10B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C68 | C67 | sing | 1.53Å | 1.49Å | |
| C67 | C69 | sing | 1.53Å | 1.51Å | |
| C67 | O15 | sing | 1.43Å | 1.39Å | |
| O15 | N12 | sing | 1.42Å | 1.32Å | |
| C31 | N12 | sing | 1.46Å | 1.47Å | |
| C31 | C11 | sing | 1.51Å | 1.51Å | |
| N12 | S13 | sing | 1.66Å | 1.67Å | |
| O2 | C11 | doub | 1.21Å | 1.21Å | |
| O14 | S13 | doub | 1.42Å | 1.44Å | |
| C11 | N2 | sing | 1.35Å | 1.43Å | |
| S13 | O13 | doub | 1.42Å | 1.44Å | |
| S13 | C28 | sing | 1.76Å | 1.79Å | |
| N2 | O7 | sing | 1.42Å | 1.31Å | |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C17 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | C21 | sing | 1.48Å | 1.50Å | |
| C26 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| C26 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | C30 | sing | 1.39Å | 1.39Å | Aromatic |
| C25 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C67 | H1 | sing | 1.09Å | 1.10Å | |
| C69 | H2 | sing | 1.09Å | 1.10Å | |
| C69 | H3 | sing | 1.09Å | 1.10Å | |
| C69 | H4 | sing | 1.09Å | 1.10Å | |
| C68 | H5 | sing | 1.09Å | 1.10Å | |
| C68 | H6 | sing | 1.09Å | 1.10Å | |
| C68 | H7 | sing | 1.09Å | 1.10Å | |
| C31 | H8 | sing | 1.09Å | 1.10Å | |
| C31 | H9 | sing | 1.09Å | 1.10Å | |
| N2 | H10 | sing | 0.97Å | 1.00Å | |
| O7 | H11 | sing | 0.97Å | 0.95Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C17 | H13 | sing | 1.08Å | 1.08Å | |
| C15 | H14 | sing | 1.08Å | 1.08Å | |
| C29 | H15 | sing | 1.08Å | 1.08Å | |
| C26 | H16 | sing | 1.08Å | 1.08Å | |
| C25 | H17 | sing | 1.08Å | 1.08Å | |
| C24 | H18 | sing | 1.08Å | 1.08Å | |
| C23 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C68 | C67 | C69 | 109.0° | 109.4° |
| C68 | C67 | O15 | 107.1° | 109.5° |
| C68 | C67 | H1 | 110.1° | 109.5° |
| C67 | C68 | H5 | 109.5° | 109.5° |
| C67 | C68 | H6 | 109.5° | 109.5° |
| C67 | C68 | H7 | 109.5° | 109.5° |
| C69 | C67 | O15 | 109.4° | 109.5° |
| C69 | C67 | H1 | 109.8° | 109.4° |
| C67 | C69 | H2 | 109.5° | 109.4° |
| C67 | C69 | H3 | 109.5° | 109.4° |
| C67 | C69 | H4 | 109.5° | 109.4° |
| C67 | O15 | N12 | 119.3° | 113.9° |
| O15 | C67 | H1 | 111.5° | 109.6° |
| O15 | N12 | C31 | 114.5° | 120.0° |
| O15 | N12 | S13 | 109.8° | 120.0° |
| N12 | C31 | C11 | 107.8° | 109.5° |
| C31 | N12 | S13 | 117.2° | 120.0° |
| N12 | C31 | H8 | 109.9° | 109.5° |
| N12 | C31 | H9 | 109.9° | 109.5° |
| C31 | C11 | O2 | 120.1° | 120.0° |
| C31 | C11 | N2 | 121.5° | 120.0° |
| C11 | C31 | H8 | 109.9° | 109.5° |
| C11 | C31 | H9 | 109.9° | 109.5° |
| N12 | S13 | O14 | 115.2° | 106.4° |
| N12 | S13 | O13 | 113.6° | 106.4° |
