FV3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C18 | sing | 1.51Å | 1.50Å | |
| C11 | C9 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.51Å | 1.51Å | |
| C18 | C20 | sing | 1.51Å | 1.50Å | |
| C18 | C17 | doub | 1.31Å | 1.34Å | |
| C14 | C13 | sing | 1.51Å | 1.50Å | |
| C9 | C8 | sing | 1.51Å | 1.51Å | |
| C17 | C16 | sing | 1.51Å | 1.51Å | |
| C12 | C13 | doub | 1.31Å | 1.34Å | |
| C13 | C15 | sing | 1.51Å | 1.51Å | |
| C7 | C8 | doub | 1.31Å | 1.34Å | |
| C7 | C6 | sing | 1.51Å | 1.51Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C8 | C10 | sing | 1.51Å | 1.50Å | |
| C3 | O5 | sing | 1.43Å | 1.42Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C6 | O5 | sing | 1.43Å | 1.42Å | |
| O6 | C2 | sing | 1.43Å | 1.43Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C1 | O1 | sing | 1.43Å | 1.43Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| O6 | H5 | sing | 0.97Å | 0.95Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.08Å | 1.08Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.08Å | 1.08Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.08Å | 1.08Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C19 | H31 | sing | 1.09Å | 1.10Å | |
| C19 | H32 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C18 | C20 | 120.0° | 120.0° |
| C19 | C18 | C17 | 119.1° | 120.0° |
| C18 | C19 | H30 | 109.5° | 109.5° |
| C18 | C19 | H31 | 109.5° | 109.5° |
| C18 | C19 | H32 | 109.5° | 109.5° |
| C9 | C11 | C12 | 108.6° | 109.5° |
| C11 | C9 | C8 | 108.0° | 109.5° |
| C11 | C9 | H14 | 109.8° | 109.5° |
| C11 | C9 | H15 | 109.8° | 109.5° |
| C9 | C11 | H16 | 109.7° | 109.5° |
| C9 | C11 | H17 | 109.7° | 109.5° |
| C11 | C12 | C13 | 120.6° | 120.0° |
| C12 | C11 | H16 | 109.7° | 109.5° |
| C12 | C11 | H17 | 109.7° | 109.5° |
| C11 | C12 | H18 | 119.7° | 120.1° |
| C20 | C18 | C17 | 120.9° | 120.0° |
| C18 | C20 | H27 | 109.5° | 109.4° |
| C18 | C20 | H28 | 109.5° | 109.5° |
| C18 | C20 | H29 | 109.5° | 109.5° |
| C18 | C17 | C16 | 121.7° | 120.0° |
| C18 | C17 | H26 | 119.2° | 120.0° |
| C14 | C13 | C12 | 120.0° | 120.0° |
| C14 | C13 | C15 | 120.1° | 120.0° |
| C13 | C14 | H19 | 109.5° | 109.5° |
| C13 | C14 | H20 | 109.5° | 109.5° |
| C13 | C14 | H21 | 109.5° | 109.5° |
| C9 | C8 | C7 | 119.0° | 120.0° |
| C9 | C8 | C10 | 120.1° | 120.0° |
| C8 | C9 | H14 | 109.9° | 109.4° |
