V14
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | O21 | sing | 1.43Å | 1.41Å | |
| C18 | C15 | sing | 1.53Å | 1.55Å | |
| C15 | S11 | sing | 1.81Å | 1.81Å | |
| O17 | S11 | doub | 1.42Å | 1.53Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C22 | C14 | sing | 1.53Å | 1.52Å | |
| C23 | C24 | sing | 1.53Å | 1.55Å | |
| N19 | C14 | sing | 1.47Å | 1.42Å | |
| N19 | C6 | sing | 1.40Å | 1.44Å | |
| C24 | C25 | sing | 1.53Å | 1.52Å | |
| S11 | C1 | sing | 1.76Å | 1.80Å | |
| S11 | O16 | doub | 1.42Å | 1.52Å | |
| C14 | C28 | sing | 1.53Å | 1.53Å | |
| C6 | C1 | doub | 1.39Å | 1.41Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.40Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| F20 | C5 | sing | 1.35Å | 1.33Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C28 | C27 | sing | 1.53Å | 1.54Å | |
| C2 | F13 | sing | 1.35Å | 1.37Å | |
| C2 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.37Å | Aromatic |
| C4 | S7 | sing | 1.76Å | 1.79Å | |
| C3 | F12 | sing | 1.35Å | 1.35Å | |
| N10 | S7 | sing | 1.66Å | 1.71Å | |
| S7 | O9 | doub | 1.42Å | 1.54Å | |
| S7 | O8 | doub | 1.42Å | 1.50Å | |
| N10 | H1 | sing | 0.97Å | 1.00Å | |
| N10 | H2 | sing | 0.97Å | 1.00Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| O21 | H7 | sing | 0.97Å | 0.95Å | |
| N19 | H8 | sing | 1.01Å | 1.00Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C27 | H12 | sing | 1.09Å | 1.10Å | |
| C27 | H13 | sing | 1.09Å | 1.10Å | |
| C26 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H16 | sing | 1.09Å | 1.10Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O21 | C18 | C15 | 116.6° | 109.5° |
| O21 | C18 | H5 | 107.7° | 109.5° |
| O21 | C18 | H6 | 107.7° | 109.5° |
| C18 | O21 | H7 | 109.5° | 114.0° |
| C18 | C15 | S11 | 110.4° | 109.5° |
| C18 | C15 | H3 | 109.2° | 109.4° |
| C18 | C15 | H4 | 109.2° | 109.4° |
| C15 | C18 | H5 | 107.7° | 109.4° |
| C15 | C18 | H6 | 107.7° | 109.5° |
| C15 | S11 | O17 | 108.8° | 110.5° |
| C15 | S11 | C1 | 112.7° | 104.4° |
| C15 | S11 | O16 | 114.9° | 110.5° |
| S11 | C15 | H3 | 109.3° | 109.5° |
| S11 | C15 | H4 | 109.3° | 109.5° |
| O17 | S11 | C1 | 108.9° | 104.3° |
| O17 | S11 | O16 | 105.1° | 121.1° |
| C23 | C22 | C14 | 112.5° | 109.5° |
| C22 | C23 | C24 | 106.5° | 109.5° |
