PRD_000239
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | doub | 1.21Å | 1.24Å | |
| C1 | C2 | sing | 1.51Å | 1.53Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| N1 | C3 | sing | 1.47Å | 1.44Å | |
| N1 | H4 | sing | 0.97Å | 1.00Å | |
| C3 | C4 | sing | 1.51Å | 1.51Å | |
| C3 | C5 | sing | 1.53Å | 1.53Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | O2 | doub | 1.21Å | 1.23Å | |
| C5 | C6 | sing | 1.51Å | 1.50Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | O3 | doub | 1.21Å | 1.24Å | |
| C6 | O4 | sing | 1.34Å | 1.24Å | |
| O4 | H8 | sing | 0.97Å | 0.95Å | |
| N2 | C7 | sing | 1.47Å | 1.45Å | |
| N2 | H9 | sing | 0.97Å | 1.00Å | |
| C7 | C8 | sing | 1.51Å | 1.54Å | |
| C7 | C9 | sing | 1.53Å | 1.53Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | O5 | doub | 1.21Å | 1.23Å | |
| C9 | C10 | sing | 1.53Å | 1.48Å | |
| C9 | C11 | sing | 1.53Å | 1.50Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| N3 | C12 | sing | 1.47Å | 1.45Å | |
| N3 | H18 | sing | 0.97Å | 1.00Å | |
| C12 | C13 | sing | 1.51Å | 1.52Å | |
| C12 | C14 | sing | 1.53Å | 1.50Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | O6 | doub | 1.21Å | 1.22Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| N4 | C15 | sing | 1.46Å | 1.45Å | |
| N4 | H23 | sing | 0.97Å | 1.00Å | |
| C15 | C16 | sing | 1.51Å | 1.52Å | |
| C15 | C17 | sing | 1.53Å | 1.53Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | O7 | doub | 1.21Å | 1.25Å | |
| C17 | C18 | sing | 1.51Å | 1.53Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | O8 | doub | 1.21Å | 1.26Å | |
| C18 | O9 | sing | 1.34Å | 1.26Å | |
| O9 | H27 | sing | 0.97Å | 0.95Å | |
| C19 | F1 | sing | 1.40Å | 44.40Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C1 | N1 | sing | 1.35Å | 1.33Å | |
| C16 | C19 | sing | 1.51Å | 1.51Å | |
| C4 | N2 | sing | 1.35Å | 1.33Å | |
| C8 | N3 | sing | 1.35Å | 1.33Å | |
| C13 | N4 | sing | 1.35Å | 1.32Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 121.6° | 120.0° |
| O1 | C1 | N1 | 123.0° | 120.0° |
| C1 | C2 | H1 | 109.5° | 109.5° |
| C1 | C2 | H2 | 109.5° | 109.5° |
| C1 | C2 | H3 | 109.5° | 109.5° |
| C2 | C1 | N1 | 115.5° | 120.0° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| H1 | C2 | H3 | 109.5° | 109.4° |
