2II
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C23 | doub | 1.21Å | 1.21Å | |
| C23 | C24 | sing | 1.51Å | 1.50Å | |
| C23 | N3 | sing | 1.35Å | 1.34Å | |
| C21 | N3 | sing | 1.47Å | 1.47Å | |
| C21 | C20 | sing | 1.54Å | 1.52Å | |
| C25 | C24 | sing | 1.53Å | 1.49Å | |
| N3 | C22 | sing | 1.48Å | 1.46Å | |
| C20 | C19 | sing | 1.55Å | 1.54Å | |
| C30 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | C26 | sing | 1.40Å | 1.39Å | Aromatic |
| C29 | N4 | sing | 1.32Å | 1.33Å | Aromatic |
| C22 | C19 | sing | 1.55Å | 1.53Å | |
| C18 | N1 | sing | 1.35Å | 1.35Å | Aromatic |
| C18 | C17 | doub | 1.36Å | 1.37Å | Aromatic |
| C19 | N1 | sing | 1.46Å | 1.50Å | |
| N1 | N2 | sing | 1.40Å | 1.36Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C17 | C26 | sing | 1.48Å | 1.48Å | |
| C17 | C16 | sing | 1.42Å | 1.43Å | Aromatic |
| C26 | C27 | doub | 1.40Å | 1.39Å | Aromatic |
| N4 | C28 | doub | 1.32Å | 1.33Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| N2 | C16 | doub | 1.31Å | 1.33Å | Aromatic |
| C16 | C14 | sing | 1.48Å | 1.48Å | |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | O1 | sing | 1.36Å | 1.38Å | |
| O1 | C9 | sing | 1.43Å | 1.44Å | |
| C9 | C4 | sing | 1.51Å | 1.51Å | |
| C4 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.50Å | |
| C2 | C7 | doub | 1.40Å | 1.38Å | Aromatic |
| C1 | N | sing | 1.47Å | 1.46Å | |
| C6 | C7 | sing | 1.40Å | 1.40Å | Aromatic |
| C7 | C8 | sing | 1.48Å | 1.49Å | |
| N | C8 | sing | 1.34Å | 1.36Å | |
| N | C | sing | 1.47Å | 1.46Å | |
| C8 | O | doub | 1.21Å | 1.22Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C9 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.08Å | 1.08Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å | |
| C29 | H25 | sing | 1.08Å | 1.08Å | |
| C28 | H26 | sing | 1.08Å | 1.08Å | |
| C5 | H27 | sing | 1.08Å | 1.08Å | |
| C6 | H28 | sing | 1.08Å | 1.08Å | |
| C | H29 | sing | 1.09Å | 1.10Å | |
| C | H30 | sing | 1.09Å | 1.10Å | |
| C | H31 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C23 | C24 | 120.6° | 120.0° |
| O2 | C23 | N3 | 121.7° | 120.0° |
| C24 | C23 | N3 | 117.7° | 120.0° |
| C23 | C24 | C25 | 111.8° | 109.5° |
| C23 | C24 | H17 | 108.9° | 109.5° |
| C23 | C24 | H18 | 108.9° | 109.4° |
| C23 | N3 | C21 | 122.1° | 125.6° |
| C23 | N3 | C22 | 127.3° | 125.6° |
| N3 | C21 | C20 | 102.9° | 107.3° |
| C21 | N3 | C22 | 110.6° | 108.7° |
| N3 | C21 | H13 | 111.1° | 109.9° |
| N3 | C21 | H14 | 111.1° | 109.8° |