| C22 | C23 | H20 | 110.2° | 109.5° |
| C22 | C23 | H21 | 110.2° | 109.5° |
| C23 | C22 | H22 | 108.7° | 109.5° |
| C23 | C22 | H23 | 108.7° | 109.5° |
| C22 | C14 | N19 | 106.9° | 109.5° |
| C22 | C14 | C28 | 116.1° | 109.5° |
| C22 | C14 | H9 | 107.4° | 109.5° |
| C14 | C22 | H22 | 108.7° | 109.5° |
| C14 | C22 | H23 | 108.7° | 109.5° |
| C23 | C24 | C25 | 111.8° | 109.5° |
| C23 | C24 | H18 | 108.9° | 109.5° |
| C23 | C24 | H19 | 108.9° | 109.5° |
| C24 | C23 | H20 | 110.2° | 109.5° |
| C24 | C23 | H21 | 110.2° | 109.4° |
| C14 | N19 | C6 | 120.6° | 110.9° |
| N19 | C14 | C28 | 110.3° | 109.4° |
| C14 | N19 | H8 | 106.6° | 111.0° |
| N19 | C14 | H9 | 108.6° | 109.5° |
| N19 | C6 | C1 | 123.6° | 120.0° |
| N19 | C6 | C5 | 117.5° | 120.1° |
| C6 | N19 | H8 | 106.7° | 111.0° |
| C24 | C25 | C26 | 113.0° | 109.4° |
| C24 | C25 | H16 | 108.6° | 109.5° |
| C24 | C25 | H17 | 108.6° | 109.5° |
| C25 | C24 | H18 | 108.9° | 109.5° |
| C25 | C24 | H19 | 108.9° | 109.5° |
| C1 | S11 | O16 | 106.0° | 104.3° |
| S11 | C1 | C6 | 127.8° | 120.0° |
| S11 | C1 | C2 | 113.4° | 120.0° |
| C14 | C28 | C27 | 114.1° | 109.4° |
| C28 | C14 | H9 | 107.3° | 109.5° |
| C14 | C28 | H10 | 108.3° | 109.4° |
| C14 | C28 | H11 | 108.3° | 109.5° |
| C1 | C6 | C5 | 118.8° | 119.9° |
| C6 | C1 | C2 | 118.8° | 120.0° |
| C6 | C5 | F20 | 118.8° | 120.0° |
| C6 | C5 | C4 | 122.2° | 120.0° |
| C1 | C2 | F13 | 120.8° | 120.0° |
| C1 | C2 | C3 | 120.7° | 120.0° |
| F20 | C5 | C4 | 119.0° | 120.0° |
| C25 | C26 | C27 | 119.5° | 109.5° |
| C25 | C26 | H14 | 106.9° | 109.5° |
| C25 | C26 | H15 | 106.9° | 109.4° |
| C26 | C25 | H16 | 108.6° | 109.5° |
| C26 | C25 | H17 | 108.6° | 109.4° |
| C5 | C4 | C3 | 117.5° | 120.0° |
| C5 | C4 | S7 | 125.2° | 120.0° |
| C26 | C27 | C28 | 112.4° | 109.6° |
| C26 | C27 | H12 | 108.7° | 109.5° |
| C26 | C27 | H13 | 108.7° | 109.4° |
| C27 | C26 | H14 | 106.9° | 109.4° |
| C27 | C26 | H15 | 106.9° | 109.5° |
| C27 | C28 | H10 | 108.3° | 109.5° |
| C27 | C28 | H11 | 108.3° | 109.5° |
| C28 | C27 | H12 | 108.8° | 109.4° |
| C28 | C27 | H13 | 108.7° | 109.5° |
| F13 | C2 | C3 | 118.5° | 120.0° |
| C2 | C3 | C4 | 121.9° | 120.1° |
| C2 | C3 | F12 | 118.3° | 120.0° |
| C3 | C4 | S7 | 117.2° | 120.0° |
| C4 | C3 | F12 | 119.7° | 119.9° |
| C4 | S7 | N10 | 112.5° | 107.2° |