| H2 | C2 | H3 | 109.5° | 109.5° |
| C3 | N1 | H4 | 119.2° | 120.0° |
| N1 | C3 | C4 | 113.3° | 109.5° |
| N1 | C3 | C5 | 109.5° | 109.4° |
| N1 | C3 | H5 | 109.2° | 109.5° |
| C3 | N1 | C1 | 121.5° | 120.0° |
| H4 | N1 | C1 | 119.3° | 120.0° |
| C4 | C3 | C5 | 108.1° | 109.5° |
| C4 | C3 | H5 | 108.4° | 109.5° |
| C3 | C4 | O2 | 120.4° | 120.0° |
| C3 | C4 | N2 | 115.8° | 120.0° |
| C5 | C3 | H5 | 108.2° | 109.5° |
| C3 | C5 | C6 | 112.5° | 109.5° |
| C3 | C5 | H6 | 108.7° | 109.5° |
| C3 | C5 | H7 | 108.7° | 109.5° |
| O2 | C4 | N2 | 123.8° | 120.0° |
| C6 | C5 | H6 | 108.7° | 109.5° |
| C6 | C5 | H7 | 108.7° | 109.4° |
| C5 | C6 | O3 | 117.7° | 120.0° |
| C5 | C6 | O4 | 118.8° | 120.0° |
| H6 | C5 | H7 | 109.5° | 109.5° |
| O3 | C6 | O4 | 123.5° | 120.0° |
| C6 | O4 | H8 | 109.5° | 117.0° |
| C7 | N2 | H9 | 119.1° | 120.0° |
| N2 | C7 | C8 | 110.1° | 109.5° |
| N2 | C7 | C9 | 112.5° | 109.5° |
| N2 | C7 | H10 | 108.7° | 109.5° |
| C7 | N2 | C4 | 121.8° | 120.0° |
| H9 | N2 | C4 | 119.1° | 120.0° |
| C8 | C7 | C9 | 110.0° | 109.5° |
| C8 | C7 | H10 | 107.7° | 109.5° |
| C7 | C8 | O5 | 120.5° | 120.0° |
| C7 | C8 | N3 | 115.8° | 120.0° |
| C9 | C7 | H10 | 107.7° | 109.4° |
| C7 | C9 | C10 | 108.9° | 109.5° |
| C7 | C9 | C11 | 111.0° | 109.4° |
| C7 | C9 | H11 | 108.4° | 109.5° |
| O5 | C8 | N3 | 123.7° | 120.0° |
| C10 | C9 | C11 | 110.6° | 109.5° |
| C10 | C9 | H11 | 109.0° | 109.5° |
| C9 | C10 | H12 | 109.5° | 109.5° |
| C9 | C10 | H13 | 109.5° | 109.4° |
| C9 | C10 | H14 | 109.5° | 109.5° |
| C11 | C9 | H11 | 108.9° | 109.5° |
| C9 | C11 | H15 | 109.5° | 109.4° |
| C9 | C11 | H16 | 109.5° | 109.5° |
| C9 | C11 | H17 | 109.5° | 109.5° |
| H12 | C10 | H13 | 109.5° | 109.5° |
| H12 | C10 | H14 | 109.5° | 109.5° |
| H13 | C10 | H14 | 109.5° | 109.4° |
| H15 | C11 | H16 | 109.5° | 109.5° |
| H15 | C11 | H17 | 109.4° | 109.5° |
| H16 | C11 | H17 | 109.5° | 109.5° |
| C12 | N3 | H18 | 117.9° | 120.0° |
| N3 | C12 | C13 | 112.9° | 109.5° |
| N3 | C12 | C14 | 108.8° | 109.5° |
| N3 | C12 | H19 | 108.8° | 109.4° |
| C12 | N3 | C8 | 124.2° | 120.0° |
| H18 | N3 | C8 | 117.9° | 120.0° |
| C13 | C12 | C14 | 110.0° | 109.5° |
| C13 | C12 | H19 | 108.0° | 109.4° |
| C12 | C13 | O6 | 121.4° | 120.0° |
