21 | 109.1° | 109.9° |
| C18 | C17 | N2 | 106.5° | 107.1° |
| C17 | C18 | H14 | 110.4° | 110.3° |
| C17 | C18 | H13 | 110.3° | 110.3° |
| C18 | C17 | H12 | 110.1° | 110.0° |
| C20 | N2 | C17 | 110.1° | 105.8° |
| N2 | C20 | H18 | 110.6° | 110.7° |
| N2 | C20 | H17 | 110.6° | 110.7° |
| C26 | C23 | N6 | 110.9° | 109.9° |
| C26 | C23 | H25 | 111.2° | 110.2° |
| C23 | C26 | H30 | 109.5° | 109.4° |
| C23 | C26 | H31 | 109.5° | 109.5° |
| C23 | C26 | H32 | 109.5° | 109.5° |
| N6 | C23 | H25 | 112.0° | 110.8° |
| C21 | C17 | N2 | 109.1° | 109.9° |
| C21 | C17 | H12 | 110.7° | 109.9° |
| C17 | C21 | H19 | 109.5° | 109.5° |
| C17 | C21 | H20 | 109.5° | 109.5° |
| C17 | C21 | H21 | 109.5° | 109.5° |
| N2 | C17 | H12 | 111.2° | 110.1° |
| C22 | C16 | C6 | 113.3° | 109.5° |
| C16 | C22 | H24 | 109.5° | 109.4° |
| C16 | C22 | H22 | 109.5° | 109.5° |
| C16 | C22 | H23 | 109.5° | 109.5° |
| C22 | C16 | H11 | 108.5° | 109.5° |
| C22 | C16 | H10 | 108.5° | 109.4° |
| C16 | C6 | N8 | 104.0° | 109.4° |
| C6 | C16 | H11 | 108.5° | 109.5° |
| C6 | C16 | H10 | 108.5° | 109.4° |
| C16 | C6 | H2 | 109.6° | 109.5° |
| N8 | C6 | H2 | 109.9° | 109.5° |
| C6 | N8 | H69 | 109.5° | 111.0° |
| C6 | N8 | H9 | 109.4° | 111.0° |
| H4 | C7 | H3 | 109.5° | 110.1° |
| H29 | C25 | H28 | 109.5° | 110.5° |
| H27 | C24 | H26 | 109.5° | 110.9° |
| H16 | C19 | H15 | 109.4° | 110.8° |
| H14 | C18 | H13 | 109.5° | 110.4° |
| H18 | C20 | H17 | 109.5° | 110.7° |
| H30 | C26 | H31 | 109.4° | 109.5° |
| H30 | C26 | H32 | 109.5° | 109.4° |
| H31 | C26 | H32 | 109.5° | 109.5° |
| H19 | C21 | H20 | 109.5° | 109.5° |
| H19 | C21 | H21 | 109.5° | 109.5° |
| H20 | C21 | H21 | 109.4° | 109.4° |
| H24 | C22 | H22 | 109.5° | 109.5° |
| H24 | C22 | H23 | 109.5° | 109.5° |
| H22 | C22 | H23 | 109.4° | 109.5° |
| H11 | C16 | H10 | 109.5° | 109.5° |
| H69 | N8 | H9 | 109.4° | 111.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C9 | C10 | H5 | 180.0° | 179.7° |
| C9 | C13 | C12 | H7 | 180.0° | 179.9° |
| C13 | C9 | C10 | C11 | 0.9° | 0.0° |
| C9 | C13 | C12 | C14 | 176.2° | 180.0° |
| C9 | C13 | C12 | N5 | 0.6° | 0.1° |
| C13 | C9 | C10 | H6 | 179.1° | 180.0° |
| C10 | C9 | C13 | C12 | 0.0° | 0.0° |