| C4 | S7 | O9 | 115.5° | 106.4° |
| C4 | S7 | O8 | 102.5° | 106.4° |
| N10 | S7 | O9 | 109.2° | 106.4° |
| N10 | S7 | O8 | 107.2° | 106.4° |
| S7 | N10 | H1 | 109.5° | 120.0° |
| S7 | N10 | H2 | 109.5° | 120.0° |
| O9 | S7 | O8 | 109.5° | 123.1° |
| H1 | N10 | H2 | 109.5° | 120.0° |
| H3 | C15 | H4 | 109.4° | 109.5° |
| H5 | C18 | H6 | 109.5° | 109.4° |
| H10 | C28 | H11 | 109.4° | 109.5° |
| H12 | C27 | H13 | 109.5° | 109.4° |
| H14 | C26 | H15 | 109.4° | 109.5° |
| H16 | C25 | H17 | 109.5° | 109.5° |
| H18 | C24 | H19 | 109.5° | 109.4° |
| H20 | C23 | H21 | 109.5° | 109.5° |
| H22 | C22 | H23 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O21 | C18 | C15 | H5 | 121.0° | 120.0° |
| O21 | C18 | C15 | H6 | 121.0° | 120.0° |
| O21 | C18 | C15 | S11 | 25.2° | 180.0° |
| O21 | C18 | C15 | H3 | 94.9° | 60.0° |
| O21 | C18 | C15 | H4 | 145.4° | 60.0° |
| O21 | C18 | H5 | H6 | 116.8° | 120.0° |
| C18 | C15 | S11 | H3 | 120.1° | 120.0° |
| C18 | C15 | S11 | H4 | 120.1° | 120.0° |
| C18 | C15 | S11 | O17 | 56.7° | 67.8° |
| C18 | C15 | S11 | C1 | 64.3° | 179.4° |
| C18 | C15 | S11 | O16 | 174.2° | 69.0° |
| C18 | C15 | H3 | H4 | 119.5° | 119.9° |
| C15 | C18 | H5 | H6 | 116.7° | 120.0° |
| C15 | C18 | O21 | H7 | 180.0° | 180.0° |
| C15 | S11 | O17 | C1 | 123.2° | 111.7° |
| C15 | S11 | O17 | O16 | 123.5° | 131.5° |
| C15 | S11 | C1 | O16 | 126.4° | 116.0° |
| C15 | S11 | C1 | C6 | 120.7° | 75.4° |
| C15 | S11 | C1 | C2 | 59.7° | 105.2° |
| S11 | C15 | H3 | H4 | 119.6° | 120.1° |
| S11 | C15 | C18 | H5 | 146.3° | 60.0° |
| S11 | C15 | C18 | H6 | 95.8° | 60.0° |
| O17 | S11 | C1 | O16 | 112.7° | 127.9° |
| O17 | S11 | C1 | C6 | 0.2° | 40.6° |
| O17 | S11 | C1 | C2 | 179.4° | 138.8° |
| O17 | S11 | C15 | H3 | 176.8° | 52.2° |
| O17 | S11 | C15 | H4 | 63.5° | 172.2° |
| C23 | C22 | C14 | H22 | 120.5° | 120.0° |
| C23 | C22 | C14 | H23 | 120.5° | 120.0° |
| C22 | C23 | C24 | H20 | 119.5° | 120.0° |
| C22 | C23 | C24 | H21 | 119.5° | 120.0° |
| C23 | C22 | C14 | N19 | 174.8° | 164.1° |
| C22 | C23 | C24 | C25 | 75.6° | 113.0° |
| C23 | C22 | C14 | C28 | 61.6° | 76.0° |
| C23 | C22 | C14 | H9 | 58.4° | 44.1° |
| C22 | C23 | C24 | H18 | 44.8° | 7.1° |
| C22 | C23 | C24 | H19 | 164.0° | 127.0° |
| C22 | C23 | H20 | H21 | 121.4° | 120.0° |