| N12 | S13 | C28 | 105.2° | 107.2° |
| O2 | C11 | N2 | 118.4° | 120.0° |
| O14 | S13 | O13 | 102.1° | 123.2° |
| O14 | S13 | C28 | 110.2° | 106.4° |
| C11 | N2 | O7 | 118.8° | 120.0° |
| C11 | N2 | H10 | 120.6° | 120.0° |
| O13 | S13 | C28 | 110.8° | 106.4° |
| S13 | C28 | C29 | 119.5° | 119.9° |
| S13 | C28 | C14 | 119.6° | 119.9° |
| O7 | N2 | H10 | 120.6° | 120.0° |
| N2 | O7 | H11 | 109.5° | 114.0° |
| C29 | C28 | C14 | 120.8° | 120.2° |
| C28 | C29 | C15 | 119.7° | 120.1° |
| C28 | C29 | H15 | 120.2° | 119.9° |
| C28 | C14 | C17 | 119.1° | 120.1° |
| C28 | C14 | H12 | 120.4° | 119.9° |
| C29 | C15 | C16 | 119.7° | 119.9° |
| C29 | C15 | H14 | 120.1° | 120.0° |
| C15 | C29 | H15 | 120.2° | 120.0° |
| C14 | C17 | C16 | 120.1° | 119.9° |
| C17 | C14 | H12 | 120.5° | 120.0° |
| C14 | C17 | H13 | 120.0° | 120.1° |
| C15 | C16 | C17 | 120.6° | 119.7° |
| C15 | C16 | C21 | 119.1° | 120.1° |
| C16 | C15 | H14 | 120.2° | 120.1° |
| C17 | C16 | C21 | 120.3° | 120.1° |
| C16 | C17 | H13 | 120.0° | 120.0° |
| C16 | C21 | C26 | 122.1° | 120.1° |
| C16 | C21 | C30 | 118.1° | 120.1° |
| C21 | C26 | C25 | 120.3° | 119.9° |
| C26 | C21 | C30 | 119.7° | 119.7° |
| C21 | C26 | H16 | 119.9° | 120.1° |
| C26 | C25 | C24 | 120.0° | 120.1° |
| C25 | C26 | H16 | 119.8° | 120.1° |
| C26 | C25 | H17 | 120.0° | 119.9° |
| C21 | C30 | C23 | 119.8° | 119.9° |
| C21 | C30 | H20 | 120.1° | 120.0° |
| C25 | C24 | C23 | 119.7° | 120.3° |
| C24 | C25 | H17 | 120.0° | 120.0° |
| C25 | C24 | H18 | 120.1° | 119.9° |
| C30 | C23 | C24 | 120.4° | 120.1° |
| C30 | C23 | H19 | 119.8° | 119.9° |
| C23 | C30 | H20 | 120.1° | 120.1° |
| C23 | C24 | H18 | 120.1° | 119.8° |
| C24 | C23 | H19 | 119.8° | 120.0° |
| H2 | C69 | H3 | 109.5° | 109.5° |
| H2 | C69 | H4 | 109.4° | 109.5° |
| H3 | C69 | H4 | 109.5° | 109.5° |
| H5 | C68 | H6 | 109.5° | 109.5° |
| H5 | C68 | H7 | 109.5° | 109.4° |
| H6 | C68 | H7 | 109.5° | 109.5° |
| H8 | C31 | H9 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C68 | C67 | C69 | O15 | 116.8° | 120.0° |
| C68 | C67 | C69 | H1 | 120.6° | 120.0° |
| C68 | C67 | O15 | H1 | 120.5° | 120.0° |
| C68 | C67 | O15 | N12 | 147.3° | 155.0° |
| C68 | C67 | C69 | H2 | 180.0° | 60.0° |
| C68 | C67 | C69 | H3 | 60.0° | 180.0° |
| C68 | C67 | C69 | H4 | 60.0° | 60.0° |
| C67 | C68 | H5 | H6 | 120.0° | 120.0° |
| C67 | C68 | H5 | H7 | 120.0° | 120.0° |
| C67 | C68 | H6 | H7 | 120.0° | 120.0° |
| C69 | C67 | O15 | H1 | 121.6° | 120.0° |
| C69 | C67 | O15 | N12 | 94.8° | 85.0° |
| C67 | C69 | H2 | H3 | 120.0° | 119.9° |
| C67 | C69 | H2 | H4 | 120.0° | 119.9° |
| C67 | C69 | H3 | H4 | 120.0° | 120.0° |