| C9 | C10 | C11 | H6 | 180.0° | 180.0° |
| C9 | C10 | C11 | N5 | 2.5° | 0.0° |
| C9 | C10 | C11 | N3 | 179.3° | 180.0° |
| C10 | C9 | C13 | H7 | 179.9° | 179.9° |
| C13 | C12 | C14 | N5 | 176.0° | 179.9° |
| C13 | C12 | N5 | C11 | 2.1° | 0.1° |
| C13 | C12 | C14 | N4 | 8.6° | 0.0° |
| C13 | C12 | C14 | N6 | 174.3° | 179.7° |
| C12 | C13 | C9 | H5 | 180.0° | 179.7° |
| C10 | C11 | N5 | C12 | 3.1° | 0.1° |
| C10 | C11 | N5 | N3 | 178.4° | 179.9° |
| C10 | C11 | N3 | C8 | 1.7° | 5.1° |
| C10 | C11 | N3 | C7 | 173.3° | 175.0° |
| C11 | C10 | C9 | H5 | 179.1° | 179.7° |
| C4 | C5 | C1 | H1 | 180.0° | 179.7° |
| C5 | C4 | C3 | C8 | 179.9° | 179.9° |
| C5 | C4 | C3 | C2 | 0.2° | 0.0° |
| C5 | C4 | C3 | C7 | 179.9° | 179.9° |
| C4 | C5 | C1 | N1 | 0.1° | 0.0° |
| C4 | C5 | C1 | N2 | 179.4° | 179.9° |
| C5 | C4 | C8 | N3 | 176.2° | 180.0° |
| C5 | C4 | C8 | O1 | 5.0° | 0.0° |
| C1 | C5 | C4 | C3 | 0.0° | 0.0° |
| C1 | C5 | C4 | C8 | 179.8° | 179.9° |
| C5 | C1 | N1 | C2 | 0.1° | 0.0° |
| C5 | C1 | N1 | N2 | 179.6° | 179.9° |
| C5 | C1 | N2 | C20 | 0.1° | 59.9° |
| C5 | C1 | N2 | C17 | 179.3° | 57.5° |
| C4 | C3 | C2 | C7 | 179.9° | 180.0° |
| C4 | C3 | C2 | C6 | 180.0° | 179.9° |
| C4 | C3 | C2 | N1 | 0.4° | 0.0° |
| C3 | C4 | C8 | N3 | 4.0° | 0.0° |
| C3 | C4 | C8 | O1 | 174.9° | 180.0° |
| C4 | C3 | C7 | N3 | 3.8° | 0.0° |
| C3 | C4 | C5 | H1 | 180.0° | 179.7° |
| C4 | C3 | C7 | H4 | 123.0° | 119.2° |
| C4 | C3 | C7 | H3 | 115.4° | 119.3° |
| C8 | C4 | C3 | C2 | 179.9° | 180.0° |
| C8 | C4 | C3 | C7 | 0.0° | 0.0° |
| C4 | C8 | N3 | C11 | 178.9° | 180.0° |
| C4 | C8 | N3 | O1 | 178.8° | 180.0° |
| C4 | C8 | N3 | C7 | 6.5° | 0.1° |
| C8 | C4 | C5 | H1 | 0.2° | 0.4° |
| C3 | C2 | C6 | N1 | 179.7° | 179.9° |
| C3 | C2 | N1 | C1 | 0.3° | 0.1° |
| C2 | C3 | C7 | N3 | 176.1° | 180.0° |
| C3 | C2 | C6 | C16 | 96.9° | 105.0° |
| C3 | C2 | C6 | N8 | 146.9° | 135.0° |
| C2 | C3 | C7 | H4 | 56.9° | 60.8° |
| C2 | C3 | C7 | H3 | 64.7° | 60.7° |
| C3 | C2 | C6 | H2 | 24.8° | 15.1° |
| C7 | C3 | C2 | C6 | 0.1° | 0.1° |
| C7 | C3 | C2 | N1 | 179.7° | 180.0° |
| C3 | C7 | N3 | C11 | 179.4° | 180.0° |
| C3 | C7 | N3 | C8 | 6.4° | 0.0° |
| C3 | C7 | N3 | H4 | 119.2° | 119.2° |