| C23 | C22 | H22 | H23 | 118.6° | 120.0° |
| C14 | C22 | C23 | C24 | 108.9° | 44.0° |
| C22 | C14 | N19 | C28 | 127.0° | 120.0° |
| C22 | C14 | N19 | H9 | 115.6° | 120.0° |
| C22 | C14 | N19 | C6 | 159.0° | 85.0° |
| C22 | C14 | C28 | H9 | 120.1° | 120.0° |
| C22 | C14 | C28 | C27 | 56.9° | 76.0° |
| C22 | C14 | N19 | H8 | 79.5° | 38.9° |
| C22 | C14 | C28 | H10 | 63.8° | 164.1° |
| C22 | C14 | C28 | H11 | 177.6° | 44.1° |
| C14 | C22 | C23 | H20 | 131.5° | 164.0° |
| C14 | C22 | C23 | H21 | 10.6° | 76.0° |
| C14 | C22 | H22 | H23 | 118.6° | 120.0° |
| C23 | C24 | C25 | H18 | 120.3° | 120.0° |
| C23 | C24 | C25 | H19 | 120.3° | 120.0° |
| C23 | C24 | C25 | C26 | 86.4° | 76.0° |
| C23 | C24 | C25 | H16 | 153.0° | 164.1° |
| C23 | C24 | C25 | H17 | 34.1° | 44.0° |
| C23 | C24 | H18 | H19 | 118.9° | 120.0° |
| C24 | C23 | H20 | H21 | 121.4° | 119.9° |
| C24 | C23 | C22 | H22 | 130.6° | 164.0° |
| C24 | C23 | C22 | H23 | 11.5° | 76.0° |
| C14 | N19 | C6 | H8 | 121.5° | 123.9° |
| N19 | C14 | C28 | H9 | 118.2° | 120.0° |
| C14 | N19 | C6 | C1 | 120.7° | 118.0° |
| C14 | N19 | C6 | C5 | 60.4° | 62.6° |
| N19 | C14 | C28 | C27 | 64.8° | 164.0° |
| N19 | C14 | C28 | H10 | 174.4° | 44.1° |
| N19 | C14 | C28 | H11 | 55.8° | 75.9° |
| N19 | C14 | C22 | H22 | 54.3° | 75.9° |
| N19 | C14 | C22 | H23 | 64.7° | 44.1° |
| N19 | C6 | C1 | S11 | 1.7° | 0.6° |
| C6 | N19 | C14 | C28 | 31.9° | 155.0° |
| N19 | C6 | C1 | C5 | 178.9° | 179.4° |
| N19 | C6 | C1 | C2 | 178.8° | 180.0° |
| N19 | C6 | C5 | F20 | 0.7° | 0.3° |
| N19 | C6 | C5 | C4 | 178.1° | 179.9° |
| C6 | N19 | C14 | H9 | 85.4° | 35.0° |
| C24 | C25 | C26 | H16 | 120.5° | 120.0° |
| C24 | C25 | C26 | H17 | 120.5° | 120.0° |
| C24 | C25 | C26 | C27 | 100.2° | 76.0° |
| C24 | C25 | C26 | H14 | 21.3° | 44.0° |
| C24 | C25 | C26 | H15 | 138.4° | 164.0° |
| C24 | C25 | H16 | H17 | 118.4° | 120.1° |
| C25 | C24 | H18 | H19 | 119.0° | 120.0° |
| C25 | C24 | C23 | H20 | 164.9° | 127.0° |
| C25 | C24 | C23 | H21 | 43.9° | 7.0° |
| S11 | C1 | C6 | C2 | 179.6° | 179.4° |
| S11 | C1 | C6 | C5 | 179.4° | 180.0° |
| S11 | C1 | C2 | F13 | 0.0° | 0.3° |
| S11 | C1 | C2 | C3 | 179.9° | 179.8° |
| C1 | S11 | C15 | H3 | 55.9° | 59.4° |
| C1 | S11 | C15 | H4 | 175.6° | 60.6° |