| C69 | C67 | C68 | H5 | 180.0° | 60.0° |
| C69 | C67 | C68 | H6 | 60.0° | 180.0° |
| C69 | C67 | C68 | H7 | 60.0° | 60.0° |
| C67 | O15 | N12 | C31 | 91.1° | 90.1° |
| C67 | O15 | N12 | S13 | 134.6° | 90.1° |
| O15 | C67 | C69 | H2 | 63.3° | 179.9° |
| O15 | C67 | C69 | H3 | 56.8° | 60.1° |
| O15 | C67 | C69 | H4 | 176.8° | 60.0° |
| O15 | C67 | C68 | H5 | 61.8° | 60.0° |
| O15 | C67 | C68 | H6 | 178.2° | 60.0° |
| O15 | C67 | C68 | H7 | 58.2° | 180.0° |
| O15 | N12 | C31 | S13 | 130.8° | 179.9° |
| O15 | N12 | C31 | C11 | 127.7° | 89.9° |
| O15 | N12 | S13 | O14 | 7.5° | 28.5° |
| O15 | N12 | S13 | O13 | 109.7° | 161.4° |
| O15 | N12 | S13 | C28 | 129.0° | 85.0° |
| N12 | O15 | C67 | H1 | 26.8° | 35.0° |
| O15 | N12 | C31 | H8 | 8.0° | 30.1° |
| O15 | N12 | C31 | H9 | 112.5° | 150.0° |
| N12 | C31 | C11 | H8 | 119.8° | 120.0° |
| N12 | C31 | C11 | H9 | 119.8° | 120.0° |
| N12 | C31 | C11 | O2 | 77.2° | 0.0° |
| C31 | N12 | S13 | O14 | 140.5° | 151.4° |
| N12 | C31 | C11 | N2 | 102.6° | 180.0° |
| C31 | N12 | S13 | O13 | 23.2° | 18.5° |
| C31 | N12 | S13 | C28 | 98.1° | 95.1° |
| N12 | C31 | H8 | H9 | 120.7° | 120.0° |
| C11 | C31 | N12 | S13 | 101.4° | 89.9° |
| C31 | C11 | O2 | N2 | 179.8° | 180.0° |
| C31 | C11 | N2 | O7 | 179.9° | 180.0° |
| C11 | C31 | H8 | H9 | 120.7° | 120.0° |
| C31 | C11 | N2 | H10 | 0.1° | 0.0° |
| N12 | S13 | O14 | O13 | 123.5° | 123.0° |
| N12 | S13 | O14 | C28 | 118.8° | 114.0° |
| N12 | S13 | O13 | C28 | 118.1° | 114.1° |
| N12 | S13 | C28 | C29 | 84.3° | 89.9° |
| N12 | S13 | C28 | C14 | 95.7° | 89.7° |
| S13 | N12 | C31 | H8 | 138.8° | 150.1° |
| S13 | N12 | C31 | H9 | 18.3° | 30.1° |
| O2 | C11 | N2 | O7 | 0.3° | 0.1° |
| O2 | C11 | C31 | H8 | 42.6° | 120.0° |
| O2 | C11 | C31 | H9 | 163.1° | 120.0° |
| O2 | C11 | N2 | H10 | 179.7° | 180.0° |
| O14 | S13 | O13 | C28 | 117.3° | 123.0° |
| O14 | S13 | C28 | C29 | 40.4° | 23.6° |
| O14 | S13 | C28 | C14 | 139.6° | 156.8° |
| C11 | N2 | O7 | H10 | 180.0° | 179.9° |
| N2 | C11 | C31 | H8 | 137.6° | 60.0° |
| N2 | C11 | C31 | H9 | 17.1° | 59.9° |
| C11 | N2 | O7 | H11 | 0.2° | 180.0° |
| O13 | S13 | C28 | C29 | 152.6° | 156.5° |
| O13 | S13 | C28 | C14 | 27.4° | 23.8° |
| S13 | C28 | C29 | C14 | 180.0° | 179.7° |
| S13 | C28 | C29 | C15 | 179.7° | 179.7° |
| S13 | C28 | C14 | C17 | 179.7° | 180.0° |
| S13 | C28 | C14 | H12 | 0.3° | 0.1° |
| S13 | C28 | C29 | H15 | 0.3° | 0.1° |
| C28 | C29 | C15 | H15 | 180.0° | 179.7° |
| C29 | C28 | C14 | C17 | 0.3° | 0.4° |
| C28 | C29 | C15 | C16 | 0.4° | 0.6° |
| C29 | C28 | C14 | H12 | 179.7° | 179.7° |
| C28 | C29 | C15 | H14 | 179.6° | 179.7° |
| C14 | C28 | C29 | C15 | 0.4° | 0.6° |