| C3 | C7 | N3 | H3 | 119.2° | 119.3° |
| C3 | C7 | H4 | H3 | 122.4° | 121.6° |
| C14 | C12 | N5 | C11 | 178.1° | 180.0° |
| C12 | C14 | N4 | N6 | 177.6° | 179.8° |
| C12 | C14 | N6 | C15 | 177.7° | 179.7° |
| C12 | C14 | N6 | C23 | 3.9° | 0.3° |
| C12 | C14 | N4 | N7 | 177.9° | 180.0° |
| C14 | C12 | C13 | H7 | 3.8° | 0.1° |
| C12 | N5 | C11 | N3 | 178.5° | 180.0° |
| N5 | C12 | C14 | N4 | 167.4° | 180.0° |
| N5 | C12 | C14 | N6 | 9.7° | 0.2° |
| N5 | C12 | C13 | H7 | 179.4° | 180.0° |
| C6 | C2 | N1 | C1 | 180.0° | 180.0° |
| C2 | C6 | C16 | C22 | 74.7° | 175.0° |
| C2 | C6 | C16 | N8 | 120.8° | 119.9° |
| C2 | C6 | C16 | H2 | 121.8° | 120.1° |
| C2 | C6 | N8 | H2 | 121.9° | 120.0° |
| C2 | C6 | C16 | H11 | 164.7° | 64.9° |
| C2 | C6 | C16 | H10 | 45.8° | 55.1° |
| C2 | C6 | N8 | H69 | 180.0° | 60.0° |
| C2 | C6 | N8 | H9 | 60.0° | 64.0° |
| C2 | N1 | C1 | N2 | 179.6° | 180.0° |
| N1 | C2 | C6 | C16 | 83.4° | 74.9° |
| N1 | C2 | C6 | N8 | 32.7° | 45.0° |
| N1 | C2 | C6 | H2 | 154.8° | 165.0° |
| N5 | C11 | N3 | C8 | 180.0° | 175.0° |
| N5 | C11 | N3 | C7 | 8.3° | 4.9° |
| N5 | C11 | C10 | H6 | 177.5° | 180.0° |
| C11 | N3 | C8 | C7 | 172.4° | 179.9° |
| C11 | N3 | C8 | O1 | 0.1° | 0.0° |
| N3 | C11 | C10 | H6 | 0.7° | 0.0° |
| C11 | N3 | C7 | H4 | 61.4° | 60.8° |
| C11 | N3 | C7 | H3 | 60.3° | 60.7° |
| N1 | C1 | N2 | C20 | 179.5° | 120.2° |
| N1 | C1 | N2 | C17 | 0.2° | 122.5° |
| N1 | C1 | C5 | H1 | 179.9° | 179.7° |
| C1 | N2 | C20 | C19 | 157.3° | 159.7° |
| C1 | N2 | C17 | C18 | 162.2° | 145.8° |
| C1 | N2 | C20 | C17 | 179.3° | 120.5° |
| C1 | N2 | C17 | C21 | 80.1° | 94.8° |
| N2 | C1 | C5 | H1 | 0.6° | 0.3° |
| C1 | N2 | C20 | H18 | 83.4° | 81.9° |
| C1 | N2 | C20 | H17 | 38.0° | 41.3° |
| C1 | N2 | C17 | H12 | 42.2° | 26.3° |
| C14 | N4 | N7 | C15 | 0.3° | 0.1° |
| N4 | C14 | N6 | C15 | 0.2° | 0.5° |
| N4 | C14 | N6 | C23 | 178.6° | 179.5° |
| C14 | N6 | C15 | C25 | 179.9° | 179.6° |
| C14 | N6 | C15 | N7 | 0.0° | 0.5° |
| C14 | N6 | C15 | C23 | 178.9° | 180.0° |
| C14 | N6 | C23 | C24 | 162.4° | 162.6° |
| C14 | N6 | C23 | C26 | 80.1° | 43.9° |
| N6 | C14 | N4 | N7 | 0.3° | 0.2° |
| C14 | N6 | C23 | H25 | 44.7° | 78.1° |