| C8 | C9 | H15 | 109.8° | 109.5° |
| C17 | C16 | C15 | 110.2° | 109.5° |
| C17 | C16 | H24 | 109.3° | 109.5° |
| C17 | C16 | H25 | 109.3° | 109.4° |
| C16 | C17 | H26 | 119.1° | 120.0° |
| C12 | C13 | C15 | 119.8° | 120.0° |
| C13 | C12 | H18 | 119.7° | 119.9° |
| C13 | C15 | C16 | 110.7° | 109.5° |
| C13 | C15 | H22 | 109.2° | 109.4° |
| C13 | C15 | H23 | 109.2° | 109.4° |
| C8 | C7 | C6 | 120.7° | 120.0° |
| C7 | C8 | C10 | 120.9° | 120.0° |
| C8 | C7 | H10 | 119.6° | 120.0° |
| C7 | C6 | O5 | 109.1° | 109.5° |
| C7 | C6 | H8 | 109.6° | 109.4° |
| C7 | C6 | H9 | 109.6° | 109.4° |
| C6 | C7 | H10 | 119.7° | 120.0° |
| C16 | C15 | H22 | 109.2° | 109.5° |
| C16 | C15 | H23 | 109.2° | 109.4° |
| C15 | C16 | H24 | 109.3° | 109.5° |
| C15 | C16 | H25 | 109.3° | 109.4° |
| C8 | C10 | H11 | 109.5° | 109.5° |
| C8 | C10 | H12 | 109.5° | 109.4° |
| C8 | C10 | H13 | 109.5° | 109.5° |
| O5 | C3 | C2 | 110.1° | 109.5° |
| C3 | O5 | C6 | 112.5° | 114.0° |
| O5 | C3 | H6 | 109.3° | 109.5° |
| O5 | C3 | H7 | 109.3° | 109.5° |
| C3 | C2 | O6 | 109.2° | 109.5° |
| C3 | C2 | C1 | 109.4° | 109.5° |
| C3 | C2 | H4 | 109.1° | 109.5° |
| C2 | C3 | H6 | 109.3° | 109.5° |
| C2 | C3 | H7 | 109.3° | 109.5° |
| O5 | C6 | H8 | 109.6° | 109.5° |
| O5 | C6 | H9 | 109.6° | 109.5° |
| O6 | C2 | C1 | 109.6° | 109.4° |
| O6 | C2 | H4 | 110.4° | 109.5° |
| C2 | O6 | H5 | 109.5° | 114.0° |
| C2 | C1 | O1 | 108.3° | 109.5° |
| C2 | C1 | H2 | 109.8° | 109.4° |
| C2 | C1 | H3 | 109.8° | 109.5° |
| C1 | C2 | H4 | 109.1° | 109.4° |
| C1 | O1 | H1 | 109.5° | 114.0° |
| O1 | C1 | H2 | 109.8° | 109.4° |
| O1 | C1 | H3 | 109.7° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H6 | C3 | H7 | 109.5° | 109.5° |
| H8 | C6 | H9 | 109.4° | 109.5° |
| H11 | C10 | H12 | 109.4° | 109.5° |
| H11 | C10 | H13 | 109.4° | 109.5° |
| H12 | C10 | H13 | 109.5° | 109.5° |
| H14 | C9 | H15 | 109.5° | 109.5° |
| H16 | C11 | H17 | 109.5° | 109.5° |
| H19 | C14 | H20 | 109.5° | 109.4° |
| H19 | C14 | H21 | 109.4° | 109.5° |
| H20 | C14 | H21 | 109.4° | 109.5° |
| H22 | C15 | H23 | 109.4° | 109.5° |
| H24 | C16 | H25 | 109.5° | 109.5° |
| H27 | C20 | H28 | 109.5° | 109.5° |
| H27 | C20 | H29 | 109.4° | 109.5° |
| H28 | C20 | H29 | 109.5° | 109.5° |
| H30 | C19 | H31 | 109.5° | 109.5° |
| H30 | C19 | H32 | 109.5° | 109.4° |