| C28 | C14 | C17 | H12 | 180.0° | 179.9° |
| C28 | C14 | C17 | C16 | 0.9° | 0.1° |
| C28 | C14 | C17 | H13 | 179.1° | 180.0° |
| C14 | C28 | C29 | H15 | 179.6° | 179.7° |
| C29 | C15 | C16 | H14 | 180.0° | 179.8° |
| C29 | C15 | C16 | C17 | 0.2° | 0.3° |
| C29 | C15 | C16 | C21 | 177.6° | 179.7° |
| C14 | C17 | C16 | C15 | 0.8° | 0.1° |
| C14 | C17 | C16 | H13 | 180.0° | 180.0° |
| C14 | C17 | C16 | C21 | 178.2° | 180.0° |
| C15 | C16 | C17 | C21 | 177.4° | 180.0° |
| C15 | C16 | C21 | C26 | 37.4° | 179.8° |
| C15 | C16 | C21 | C30 | 139.3° | 0.0° |
| C15 | C16 | C17 | H13 | 179.2° | 180.0° |
| C16 | C15 | C29 | H15 | 179.6° | 179.8° |
| C17 | C16 | C21 | C26 | 145.2° | 0.3° |
| C17 | C16 | C21 | C30 | 38.1° | 179.9° |
| C16 | C17 | C14 | H12 | 179.1° | 180.0° |
| C17 | C16 | C15 | H14 | 179.9° | 180.0° |
| C16 | C21 | C26 | C30 | 176.6° | 179.8° |
| C16 | C21 | C26 | C25 | 178.4° | 180.0° |
| C16 | C21 | C30 | C23 | 178.1° | 179.7° |
| C21 | C16 | C17 | H13 | 1.8° | 0.0° |
| C21 | C16 | C15 | H14 | 2.4° | 0.0° |
| C16 | C21 | C26 | H16 | 1.5° | 0.0° |
| C16 | C21 | C30 | H20 | 1.9° | 0.0° |
| C21 | C26 | C25 | H16 | 180.0° | 180.0° |
| C21 | C26 | C25 | C24 | 1.5° | 0.1° |
| C26 | C21 | C30 | C23 | 1.4° | 0.5° |
| C21 | C26 | C25 | H17 | 178.5° | 180.0° |
| C26 | C21 | C30 | H20 | 178.6° | 179.8° |
| C25 | C26 | C21 | C30 | 1.8° | 0.2° |
| C26 | C25 | C24 | H17 | 180.0° | 179.9° |
| C26 | C25 | C24 | C23 | 0.7° | 0.1° |
| C26 | C25 | C24 | H18 | 179.3° | 180.0° |
| C21 | C30 | C23 | H20 | 180.0° | 179.7° |
| C21 | C30 | C23 | C24 | 0.6° | 0.5° |
| C30 | C21 | C26 | H16 | 178.1° | 179.8° |
| C21 | C30 | C23 | H19 | 179.4° | 179.7° |
| C25 | C24 | C23 | C30 | 0.3° | 0.3° |
| C25 | C24 | C23 | H18 | 180.0° | 179.9° |
| C24 | C25 | C26 | H16 | 178.5° | 179.9° |
| C25 | C24 | C23 | H19 | 179.7° | 180.0° |
| C30 | C23 | C24 | H19 | 180.0° | 179.7° |
| C30 | C23 | C24 | H18 | 179.8° | 179.7° |
| C23 | C24 | C25 | H17 | 179.3° | 180.0° |
| C24 | C23 | C30 | H20 | 179.4° | 179.8° |
| H1 | C67 | C69 | H2 | 59.4° | 60.0° |
| H1 | C67 | C69 | H3 | 179.4° | 60.0° |
| H1 | C67 | C69 | H4 | 60.6° | 180.0° |
| H1 | C67 | C68 | H5 | 59.6° | 179.9° |
| H1 | C67 | C68 | H6 | 60.4° | 60.1° |
| H1 | C67 | C68 | H7 | 179.6° | 59.9° |
| H2 | C69 | H3 | H4 | 120.0° | 120.1° |
| H5 | C68 | H6 | H7 | 120.0° | 120.0° |
| H10 | N2 | O7 | H11 | 179.9° | 0.1° |
| H12 | C14 | C17 | H13 | 0.9° | 0.0° |
| H14 | C15 | C29 | H15 | 0.5° | 0.0° |
| H16 | C26 | C25 | H17 | 1.5° | 0.0° |
| H17 | C25 | C24 | H18 | 0.7° | 0.1° |
| H18 | C24 | C23 | H19 | 0.3° | 0.1° |
| H19 | C23 | C30 | H20 | 0.7° | 0.0° |