| O16 | S11 | C1 | C6 | 112.9° | 168.6° |
| O16 | S11 | C1 | C2 | 66.7° | 10.9° |
| O16 | S11 | C15 | H3 | 65.7° | 171.0° |
| O16 | S11 | C15 | H4 | 54.0° | 51.0° |
| C14 | C28 | C27 | C26 | 80.9° | 44.0° |
| C14 | C28 | C27 | H10 | 120.7° | 119.9° |
| C14 | C28 | C27 | H11 | 120.7° | 120.0° |
| C28 | C14 | N19 | H8 | 153.5° | 81.1° |
| C14 | C28 | H10 | H11 | 117.9° | 120.0° |
| C14 | C28 | C27 | H12 | 39.5° | 164.1° |
| C14 | C28 | C27 | H13 | 158.6° | 76.0° |
| C28 | C14 | C22 | H22 | 177.9° | 44.0° |
| C28 | C14 | C22 | H23 | 58.9° | 164.1° |
| C1 | C6 | C5 | F20 | 178.3° | 179.7° |
| C1 | C6 | C5 | C4 | 0.8° | 0.5° |
| C6 | C1 | C2 | F13 | 179.7° | 179.7° |
| C6 | C1 | C2 | C3 | 0.4° | 0.3° |
| C1 | C6 | N19 | H8 | 117.8° | 6.0° |
| C5 | C6 | C1 | C2 | 0.2° | 0.6° |
| C6 | C5 | F20 | C4 | 177.5° | 179.8° |
| C6 | C5 | C4 | C3 | 0.9° | 0.2° |
| C6 | C5 | C4 | S7 | 177.1° | 179.7° |
| C5 | C6 | N19 | H8 | 61.2° | 173.5° |
| C1 | C2 | F13 | C3 | 179.9° | 180.0° |
| C1 | C2 | C3 | C4 | 0.4° | 0.0° |
| C1 | C2 | C3 | F12 | 176.0° | 180.0° |
| F20 | C5 | C4 | C3 | 178.3° | 180.0° |
| F20 | C5 | C4 | S7 | 5.5° | 0.1° |
| C25 | C26 | C27 | H14 | 121.4° | 120.0° |
| C25 | C26 | C27 | H15 | 121.4° | 120.0° |
| C25 | C26 | C27 | C28 | 17.5° | 112.9° |
| C25 | C26 | C27 | H12 | 137.9° | 127.0° |
| C25 | C26 | C27 | H13 | 103.0° | 7.1° |
| C25 | C26 | H14 | H15 | 115.5° | 120.0° |
| C26 | C25 | H16 | H17 | 118.4° | 120.0° |
| C26 | C25 | C24 | H18 | 33.9° | 44.1° |
| C26 | C25 | C24 | H19 | 153.2° | 164.0° |
| C5 | C4 | C3 | C2 | 0.3° | 0.0° |
| C5 | C4 | C3 | S7 | 176.5° | 179.9° |
| C5 | C4 | C3 | F12 | 176.6° | 180.0° |
| C5 | C4 | S7 | N10 | 115.4° | 90.0° |
| C5 | C4 | S7 | O9 | 10.8° | 23.6° |
| C5 | C4 | S7 | O8 | 129.8° | 156.5° |
| C26 | C27 | C28 | H12 | 120.4° | 120.1° |
| C26 | C27 | C28 | H13 | 120.4° | 120.0° |
| C26 | C27 | C28 | H10 | 39.8° | 75.9° |
| C26 | C27 | C28 | H11 | 158.4° | 164.0° |
| C26 | C27 | H12 | H13 | 118.7° | 119.9° |
| C27 | C26 | H14 | H15 | 115.5° | 120.0° |
| C27 | C26 | C25 | H16 | 139.3° | 164.1° |
| C27 | C26 | C25 | H17 | 20.4° | 44.1° |
| C27 | C28 | C14 | H9 | 177.0° | 44.0° |
| C27 | C28 | H10 | H11 | 117.9° | 120.1° |
| C28 | C27 | H12 | H13 | 118.7° | 120.0° |
| C28 | C27 | C26 | H14 | 104.0° | 7.1° |