| H31 | C19 | H32 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C18 | C20 | C17 | 180.0° | 180.0° |
| C19 | C18 | C17 | C16 | 179.7° | 175.7° |
| C19 | C18 | C17 | H26 | 0.3° | 4.4° |
| C19 | C18 | C20 | H27 | 180.0° | 95.0° |
| C19 | C18 | C20 | H28 | 60.0° | 25.0° |
| C19 | C18 | C20 | H29 | 60.0° | 145.0° |
| C18 | C19 | H30 | H31 | 120.0° | 120.0° |
| C18 | C19 | H30 | H32 | 120.0° | 120.0° |
| C18 | C19 | H31 | H32 | 120.0° | 120.0° |
| C9 | C11 | C12 | H16 | 119.9° | 120.0° |
| C9 | C11 | C12 | H17 | 119.8° | 120.0° |
| C11 | C9 | C8 | H14 | 119.8° | 120.0° |
| C11 | C9 | C8 | H15 | 119.8° | 120.0° |
| C9 | C11 | C12 | C13 | 130.6° | 121.1° |
| C11 | C9 | C8 | C7 | 83.8° | 95.0° |
| C11 | C9 | C8 | C10 | 95.7° | 85.0° |
| C11 | C9 | H14 | H15 | 120.6° | 120.0° |
| C9 | C11 | H16 | H17 | 120.4° | 120.0° |
| C9 | C11 | C12 | H18 | 49.4° | 58.9° |
| C11 | C12 | C13 | C14 | 0.1° | 6.7° |
| C12 | C11 | C9 | C8 | 60.4° | 180.0° |
| C11 | C12 | C13 | H18 | 180.0° | 179.9° |
| C11 | C12 | C13 | C15 | 179.9° | 173.4° |
| C12 | C11 | C9 | H14 | 59.4° | 60.0° |
| C12 | C11 | C9 | H15 | 179.8° | 60.0° |
| C12 | C11 | H16 | H17 | 120.4° | 120.0° |
| C20 | C18 | C17 | C16 | 0.3° | 4.3° |
| C20 | C18 | C17 | H26 | 179.7° | 175.7° |
| C18 | C20 | H27 | H28 | 120.0° | 120.0° |
| C18 | C20 | H27 | H29 | 120.0° | 120.0° |
| C18 | C20 | H28 | H29 | 120.0° | 120.0° |
| C20 | C18 | C19 | H30 | 180.0° | 90.0° |
| C20 | C18 | C19 | H31 | 60.0° | 150.0° |
| C20 | C18 | C19 | H32 | 60.0° | 30.0° |
| C18 | C17 | C16 | H26 | 180.0° | 179.9° |
| C18 | C17 | C16 | C15 | 165.4° | 119.7° |
| C18 | C17 | C16 | H24 | 74.5° | 0.3° |
| C18 | C17 | C16 | H25 | 45.2° | 120.4° |
| C17 | C18 | C20 | H27 | 0.0° | 84.9° |
| C17 | C18 | C20 | H28 | 120.1° | 155.1° |
| C17 | C18 | C20 | H29 | 120.0° | 35.1° |
| C17 | C18 | C19 | H30 | 0.0° | 90.0° |
| C17 | C18 | C19 | H31 | 120.0° | 30.0° |
| C17 | C18 | C19 | H32 | 120.0° | 150.0° |
| C14 | C13 | C12 | C15 | 179.8° | 179.9° |
| C14 | C13 | C15 | C16 | 62.0° | 85.0° |
| C14 | C13 | C12 | H18 | 180.0° | 173.4° |
| C13 | C14 | H19 | H20 | 120.0° | 120.0° |
| C13 | C14 | H19 | H21 | 120.0° | 120.0° |
| C13 | C14 | H20 | H21 | 120.0° | 120.1° |
| C14 | C13 | C15 | H22 | 177.8° | 35.1° |
| C14 | C13 | C15 | H23 | 58.2° | 155.0° |
| C9 | C8 | C7 | C10 | 179.5° | 180.0° |
| C9 | C8 | C7 | C6 | 179.9° | 173.3° |