| C25 | C15 | N7 | N6 | 179.9° | 179.8° |
| C15 | C25 | C24 | H29 | 118.5° | 118.7° |
| C15 | C25 | C24 | H28 | 118.5° | 118.7° |
| C15 | C25 | C24 | C23 | 28.2° | 25.5° |
| C25 | C15 | N6 | C23 | 1.0° | 0.4° |
| C25 | C15 | N7 | N4 | 179.9° | 179.8° |
| C15 | C25 | H29 | H28 | 124.2° | 122.5° |
| C15 | C25 | C24 | H27 | 147.4° | 93.1° |
| C15 | C25 | C24 | H26 | 91.1° | 143.2° |
| N7 | C15 | C25 | C24 | 162.5° | 163.5° |
| N7 | C15 | N6 | C23 | 178.9° | 179.4° |
| N7 | C15 | C25 | H29 | 78.9° | 44.8° |
| N7 | C15 | C25 | H28 | 44.0° | 77.8° |
| N6 | C15 | C25 | C24 | 17.5° | 16.7° |
| C15 | N6 | C23 | C24 | 19.2° | 17.5° |
| C15 | N6 | C23 | C26 | 98.3° | 136.2° |
| N6 | C15 | N7 | N4 | 0.2° | 0.4° |
| N6 | C15 | C25 | H29 | 101.0° | 135.4° |
| N6 | C15 | C25 | H28 | 136.1° | 102.0° |
| C15 | N6 | C23 | H25 | 136.9° | 101.8° |
| C8 | N3 | C7 | H4 | 125.5° | 119.2° |
| C8 | N3 | C7 | H3 | 112.8° | 119.2° |
| O1 | C8 | N3 | C7 | 172.3° | 179.9° |
| N3 | C7 | H4 | H3 | 122.4° | 121.5° |
| C25 | C24 | C23 | H27 | 119.2° | 118.2° |
| C25 | C24 | C23 | H26 | 119.3° | 117.9° |
| C25 | C24 | C23 | C26 | 88.7° | 144.6° |
| C25 | C24 | C23 | N6 | 28.9° | 26.1° |
| C24 | C25 | H29 | H28 | 124.2° | 122.6° |
| C25 | C24 | H27 | H26 | 122.2° | 123.8° |
| C25 | C24 | C23 | H25 | 147.6° | 93.5° |
| C24 | C23 | C26 | N6 | 111.4° | 115.8° |
| C24 | C23 | C26 | H25 | 123.4° | 121.9° |
| C24 | C23 | N6 | H25 | 117.7° | 119.3° |
| C23 | C24 | C25 | H29 | 90.3° | 144.2° |
| C23 | C24 | C25 | H28 | 146.7° | 93.2° |
| C23 | C24 | H27 | H26 | 122.2° | 123.8° |
| C24 | C23 | C26 | H30 | 180.0° | 61.4° |
| C24 | C23 | C26 | H31 | 60.0° | 178.6° |
| C24 | C23 | C26 | H32 | 60.0° | 58.5° |
| C18 | C19 | C20 | H16 | 119.7° | 118.4° |
| C18 | C19 | C20 | H15 | 119.7° | 118.4° |
| C19 | C18 | C17 | H14 | 119.5° | 118.9° |
| C19 | C18 | C17 | H13 | 119.4° | 118.9° |
| C18 | C19 | C20 | N2 | 19.1° | 37.4° |
| C19 | C18 | C17 | C21 | 111.9° | 120.6° |
| C19 | C18 | C17 | N2 | 5.7° | 1.3° |
| C18 | C19 | H16 | H15 | 120.9° | 123.2° |
| C19 | C18 | H14 | H13 | 121.7° | 122.2° |
| C18 | C19 | C20 | H18 | 100.2° | 155.8° |
| C18 | C19 | C20 | H17 | 138.4° | 81.0° |