| C12 | C13 | N4 | 116.4° | 120.0° |
| C14 | C12 | H19 | 108.2° | 109.5° |
| C12 | C14 | H20 | 109.5° | 109.5° |
| C12 | C14 | H21 | 109.5° | 109.5° |
| C12 | C14 | H22 | 109.5° | 109.5° |
| O6 | C13 | N4 | 122.1° | 120.0° |
| H20 | C14 | H21 | 109.5° | 109.4° |
| H20 | C14 | H22 | 109.5° | 109.4° |
| H21 | C14 | H22 | 109.5° | 109.4° |
| C15 | N4 | H23 | 119.1° | 120.0° |
| N4 | C15 | C16 | 109.6° | 109.5° |
| N4 | C15 | C17 | 110.1° | 109.5° |
| N4 | C15 | H24 | 109.5° | 109.5° |
| C15 | N4 | C13 | 121.8° | 120.0° |
| H23 | N4 | C13 | 119.1° | 120.0° |
| C16 | C15 | C17 | 110.6° | 109.5° |
| C16 | C15 | H24 | 108.6° | 109.4° |
| C15 | C16 | O7 | 118.3° | 119.9° |
| C15 | C16 | C19 | 122.8° | 120.0° |
| C17 | C15 | H24 | 108.5° | 109.4° |
| C15 | C17 | C18 | 112.6° | 109.5° |
| C15 | C17 | H25 | 108.7° | 109.4° |
| C15 | C17 | H26 | 108.7° | 109.5° |
| O7 | C16 | C19 | 118.0° | 120.0° |
| C18 | C17 | H25 | 108.7° | 109.4° |
| C18 | C17 | H26 | 108.7° | 109.4° |
| C17 | C18 | O8 | 118.6° | 120.0° |
| C17 | C18 | O9 | 118.3° | 120.0° |
| H25 | C17 | H26 | 109.5° | 109.5° |
| O8 | C18 | O9 | 123.1° | 120.0° |
| C18 | O9 | H27 | 109.5° | 117.0° |
| F1 | C19 | H28 | 115.7° | 109.5° |
| F1 | C19 | H29 | 115.7° | 109.4° |
| F1 | C19 | C16 | 82.5° | 109.5° |
| H28 | C19 | H29 | 109.5° | 109.5° |
| H28 | C19 | C16 | 115.8° | 109.5° |
| H29 | C19 | C16 | 115.7° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | N1 | 179.9° | 179.7° |
| O1 | C1 | C2 | H1 | 0.0° | 0.0° |
| O1 | C1 | C2 | H2 | 120.0° | 120.0° |
| O1 | C1 | C2 | H3 | 120.0° | 120.0° |
| O1 | C1 | N1 | C3 | 0.5° | 4.9° |
| O1 | C1 | N1 | H4 | 179.4° | 175.0° |
| C1 | C2 | H1 | H2 | 120.0° | 120.0° |
| C1 | C2 | H1 | H3 | 120.0° | 120.0° |
| C1 | C2 | H2 | H3 | 120.0° | 120.0° |
| C2 | C1 | N1 | C3 | 179.5° | 174.8° |
| C2 | C1 | N1 | H4 | 0.5° | 5.3° |
| H1 | C2 | H2 | H3 | 120.0° | 119.9° |
| H1 | C2 | C1 | N1 | 180.0° | 179.7° |
| H2 | C2 | C1 | N1 | 59.9° | 59.7° |
| H3 | C2 | C1 | N1 | 60.1° | 60.3° |
| C3 | N1 | H4 | C1 | 180.0° | 179.9° |
| N1 | C3 | C4 | C5 | 121.6° | 120.0° |
| N1 | C3 | C4 | H5 | 121.4° | 120.0° |
| N1 | C3 | C5 | H5 | 118.9° | 120.0° |
| N1 | C3 | C4 | O2 | 54.1° | 0.0° |
| N1 | C3 | C5 | C6 | 64.0° | 64.2° |