| C21 | C20 | C19 | 101.8° | 102.9° |
| C21 | C20 | H11 | 111.3° | 110.7° |
| C21 | C20 | H12 | 111.4° | 110.9° |
| C20 | C21 | H13 | 111.1° | 109.9° |
| C20 | C21 | H14 | 111.1° | 109.9° |
| C25 | C24 | H17 | 108.9° | 109.5° |
| C25 | C24 | H18 | 108.9° | 109.4° |
| C24 | C25 | H21 | 109.5° | 109.5° |
| C24 | C25 | H22 | 109.4° | 109.5° |
| C24 | C25 | H23 | 109.5° | 109.4° |
| N3 | C22 | C19 | 104.7° | 104.8° |
| N3 | C22 | H15 | 110.7° | 110.3° |
| N3 | C22 | H16 | 110.7° | 110.5° |
| C20 | C19 | C22 | 102.0° | 101.6° |
| C20 | C19 | N1 | 110.0° | 111.0° |
| C20 | C19 | H10 | 110.6° | 111.0° |
| C19 | C20 | H11 | 111.4° | 110.7° |
| C19 | C20 | H12 | 111.4° | 110.7° |
| C29 | C30 | C26 | 118.8° | 119.0° |
| C30 | C29 | N4 | 123.8° | 120.9° |
| C29 | C30 | H20 | 120.6° | 120.5° |
| C30 | C29 | H25 | 118.1° | 119.6° |
| C30 | C26 | C17 | 121.1° | 120.9° |
| C30 | C26 | C27 | 117.9° | 118.2° |
| C26 | C30 | H20 | 120.6° | 120.5° |
| C29 | N4 | C28 | 116.8° | 122.0° |
| N4 | C29 | H25 | 118.1° | 119.5° |
| C22 | C19 | N1 | 112.0° | 111.0° |
| C22 | C19 | H10 | 110.8° | 111.0° |
| C19 | C22 | H15 | 110.6° | 110.3° |
| C19 | C22 | H16 | 110.7° | 110.4° |
| N1 | C18 | C17 | 106.8° | 107.8° |
| C18 | N1 | C19 | 127.5° | 125.8° |
| C18 | N1 | N2 | 112.9° | 108.4° |
| N1 | C18 | H24 | 126.6° | 126.0° |
| C18 | C17 | C26 | 125.6° | 126.3° |
| C18 | C17 | C16 | 104.6° | 107.4° |
| C17 | C18 | H24 | 126.6° | 126.1° |
| C19 | N1 | N2 | 119.5° | 125.8° |
| N1 | C19 | H10 | 111.1° | 110.9° |
| N1 | N2 | C16 | 104.1° | 108.4° |
| C12 | C13 | C14 | 120.4° | 120.0° |
| C13 | C12 | C11 | 120.3° | 120.2° |
| C13 | C12 | H7 | 119.8° | 119.9° |
| C12 | C13 | H8 | 119.8° | 120.0° |
| C13 | C14 | C16 | 120.9° | 120.1° |
| C13 | C14 | C15 | 119.5° | 119.8° |
| C14 | C13 | H8 | 119.8° | 120.0° |
| C26 | C17 | C16 | 129.3° | 126.3° |
| C17 | C26 | C27 | 121.0° | 120.9° |
| C17 | C16 | N2 | 111.5° | 107.9° |
| C17 | C16 | C14 | 130.2° | 126.1° |
| C26 | C27 | C28 | 118.8° | 119.0° |
| C26 | C27 | H19 | 120.6° | 120.5° |
| N4 | C28 | C27 | 123.7° | 120.9° |
| N4 | C28 | H26 | 118.2° | 119.6° |
| C12 | C11 | C10 | 119.3° | 120.2° |
| C12 | C11 | H6 | 120.4° | 119.9° |
| C11 | C12 | H7 | 119.8° | 119.9° |
| N2 | C16 | C14 | 118.2° | 126.1° |
| C16 | C14 | C15 | 119.5° | 120.1° |
| C14 | C15 | C10 | 119.7° | 119.8° |
| C14 | C15 | H9 | 120.2° | 120.0° |
| C28 | C27 | H19 | 120.6° | 120.5° |
| C27 | C28 | H26 | 118.1° | 119.6° |
| C11 | C10 | C15 | 120.8° | 120.0° |