| C19 | C18 | C17 | H12 | 126.4° | 118.3° |
| C20 | C19 | C18 | C17 | 8.2° | 21.9° |
| C19 | C20 | N2 | H18 | 119.3° | 118.4° |
| C19 | C20 | N2 | H17 | 119.3° | 118.4° |
| C19 | C20 | N2 | C17 | 23.4° | 39.2° |
| C20 | C19 | H16 | H15 | 120.9° | 123.3° |
| C20 | C19 | C18 | H14 | 127.7° | 96.9° |
| C20 | C19 | C18 | H13 | 111.2° | 140.8° |
| C19 | C20 | H18 | H17 | 122.1° | 123.1° |
| C18 | C17 | N2 | C20 | 18.5° | 25.4° |
| C18 | C17 | C21 | N2 | 116.0° | 117.6° |
| C18 | C17 | C21 | H12 | 121.4° | 121.1° |
| C18 | C17 | N2 | H12 | 120.0° | 119.5° |
| C17 | C18 | C19 | H16 | 128.0° | 96.4° |
| C17 | C18 | C19 | H15 | 111.5° | 140.3° |
| C17 | C18 | H14 | H13 | 121.6° | 122.1° |
| C18 | C17 | C21 | H19 | 180.0° | 58.5° |
| C18 | C17 | C21 | H20 | 60.0° | 178.6° |
| C18 | C17 | C21 | H21 | 60.0° | 61.5° |
| C20 | N2 | C17 | C21 | 99.2° | 144.7° |
| N2 | C20 | C19 | H16 | 138.8° | 81.0° |
| N2 | C20 | C19 | H15 | 100.6° | 155.8° |
| N2 | C20 | H18 | H17 | 122.1° | 123.1° |
| C20 | N2 | C17 | H12 | 138.5° | 94.2° |
| C26 | C23 | N6 | H25 | 124.8° | 122.0° |
| C26 | C23 | C24 | H27 | 30.5° | 26.4° |
| C26 | C23 | C24 | H26 | 152.0° | 97.5° |
| C23 | C26 | H30 | H31 | 120.0° | 120.0° |
| C23 | C26 | H30 | H32 | 120.0° | 120.0° |
| C23 | C26 | H31 | H32 | 120.0° | 120.1° |
| N6 | C23 | C24 | H27 | 148.1° | 92.1° |
| N6 | C23 | C24 | H26 | 90.4° | 144.0° |
| N6 | C23 | C26 | H30 | 68.6° | 177.2° |
| N6 | C23 | C26 | H31 | 51.3° | 62.8° |
| N6 | C23 | C26 | H32 | 171.4° | 57.2° |
| C21 | C17 | N2 | H12 | 122.3° | 121.2° |
| C21 | C17 | C18 | H14 | 128.6° | 120.5° |
| C21 | C17 | C18 | H13 | 7.5° | 1.6° |
| C17 | C21 | H19 | H20 | 120.0° | 120.0° |
| C17 | C21 | H19 | H21 | 120.0° | 120.0° |
| C17 | C21 | H20 | H21 | 120.0° | 120.0° |
| N2 | C17 | C18 | H14 | 113.7° | 120.1° |
| N2 | C17 | C18 | H13 | 125.1° | 117.7° |
| C17 | N2 | C20 | H18 | 95.9° | 157.6° |
| C17 | N2 | C20 | H17 | 142.7° | 79.2° |
| N2 | C17 | C21 | H19 | 64.0° | 59.1° |
| N2 | C17 | C21 | H20 | 176.0° | 61.0° |
| N2 | C17 | C21 | H21 | 56.0° | 179.1° |
| C22 | C16 | C6 | H11 | 120.6° | 120.0° |
| C22 | C16 | C6 | H10 | 120.6° | 119.9° |
| C22 | C16 | C6 | N8 | 164.5° | 65.0° |