| C28 | C27 | C26 | H15 | 138.9° | 127.1° |
| F13 | C2 | C3 | C4 | 179.7° | 180.0° |
| F13 | C2 | C3 | F12 | 3.9° | 0.0° |
| C2 | C3 | C4 | F12 | 176.3° | 180.0° |
| C2 | C3 | C4 | S7 | 176.7° | 179.9° |
| C3 | C4 | S7 | N10 | 68.4° | 90.0° |
| C3 | C4 | S7 | O9 | 165.4° | 156.5° |
| C3 | C4 | S7 | O8 | 46.4° | 23.6° |
| S7 | C4 | C3 | F12 | 6.9° | 0.0° |
| C4 | S7 | N10 | O9 | 129.6° | 113.5° |
| C4 | S7 | N10 | O8 | 111.9° | 113.6° |
| C4 | S7 | O9 | O8 | 115.0° | 122.9° |
| C4 | S7 | N10 | H1 | 180.0° | 150.0° |
| C4 | S7 | N10 | H2 | 60.0° | 30.0° |
| N10 | S7 | O9 | O8 | 117.1° | 123.0° |
| S7 | N10 | H1 | H2 | 120.0° | 180.0° |
| O9 | S7 | N10 | H1 | 50.4° | 96.5° |
| O9 | S7 | N10 | H2 | 69.6° | 83.5° |
| O8 | S7 | N10 | H1 | 68.1° | 36.4° |
| O8 | S7 | N10 | H2 | 171.9° | 143.6° |
| H3 | C15 | C18 | H5 | 26.1° | 180.0° |
| H3 | C15 | C18 | H6 | 144.0° | 60.1° |
| H4 | C15 | C18 | H5 | 93.6° | 60.1° |
| H4 | C15 | C18 | H6 | 24.3° | 180.0° |
| H5 | C18 | O21 | H7 | 59.0° | 60.0° |
| H6 | C18 | O21 | H7 | 59.0° | 60.0° |
| H8 | N19 | C14 | H9 | 36.1° | 158.9° |
| H9 | C14 | C28 | H10 | 56.3° | 75.9° |
| H9 | C14 | C28 | H11 | 62.3° | 164.0° |
| H9 | C14 | C22 | H22 | 62.1° | 164.1° |
| H9 | C14 | C22 | H23 | 178.9° | 75.9° |
| H10 | C28 | C27 | H12 | 160.2° | 44.1° |
| H10 | C28 | C27 | H13 | 80.7° | 164.0° |
| H11 | C28 | C27 | H12 | 81.2° | 76.0° |
| H11 | C28 | C27 | H13 | 37.9° | 44.0° |
| H12 | C27 | C26 | H14 | 16.5° | 113.0° |
| H12 | C27 | C26 | H15 | 100.7° | 7.0° |
| H13 | C27 | C26 | H14 | 135.6° | 127.1° |
| H13 | C27 | C26 | H15 | 18.5° | 112.9° |
| H14 | C26 | C25 | H16 | 99.3° | 76.0° |
| H14 | C26 | C25 | H17 | 141.8° | 164.0° |
| H15 | C26 | C25 | H16 | 17.9° | 44.1° |
| H15 | C26 | C25 | H17 | 101.1° | 76.0° |
| H16 | C25 | C24 | H18 | 86.6° | 75.9° |
| H16 | C25 | C24 | H19 | 32.7° | 44.1° |
| H17 | C25 | C24 | H18 | 154.4° | 164.0° |
| H17 | C25 | C24 | H19 | 86.3° | 76.0° |
| H18 | C24 | C23 | H20 | 74.8° | 112.9° |
| H18 | C24 | C23 | H21 | 164.3° | 127.1° |
| H19 | C24 | C23 | H20 | 44.5° | 7.0° |
| H19 | C24 | C23 | H21 | 76.4° | 113.0° |
| H20 | C23 | C22 | H22 | 11.1° | 76.0° |
| H20 | C23 | C22 | H23 | 108.0° | 44.0° |
| H21 | C23 | C22 | H22 | 109.9° | 44.0° |
| H21 | C23 | C22 | H23 | 131.1° | 164.0° |