| C11 | C10 | O1 | 117.6° | 120.0° |
| C10 | C11 | H6 | 120.3° | 119.9° |
| C15 | C10 | O1 | 121.3° | 120.0° |
| C10 | C15 | H9 | 120.2° | 120.1° |
| C10 | O1 | C9 | 119.1° | 117.0° |
| O1 | C9 | C4 | 112.7° | 109.5° |
| O1 | C9 | H4 | 108.6° | 109.5° |
| O1 | C9 | H5 | 108.7° | 109.5° |
| C9 | C4 | C3 | 119.6° | 119.9° |
| C9 | C4 | C5 | 122.1° | 119.9° |
| C4 | C9 | H4 | 108.7° | 109.5° |
| C4 | C9 | H5 | 108.7° | 109.4° |
| C3 | C4 | C5 | 118.1° | 120.2° |
| C4 | C3 | C2 | 121.3° | 120.0° |
| C4 | C3 | H3 | 119.4° | 120.0° |
| C4 | C5 | C6 | 121.2° | 120.3° |
| C4 | C5 | H27 | 119.4° | 119.9° |
| C3 | C2 | C1 | 130.5° | 133.2° |
| C3 | C2 | C7 | 120.0° | 120.3° |
| C2 | C3 | H3 | 119.3° | 120.0° |
| C5 | C6 | C7 | 119.6° | 119.8° |
| C6 | C5 | H27 | 119.4° | 119.8° |
| C5 | C6 | H28 | 120.2° | 120.1° |
| C1 | C2 | C7 | 109.5° | 106.4° |
| C2 | C1 | N | 102.4° | 106.2° |
| C2 | C1 | H1 | 111.2° | 110.1° |
| C2 | C1 | H2 | 111.2° | 110.2° |
| C2 | C7 | C6 | 119.7° | 119.4° |
| C2 | C7 | C8 | 108.6° | 108.3° |
| C1 | N | C8 | 113.3° | 108.8° |
| C1 | N | C | 123.4° | 125.6° |
| N | C1 | H1 | 111.2° | 110.1° |
| N | C1 | H2 | 111.2° | 110.1° |
| C6 | C7 | C8 | 131.7° | 132.3° |
| C7 | C6 | H28 | 120.2° | 120.1° |
| C7 | C8 | N | 106.2° | 110.2° |
| C7 | C8 | O | 129.1° | 124.9° |
| C8 | N | C | 123.4° | 125.6° |
| N | C8 | O | 124.7° | 124.9° |
| N | C | H29 | 109.5° | 109.5° |
| N | C | H30 | 109.5° | 109.5° |
| N | C | H31 | 109.4° | 109.5° |
| H1 | C1 | H2 | 109.5° | 110.0° |
| H4 | C9 | H5 | 109.5° | 109.5° |
| H11 | C20 | H12 | 109.5° | 110.6° |
| H13 | C21 | H14 | 109.5° | 110.0° |
| H15 | C22 | H16 | 109.5° | 110.4° |
| H17 | C24 | H18 | 109.5° | 109.5° |
| H21 | C25 | H22 | 109.5° | 109.5° |
| H21 | C25 | H23 | 109.5° | 109.5° |
| H22 | C25 | H23 | 109.5° | 109.4° |
| H29 | C | H30 | 109.4° | 109.5° |
| H29 | C | H31 | 109.5° | 109.5° |
| H30 | C | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C23 | C24 | N3 | 179.1° | 179.9° |
| O2 | C23 | N3 | C21 | 21.5° | 179.9° |
| O2 | C23 | C24 | C25 | 56.4° | 0.1° |
| O2 | C23 | N3 | C22 | 160.7° | 0.1° |
| O2 | C23 | C24 | H17 | 176.8° | 120.0° |
| O2 | C23 | C24 | H18 | 63.9° | 120.0° |
| C24 | C23 | N3 | C21 | 157.6° | 0.0° |
| C23 | C24 | C25 | H17 | 120.4° | 120.1° |
| C23 | C24 | C25 | H18 | 120.4° | 119.9° |
| C24 | C23 | N3 | C22 | 20.2° | 179.9° |
| C23 | C24 | H17 | H18 | 118.9° | 120.0° |
| C23 | C24 | C25 | H21 | 180.0° | 180.0° |
| C23 | C24 | C25 | H22 | 60.0° | 59.9° |