| C16 | C22 | H24 | H22 | 120.0° | 120.0° |
| C16 | C22 | H24 | H23 | 120.0° | 120.0° |
| C16 | C22 | H22 | H23 | 120.0° | 120.0° |
| C22 | C16 | H11 | H10 | 118.2° | 120.0° |
| C22 | C16 | C6 | H2 | 47.0° | 54.9° |
| C16 | C6 | N8 | H2 | 117.3° | 120.0° |
| C6 | C16 | C22 | H24 | 180.0° | 60.0° |
| C6 | C16 | C22 | H22 | 60.0° | 59.9° |
| C6 | C16 | C22 | H23 | 60.0° | 180.0° |
| C6 | C16 | H11 | H10 | 118.3° | 120.0° |
| C16 | C6 | N8 | H69 | 59.1° | 60.0° |
| C16 | C6 | N8 | H9 | 60.8° | 176.1° |
| N8 | C6 | C16 | H11 | 43.9° | 55.0° |
| N8 | C6 | C16 | H10 | 74.9° | 175.0° |
| C6 | N8 | H69 | H9 | 120.0° | 123.9° |
| H5 | C9 | C13 | H7 | 0.0° | 0.3° |
| H5 | C9 | C10 | H6 | 0.9° | 0.2° |
| H29 | C25 | C24 | H27 | 28.9° | 25.6° |
| H29 | C25 | C24 | H26 | 150.4° | 98.2° |
| H28 | C25 | C24 | H27 | 94.0° | 148.2° |
| H28 | C25 | C24 | H26 | 27.4° | 24.5° |
| H27 | C24 | C23 | H25 | 93.2° | 148.2° |
| H26 | C24 | C23 | H25 | 28.3° | 24.3° |
| H16 | C19 | C18 | H14 | 112.6° | 144.7° |
| H16 | C19 | C18 | H13 | 8.6° | 22.5° |
| H16 | C19 | C20 | H18 | 19.6° | 37.5° |
| H16 | C19 | C20 | H17 | 101.9° | 160.6° |
| H15 | C19 | C18 | H14 | 7.9° | 21.5° |
| H15 | C19 | C18 | H13 | 129.1° | 100.8° |
| H15 | C19 | C20 | H18 | 140.1° | 85.8° |
| H15 | C19 | C20 | H17 | 18.7° | 37.3° |
| H14 | C18 | C17 | H12 | 6.9° | 0.6° |
| H13 | C18 | C17 | H12 | 114.2° | 122.7° |
| H25 | C23 | C26 | H30 | 56.6° | 60.5° |
| H25 | C23 | C26 | H31 | 176.6° | 59.5° |
| H25 | C23 | C26 | H32 | 63.4° | 179.6° |
| H12 | C17 | C21 | H19 | 58.6° | 179.7° |
| H12 | C17 | C21 | H20 | 61.4° | 60.3° |
| H12 | C17 | C21 | H21 | 178.7° | 59.7° |
| H30 | C26 | H31 | H32 | 120.0° | 120.0° |
| H19 | C21 | H20 | H21 | 120.0° | 120.0° |
| H24 | C22 | H22 | H23 | 120.0° | 120.0° |
| H24 | C22 | C16 | H11 | 59.4° | 60.0° |
| H24 | C22 | C16 | H10 | 59.4° | 180.0° |
| H22 | C22 | C16 | H11 | 60.6° | 180.0° |
| H22 | C22 | C16 | H10 | 179.4° | 60.0° |
| H23 | C22 | C16 | H11 | 179.4° | 59.9° |
| H23 | C22 | C16 | H10 | 60.6° | 60.1° |
| H11 | C16 | C6 | H2 | 73.6° | 175.0° |
| H10 | C16 | C6 | H2 | 167.6° | 65.0° |
| H2 | C6 | N8 | H69 | 58.1° | 180.0° |
| H2 | C6 | N8 | H9 | 178.1° | 56.1° |