| C9 | C8 | C7 | H10 | 0.1° | 6.7° |
| C9 | C8 | C10 | H11 | 180.0° | 95.4° |
| C9 | C8 | C10 | H12 | 60.0° | 24.6° |
| C9 | C8 | C10 | H13 | 60.0° | 144.6° |
| C8 | C9 | H14 | H15 | 120.7° | 120.0° |
| C8 | C9 | C11 | H16 | 59.4° | 60.0° |
| C8 | C9 | C11 | H17 | 179.7° | 60.0° |
| C17 | C16 | C15 | C13 | 68.9° | 180.0° |
| C17 | C16 | C15 | H24 | 120.1° | 120.1° |
| C17 | C16 | C15 | H25 | 120.1° | 119.9° |
| C17 | C16 | C15 | H22 | 51.3° | 60.0° |
| C17 | C16 | C15 | H23 | 170.9° | 60.0° |
| C17 | C16 | H24 | H25 | 119.6° | 120.0° |
| C12 | C13 | C15 | C16 | 117.8° | 94.9° |
| C13 | C12 | C11 | H16 | 10.7° | 1.1° |
| C13 | C12 | C11 | H17 | 109.6° | 118.9° |
| C12 | C13 | C14 | H19 | 180.0° | 85.5° |
| C12 | C13 | C14 | H20 | 60.0° | 154.6° |
| C12 | C13 | C14 | H21 | 60.0° | 34.5° |
| C12 | C13 | C15 | H22 | 2.4° | 145.0° |
| C12 | C13 | C15 | H23 | 122.0° | 25.0° |
| C13 | C15 | C16 | H22 | 120.2° | 120.0° |
| C13 | C15 | C16 | H23 | 120.2° | 120.0° |
| C15 | C13 | C12 | H18 | 0.2° | 6.5° |
| C15 | C13 | C14 | H19 | 0.2° | 94.6° |
| C15 | C13 | C14 | H20 | 120.2° | 25.4° |
| C15 | C13 | C14 | H21 | 119.8° | 145.4° |
| C13 | C15 | H22 | H23 | 119.5° | 120.0° |
| C13 | C15 | C16 | H24 | 51.2° | 59.9° |
| C13 | C15 | C16 | H25 | 171.0° | 60.1° |
| C8 | C7 | C6 | H10 | 180.0° | 180.0° |
| C8 | C7 | C6 | O5 | 115.3° | 132.4° |
| C8 | C7 | C6 | H8 | 124.7° | 107.6° |
| C8 | C7 | C6 | H9 | 4.7° | 12.4° |
| C7 | C8 | C10 | H11 | 0.5° | 84.6° |
| C7 | C8 | C10 | H12 | 119.5° | 155.4° |
| C7 | C8 | C10 | H13 | 120.5° | 35.4° |
| C7 | C8 | C9 | H14 | 156.4° | 145.0° |
| C7 | C8 | C9 | H15 | 36.0° | 25.0° |
| C6 | C7 | C8 | C10 | 0.3° | 6.7° |
| C7 | C6 | O5 | C3 | 111.8° | 180.0° |
| C7 | C6 | O5 | H8 | 120.0° | 120.0° |
| C7 | C6 | O5 | H9 | 120.0° | 120.0° |
| C7 | C6 | H8 | H9 | 120.2° | 120.0° |
| C16 | C15 | H22 | H23 | 119.4° | 120.0° |
| C15 | C16 | H24 | H25 | 119.7° | 120.0° |
| C15 | C16 | C17 | H26 | 14.6° | 60.3° |
| C10 | C8 | C7 | H10 | 179.7° | 173.3° |
| C8 | C10 | H11 | H12 | 120.0° | 120.0° |
| C8 | C10 | H11 | H13 | 120.0° | 120.0° |
| C8 | C10 | H12 | H13 | 120.0° | 120.0° |
| C10 | C8 | C9 | H14 | 24.0° | 35.0° |
| C10 | C8 | C9 | H15 | 144.5° | 155.0° |
| O5 | C3 | C2 | H6 | 120.1° | 120.0° |
| O5 | C3 | C2 | H7 | 120.1° | 120.0° |
| O5 | C3 | C2 | O6 | 176.7° | 65.0° |