| C23 | C24 | C25 | H23 | 60.0° | 60.0° |
| C23 | N3 | C21 | C22 | 178.1° | 179.9° |
| C23 | N3 | C21 | C20 | 157.4° | 178.9° |
| N3 | C23 | C24 | C25 | 124.5° | 180.0° |
| C23 | N3 | C22 | C19 | 176.4° | 155.9° |
| C23 | N3 | C21 | H13 | 83.7° | 59.4° |
| C23 | N3 | C21 | H14 | 38.5° | 61.7° |
| C23 | N3 | C22 | H15 | 64.4° | 85.4° |
| C23 | N3 | C22 | H16 | 57.1° | 36.9° |
| N3 | C23 | C24 | H17 | 4.1° | 60.0° |
| N3 | C23 | C24 | H18 | 115.2° | 60.1° |
| N3 | C21 | C20 | H13 | 118.9° | 119.5° |
| N3 | C21 | C20 | H14 | 118.9° | 119.4° |
| N3 | C21 | C20 | C19 | 38.2° | 22.2° |
| C21 | N3 | C22 | C19 | 5.7° | 24.0° |
| N3 | C21 | C20 | H11 | 157.0° | 140.6° |
| N3 | C21 | C20 | H12 | 80.6° | 96.3° |
| N3 | C21 | H13 | H14 | 123.1° | 121.0° |
| C21 | N3 | C22 | H15 | 113.5° | 94.8° |
| C21 | N3 | C22 | H16 | 124.9° | 142.9° |
| C20 | C21 | N3 | C22 | 20.7° | 1.0° |
| C21 | C20 | C19 | H11 | 118.7° | 118.3° |
| C21 | C20 | C19 | H12 | 118.8° | 118.6° |
| C21 | C20 | C19 | C22 | 41.6° | 35.5° |
| C21 | C20 | C19 | N1 | 77.3° | 153.6° |
| C21 | C20 | C19 | H10 | 159.5° | 82.6° |
| C21 | C20 | H11 | H12 | 123.6° | 123.3° |
| C20 | C21 | H13 | H14 | 123.0° | 121.1° |
| C25 | C24 | H17 | H18 | 118.9° | 120.0° |
| C24 | C25 | H21 | H22 | 120.0° | 120.1° |
| C24 | C25 | H21 | H23 | 120.0° | 120.0° |
| C24 | C25 | H22 | H23 | 120.0° | 120.0° |
| N3 | C22 | C19 | C20 | 29.3° | 36.9° |
| N3 | C22 | C19 | H15 | 119.2° | 118.7° |
| N3 | C22 | C19 | H16 | 119.3° | 119.0° |
| N3 | C22 | C19 | N1 | 88.2° | 155.0° |
| N3 | C22 | C19 | H10 | 147.1° | 81.1° |
| C22 | N3 | C21 | H13 | 98.2° | 120.5° |
| C22 | N3 | C21 | H14 | 139.6° | 118.4° |
| N3 | C22 | H15 | H16 | 122.2° | 122.4° |
| C20 | C19 | C22 | N1 | 117.6° | 118.1° |
| C20 | C19 | C22 | H10 | 117.8° | 118.0° |
| C20 | C19 | N1 | C18 | 104.1° | 30.7° |
| C20 | C19 | N1 | H10 | 122.9° | 123.8° |
| C20 | C19 | N1 | N2 | 72.4° | 149.6° |
| C19 | C20 | H11 | H12 | 123.6° | 123.2° |
| C19 | C20 | C21 | H13 | 80.7° | 97.3° |
| C19 | C20 | C21 | H14 | 157.2° | 141.6° |
| C20 | C19 | C22 | H15 | 89.9° | 81.8° |
| C20 | C19 | C22 | H16 | 148.6° | 155.9° |
| C29 | C30 | C26 | H20 | 180.0° | 179.7° |
| C30 | C29 | N4 | H25 | 180.0° | 179.6° |
| C29 | C30 | C26 | C17 | 178.8° | 180.0° |
| C29 | C30 | C26 | C27 | 2.1° | 0.0° |
| C30 | C29 | N4 | C28 | 1.7° | 0.6° |
| C26 | C30 | C29 | N4 | 1.5° | 0.3° |
| C30 | C26 | C17 | C18 | 37.4° | 50.0° |
| C30 | C26 | C17 | C27 | 179.1° | 180.0° |