| N1 | C3 | C5 | H6 | 56.5° | 55.9° |
| N1 | C3 | C5 | H7 | 175.6° | 175.9° |
| N1 | C3 | C4 | N2 | 126.2° | 180.0° |
| H4 | N1 | C3 | C4 | 82.3° | 94.4° |
| H4 | N1 | C3 | C5 | 38.6° | 25.6° |
| H4 | N1 | C3 | H5 | 156.8° | 145.6° |
| C4 | C3 | C5 | H5 | 117.1° | 120.0° |
| C3 | C4 | O2 | N2 | 179.7° | 180.0° |
| C4 | C3 | C5 | C6 | 172.1° | 175.9° |
| C4 | C3 | C5 | H6 | 67.5° | 64.1° |
| C4 | C3 | C5 | H7 | 51.6° | 55.9° |
| C3 | C4 | N2 | C7 | 176.6° | 180.0° |
| C3 | C4 | N2 | H9 | 3.4° | 0.1° |
| C4 | C3 | N1 | C1 | 97.7° | 85.7° |
| C5 | C3 | C4 | O2 | 67.5° | 120.0° |
| C3 | C5 | C6 | H6 | 120.4° | 120.0° |
| C3 | C5 | C6 | H7 | 120.4° | 120.0° |
| C3 | C5 | H6 | H7 | 118.6° | 120.0° |
| C3 | C5 | C6 | O3 | 57.4° | 5.8° |
| C3 | C5 | C6 | O4 | 122.8° | 174.2° |
| C5 | C3 | N1 | C1 | 141.5° | 154.3° |
| C5 | C3 | C4 | N2 | 112.2° | 60.0° |
| H5 | C3 | C4 | O2 | 175.5° | 120.0° |
| H5 | C3 | C5 | C6 | 54.9° | 55.8° |
| H5 | C3 | C5 | H6 | 175.4° | 175.9° |
| H5 | C3 | C5 | H7 | 65.5° | 64.1° |
| H5 | C3 | N1 | C1 | 23.2° | 34.3° |
| H5 | C3 | C4 | N2 | 4.8° | 60.0° |
| O2 | C4 | N2 | C7 | 3.1° | 0.0° |
| O2 | C4 | N2 | H9 | 176.9° | 179.9° |
| C6 | C5 | H6 | H7 | 118.6° | 120.0° |
| C5 | C6 | O3 | O4 | 179.8° | 180.0° |
| C5 | C6 | O4 | H8 | 179.8° | 180.0° |
| H6 | C5 | C6 | O3 | 177.9° | 125.8° |
| H6 | C5 | C6 | O4 | 2.4° | 54.2° |
| H7 | C5 | C6 | O3 | 63.0° | 114.2° |
| H7 | C5 | C6 | O4 | 116.8° | 65.8° |
| O3 | C6 | O4 | H8 | 0.0° | 0.0° |
| C7 | N2 | H9 | C4 | 180.0° | 179.9° |
| N2 | C7 | C8 | C9 | 124.5° | 120.0° |
| N2 | C7 | C8 | H10 | 118.3° | 120.0° |
| N2 | C7 | C9 | H10 | 119.7° | 120.0° |
| N2 | C7 | C8 | O5 | 23.5° | 17.8° |
| N2 | C7 | C9 | C10 | 63.7° | 64.7° |
| N2 | C7 | C9 | C11 | 58.3° | 55.3° |
| N2 | C7 | C9 | H11 | 177.8° | 175.3° |
| N2 | C7 | C8 | N3 | 155.9° | 162.3° |
| H9 | N2 | C7 | C8 | 58.0° | 25.0° |
| H9 | N2 | C7 | C9 | 65.1° | 95.1° |
| H9 | N2 | C7 | H10 | 175.7° | 145.0° |
| C8 | C7 | C9 | H10 | 117.1° | 120.0° |
| C7 | C8 | O5 | N3 | 179.4° | 179.9° |
| C8 | C7 | C9 | C10 | 173.2° | 175.3° |
| C8 | C7 | C9 | C11 | 64.8° | 64.8° |
| C8 | C7 | C9 | H11 | 54.7° | 55.2° |
| C7 | C8 | N3 | C12 | 178.7° | 175.0° |
| C7 | C8 | N3 | H18 | 1.3° | 4.9° |