| O5 | C3 | C2 | C1 | 56.8° | 175.0° |
| O5 | C3 | C2 | H4 | 62.5° | 55.0° |
| O5 | C3 | H6 | H7 | 119.8° | 120.0° |
| C3 | O5 | C6 | H8 | 8.1° | 60.1° |
| C3 | O5 | C6 | H9 | 128.2° | 60.0° |
| C2 | C3 | O5 | C6 | 123.4° | 180.0° |
| C3 | C2 | O6 | C1 | 119.8° | 120.0° |
| C3 | C2 | O6 | H4 | 120.0° | 120.1° |
| C3 | C2 | C1 | H4 | 119.3° | 120.0° |
| C3 | C2 | C1 | O1 | 137.6° | 175.0° |
| C3 | C2 | C1 | H2 | 102.6° | 55.0° |
| C3 | C2 | C1 | H3 | 17.8° | 65.0° |
| C3 | C2 | O6 | H5 | 180.0° | 60.0° |
| C2 | C3 | H6 | H7 | 119.7° | 120.0° |
| C6 | O5 | C3 | H6 | 116.5° | 60.0° |
| C6 | O5 | C3 | H7 | 3.3° | 60.0° |
| O5 | C6 | H8 | H9 | 120.1° | 120.0° |
| O5 | C6 | C7 | H10 | 64.7° | 47.7° |
| O6 | C2 | C1 | H4 | 121.0° | 120.0° |
| O6 | C2 | C1 | O1 | 102.8° | 65.0° |
| O6 | C2 | C1 | H2 | 17.0° | 175.0° |
| O6 | C2 | C1 | H3 | 137.4° | 55.0° |
| O6 | C2 | C3 | H6 | 63.2° | 175.0° |
| O6 | C2 | C3 | H7 | 56.6° | 55.0° |
| C2 | C1 | O1 | H2 | 119.8° | 120.0° |
| C2 | C1 | O1 | H3 | 119.8° | 120.1° |
| C2 | C1 | O1 | H1 | 180.0° | 180.0° |
| C2 | C1 | H2 | H3 | 120.6° | 120.0° |
| C1 | C2 | O6 | H5 | 60.2° | 60.0° |
| C1 | C2 | C3 | H6 | 176.9° | 55.0° |
| C1 | C2 | C3 | H7 | 63.3° | 65.0° |
| O1 | C1 | H2 | H3 | 120.5° | 120.0° |
| O1 | C1 | C2 | H4 | 18.2° | 54.9° |
| H1 | O1 | C1 | H2 | 60.2° | 60.0° |
| H1 | O1 | C1 | H3 | 60.2° | 59.9° |
| H2 | C1 | C2 | H4 | 138.1° | 65.0° |
| H3 | C1 | C2 | H4 | 101.5° | 175.0° |
| H4 | C2 | O6 | H5 | 60.0° | 179.9° |
| H4 | C2 | C3 | H6 | 57.6° | 65.0° |
| H4 | C2 | C3 | H7 | 177.4° | 175.0° |
| H8 | C6 | C7 | H10 | 55.2° | 72.3° |
| H9 | C6 | C7 | H10 | 175.3° | 167.7° |
| H11 | C10 | H12 | H13 | 120.0° | 120.0° |
| H14 | C9 | C11 | H16 | 179.2° | 180.0° |
| H14 | C9 | C11 | H17 | 60.5° | 60.0° |
| H15 | C9 | C11 | H16 | 60.3° | 60.0° |
| H15 | C9 | C11 | H17 | 60.0° | 180.0° |
| H16 | C11 | C12 | H18 | 169.3° | 178.9° |
| H17 | C11 | C12 | H18 | 70.4° | 61.1° |
| H19 | C14 | H20 | H21 | 120.0° | 120.0° |
| H22 | C15 | C16 | H24 | 171.4° | 180.0° |
| H22 | C15 | C16 | H25 | 68.8° | 60.0° |
| H23 | C15 | C16 | H24 | 69.0° | 60.0° |
| H23 | C15 | C16 | H25 | 50.8° | 180.0° |
| H24 | C16 | C17 | H26 | 105.5° | 179.7° |
| H25 | C16 | C17 | H26 | 134.8° | 59.7° |
| H27 | C20 | H28 | H29 | 120.0° | 120.1° |
| H30 | C19 | H31 | H32 | 120.0° | 119.9° |