| C30 | C26 | C17 | C16 | 152.4° | 130.0° |
| C30 | C26 | C27 | C28 | 0.3° | 0.0° |
| C30 | C26 | C27 | H19 | 179.7° | 179.7° |
| C26 | C30 | C29 | H25 | 178.5° | 180.0° |
| C29 | N4 | C28 | C27 | 4.4° | 0.6° |
| N4 | C29 | C30 | H20 | 178.6° | 180.0° |
| C29 | N4 | C28 | H26 | 175.6° | 179.4° |
| C22 | C19 | N1 | C18 | 8.5° | 81.6° |
| C22 | C19 | N1 | H10 | 124.5° | 123.9° |
| C22 | C19 | N1 | N2 | 175.0° | 98.2° |
| C22 | C19 | C20 | H11 | 160.4° | 153.8° |
| C22 | C19 | C20 | H12 | 77.1° | 83.1° |
| C19 | C22 | H15 | H16 | 122.2° | 122.3° |
| N1 | C18 | C17 | H24 | 180.0° | 179.9° |
| C18 | N1 | C19 | N2 | 176.5° | 179.7° |
| N1 | C18 | C17 | C26 | 173.0° | 179.9° |
| N1 | C18 | C17 | C16 | 0.8° | 0.1° |
| C18 | N1 | N2 | C16 | 2.4° | 0.2° |
| C18 | N1 | C19 | H10 | 133.0° | 154.5° |
| C17 | C18 | N1 | C19 | 177.7° | 179.8° |
| C17 | C18 | N1 | N2 | 1.0° | 0.0° |
| C18 | C17 | C26 | C16 | 170.2° | 180.0° |
| C18 | C17 | C26 | C27 | 141.7° | 130.0° |
| C18 | C17 | C16 | N2 | 2.4° | 0.3° |
| C18 | C17 | C16 | C14 | 178.2° | 179.9° |
| C19 | N1 | N2 | C16 | 179.4° | 180.0° |
| N1 | C19 | C20 | H11 | 41.4° | 88.0° |
| N1 | C19 | C20 | H12 | 163.9° | 35.0° |
| N1 | C19 | C22 | H15 | 152.5° | 36.3° |
| N1 | C19 | C22 | H16 | 31.0° | 86.0° |
| C19 | N1 | C18 | H24 | 2.3° | 0.1° |
| N1 | N2 | C16 | C17 | 2.9° | 0.3° |
| N1 | N2 | C16 | C14 | 179.3° | 179.9° |
| N2 | N1 | C19 | H10 | 50.5° | 25.7° |
| N2 | N1 | C18 | H24 | 179.0° | 179.9° |
| C12 | C13 | C14 | H8 | 180.0° | 180.0° |
| C13 | C12 | C11 | H7 | 180.0° | 179.9° |
| C12 | C13 | C14 | C16 | 178.6° | 180.0° |
| C12 | C13 | C14 | C15 | 2.3° | 0.2° |
| C13 | C12 | C11 | C10 | 2.4° | 0.0° |
| C13 | C12 | C11 | H6 | 177.6° | 179.9° |
| C13 | C14 | C16 | C17 | 48.9° | 34.9° |
| C14 | C13 | C12 | C11 | 3.3° | 0.0° |
| C13 | C14 | C16 | N2 | 126.6° | 144.7° |
| C13 | C14 | C16 | C15 | 176.3° | 179.8° |
| C13 | C14 | C15 | C10 | 0.6° | 0.5° |
| C14 | C13 | C12 | H7 | 176.7° | 179.9° |
| C13 | C14 | C15 | H9 | 179.3° | 180.0° |
| C26 | C17 | C16 | N2 | 174.2° | 179.8° |
| C26 | C17 | C16 | C14 | 10.0° | 0.1° |
| C17 | C26 | C27 | C28 | 178.8° | 180.0° |
| C17 | C26 | C27 | H19 | 1.2° | 0.3° |
| C17 | C26 | C30 | H20 | 1.2° | 0.3° |
| C26 | C17 | C18 | H24 | 7.0° | 0.0° |
| C16 | C17 | C26 | C27 | 28.5° | 50.0° |
| C17 | C16 | N2 | C14 | 176.3° | 179.7° |
| C17 | C16 | C14 | C15 | 134.8° | 145.3° |
| C16 | C17 | C18 | H24 | 179.2° | 180.0° |
| C26 | C27 | C28 | N4 | 3.7° | 0.3° |
| C26 | C27 | C28 | H19 | 180.0° | 179.7° |
| C27 | C26 | C30 | H20 | 177.9° | 179.7° |
| C26 | C27 | C28 | H26 | 176.2° | 179.7° |
| N4 | C28 | C27 | H26 | 180.0° | 180.0° |
| N4 | C28 | C27 | H19 | 176.3° | 180.0° |
| C28 | N4 | C29 | H25 | 178.3° | 179.7° |
| C12 | C11 | C10 | H6 | 180.0° | 179.9° |
| C12 | C11 | C10 | C15 | 0.7° | 0.3° |
| C12 | C11 | C10 | O1 | 173.4° | 180.0° |
| C11 | C12 | C13 | H8 | 176.8° | 180.0° |
| N2 | C16 | C14 | C15 | 49.7° | 35.1° |
| C16 | C14 | C15 | C10 | 177.0° | 179.7° |
| C16 | C14 | C13 | H8 | 1.4° | 0.0° |
| C16 | C14 | C15 | H9 | 3.0° | 0.2° |
| C14 | C15 | C10 | C11 | 0.1° | 0.5° |
| C14 | C15 | C10 | H9 | 180.0° | 179.5° |
| C14 | C15 | C10 | O1 | 174.1° | 179.8° |
| C15 | C14 | C13 | H8 | 177.7° | 179.8° |
| C11 | C10 | C15 | O1 | 174.0° | 179.7° |
| C11 | C10 | O1 | C9 | 173.7° | 0.0° |
| C10 | C11 | C12 | H7 | 177.5° | 180.0° |
| C11 | C10 | C15 | H9 | 179.9° | 180.0° |
| C15 | C10 | O1 | C9 | 0.4° | 179.7° |
| C15 | C10 | C11 | H6 | 179.3° | 179.8° |
| C10 | O1 | C9 | C4 | 173.1° | 180.0° |
| C10 | O1 | C9 | H4 | 66.4° | 60.0° |
| C10 | O1 | C9 | H5 | 52.7° | 60.0° |
| O1 | C10 | C11 | H6 | 6.6° | 0.1° |
| O1 | C10 | C15 | H9 | 5.9° | 0.2° |
| O1 | C9 | C4 | H4 | 120.4° | 120.0° |
| O1 | C9 | C4 | H5 | 120.5° | 120.0° |
| O1 | C9 | C4 | C3 | 82.8° | 90.0° |
| O1 | C9 | C4 | C5 | 103.0° | 90.0° |
| O1 | C9 | H4 | H5 | 118.5° | 120.0° |
| C9 | C4 | C3 | C5 | 174.5° | 180.0° |
| C9 | C4 | C3 | C2 | 178.2° | 180.0° |
| C9 | C4 | C5 | C6 | 177.4° | 180.0° |
| C9 | C4 | C3 | H3 | 1.8° | 0.0° |
| C4 | C9 | H4 | H5 | 118.6° | 120.0° |
| C9 | C4 | C5 | H27 | 2.6° | 0.1° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 3.1° | 0.0° |
| C4 | C3 | C2 | C1 | 178.6° | 180.0° |
| C4 | C3 | C2 | C7 | 2.8° | 0.0° |
| C3 | C4 | C9 | H4 | 37.7° | 30.0° |
| C3 | C4 | C9 | H5 | 156.7° | 150.0° |
| C3 | C4 | C5 | H27 | 176.9° | 179.9° |
| C5 | C4 | C3 | C2 | 3.8° | 0.0° |
| C4 | C5 | C6 | H27 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 1.4° | 0.0° |
| C5 | C4 | C3 | H3 | 176.2° | 180.0° |
| C5 | C4 | C9 | H4 | 136.6° | 150.0° |
| C5 | C4 | C9 | H5 | 17.5° | 30.0° |
| C4 | C5 | C6 | H28 | 178.6° | 180.0° |
| C3 | C2 | C1 | C7 | 178.7° | 180.0° |
| C3 | C2 | C1 | N | 176.7° | 180.0° |
| C3 | C2 | C7 | C6 | 1.1° | 0.0° |
| C3 | C2 | C7 | C8 | 178.2° | 180.0° |
| C3 | C2 | C1 | H1 | 64.4° | 60.8° |
| C3 | C2 | C1 | H2 | 57.8° | 60.7° |
| C5 | C6 | C7 | C2 | 0.4° | 0.0° |
| C5 | C6 | C7 | H28 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 178.7° | 180.0° |
| C2 | C1 | N | H1 | 118.9° | 119.2° |
| C2 | C1 | N | H2 | 118.9° | 119.3° |
| C1 | C2 | C7 | C6 | 179.9° | 180.0° |
| C1 | C2 | C7 | C8 | 0.7° | 0.0° |
| C2 | C1 | N | C8 | 2.7° | 0.0° |
| C2 | C1 | N | C | 178.6° | 180.0° |
| C2 | C1 | H1 | H2 | 123.3° | 121.6° |
| C1 | C2 | C3 | H3 | 1.4° | 0.0° |
| C7 | C2 | C1 | N | 2.0° | 0.0° |
| C2 | C7 | C6 | C8 | 179.1° | 180.0° |
| C2 | C7 | C8 | N | 1.0° | 0.0° |
| C2 | C7 | C8 | O | 179.6° | 179.9° |
| C7 | C2 | C1 | H1 | 116.9° | 119.2° |
| C7 | C2 | C1 | H2 | 120.9° | 119.3° |
| C7 | C2 | C3 | H3 | 177.2° | 180.0° |
| C2 | C7 | C6 | H28 | 179.6° | 180.0° |
| C1 | N | C8 | C7 | 2.4° | 0.0° |
| C1 | N | C8 | C | 178.6° | 180.0° |
| C1 | N | C8 | O | 178.9° | 180.0° |
| N | C1 | H1 | H2 | 123.3° | 121.6° |
| C1 | N | C | H29 | 180.0° | 90.0° |
| C1 | N | C | H30 | 60.0° | 150.0° |
| C1 | N | C | H31 | 60.0° | 30.0° |
| C6 | C7 | C8 | N | 178.1° | 180.0° |
| C6 | C7 | C8 | O | 0.5° | 0.0° |
| C7 | C6 | C5 | H27 | 178.6° | 180.0° |
| C7 | C8 | N | O | 178.7° | 180.0° |
| C7 | C8 | N | C | 179.0° | 180.0° |
| C8 | C7 | C6 | H28 | 1.3° | 0.0° |
| C8 | N | C1 | H1 | 116.1° | 119.2° |
| C8 | N | C1 | H2 | 121.6° | 119.3° |
| C8 | N | C | H29 | 1.5° | 90.0° |
| C8 | N | C | H30 | 118.5° | 30.0° |
| C8 | N | C | H31 | 121.5° | 150.0° |
| C | N | C8 | O | 0.3° | 0.0° |
| C | N | C1 | H1 | 62.5° | 60.8° |
| C | N | C1 | H2 | 59.8° | 60.7° |
| N | C | H29 | H30 | 120.0° | 120.0° |
| N | C | H29 | H31 | 120.0° | 120.0° |
| N | C | H30 | H31 | 120.0° | 120.0° |
| H6 | C11 | C12 | H7 | 2.4° | 0.1° |
| H7 | C12 | C13 | H8 | 3.2° | 0.1° |
| H10 | C19 | C20 | H11 | 81.7° | 35.8° |
| H10 | C19 | C20 | H12 | 40.8° | 158.9° |
| H10 | C19 | C22 | H15 | 27.9° | 160.2° |
| H10 | C19 | C22 | H16 | 93.6° | 37.9° |
| H11 | C20 | C21 | H13 | 38.0° | 21.1° |
| H11 | C20 | C21 | H14 | 84.1° | 100.0° |
| H12 | C20 | C21 | H13 | 160.5° | 144.3° |
| H12 | C20 | C21 | H14 | 38.4° | 23.1° |
| H17 | C24 | C25 | H21 | 59.7° | 59.9° |
| H17 | C24 | C25 | H22 | 179.6° | NaN° |
| H17 | C24 | C25 | H23 | 60.4° | 60.0° |
| H18 | C24 | C25 | H21 | 59.6° | 60.1° |
| H18 | C24 | C25 | H22 | 60.4° | 60.0° |
| H18 | C24 | C25 | H23 | 179.7° | 180.0° |
| H19 | C27 | C28 | H26 | 3.7° | 0.0° |
| H20 | C30 | C29 | H25 | 1.5° | 0.3° |
| H21 | C25 | H22 | H23 | 120.0° | 120.0° |
| H27 | C5 | C6 | H28 | 1.4° | 0.1° |
| H29 | C | H30 | H31 | 120.0° | 120.0° |