| C8 | C7 | N2 | C4 | 122.0° | 154.9° |
| C9 | C7 | C8 | O5 | 101.0° | 102.3° |
| C7 | C9 | C10 | C11 | 122.2° | 120.0° |
| C7 | C9 | C10 | H11 | 118.1° | 120.0° |
| C7 | C9 | C11 | H11 | 119.3° | 120.0° |
| C7 | C9 | C10 | H12 | 180.0° | 67.8° |
| C7 | C9 | C10 | H13 | 60.0° | 172.1° |
| C7 | C9 | C10 | H14 | 60.0° | 52.2° |
| C7 | C9 | C11 | H15 | 180.0° | 60.0° |
| C7 | C9 | C11 | H16 | 60.0° | 180.0° |
| C7 | C9 | C11 | H17 | 60.0° | 60.0° |
| C9 | C7 | N2 | C4 | 114.9° | 85.0° |
| C9 | C7 | C8 | N3 | 79.6° | 77.6° |
| H10 | C7 | C8 | O5 | 141.9° | 137.8° |
| H10 | C7 | C9 | C10 | 56.0° | 55.3° |
| H10 | C7 | C9 | C11 | 178.0° | 175.3° |
| H10 | C7 | C9 | H11 | 62.4° | 64.8° |
| H10 | C7 | N2 | C4 | 4.3° | 35.0° |
| H10 | C7 | C8 | N3 | 37.6° | 42.3° |
| O5 | C8 | N3 | C12 | 0.7° | 5.1° |
| O5 | C8 | N3 | H18 | 179.3° | 175.0° |
| C10 | C9 | C11 | H11 | 119.8° | 120.0° |
| C9 | C10 | H12 | H13 | 120.0° | 120.0° |
| C9 | C10 | H12 | H14 | 120.0° | 120.0° |
| C9 | C10 | H13 | H14 | 120.0° | 120.0° |
| C10 | C9 | C11 | H15 | 59.1° | 180.0° |
| C10 | C9 | C11 | H16 | 60.9° | 60.0° |
| C10 | C9 | C11 | H17 | 179.0° | 60.0° |
| C11 | C9 | C10 | H12 | 57.8° | 52.1° |
| C11 | C9 | C10 | H13 | 177.8° | 67.9° |
| C11 | C9 | C10 | H14 | 62.3° | 172.2° |
| C9 | C11 | H15 | H16 | 120.0° | 120.0° |
| C9 | C11 | H15 | H17 | 120.0° | 120.0° |
| C9 | C11 | H16 | H17 | 120.0° | 120.0° |
| H11 | C9 | C10 | H12 | 61.9° | 172.1° |
| H11 | C9 | C10 | H13 | 58.1° | 52.1° |
| H11 | C9 | C10 | H14 | 178.1° | 67.9° |
| H11 | C9 | C11 | H15 | 60.7° | 60.0° |
| H11 | C9 | C11 | H16 | 179.3° | 60.0° |
| H11 | C9 | C11 | H17 | 59.3° | 180.0° |
| H12 | C10 | H13 | H14 | 120.0° | 120.0° |
| H15 | C11 | H16 | H17 | 119.9° | 120.0° |
| C12 | N3 | H18 | C8 | 180.0° | 179.9° |
| N3 | C12 | C13 | C14 | 121.7° | 120.1° |
| N3 | C12 | C13 | H19 | 120.4° | 119.9° |
| N3 | C12 | C14 | H19 | 118.1° | 120.0° |
| N3 | C12 | C13 | O6 | 34.8° | 0.1° |
| N3 | C12 | C14 | H20 | 180.0° | 60.1° |
| N3 | C12 | C14 | H21 | 60.0° | 180.0° |
| N3 | C12 | C14 | H22 | 60.0° | 60.0° |
| N3 | C12 | C13 | N4 | 143.9° | 180.0° |
| H18 | N3 | C12 | C13 | 88.2° | 25.1° |
| H18 | N3 | C12 | C14 | 34.2° | 95.0° |
| H18 | N3 | C12 | H19 | 151.9° | 145.0° |
| C13 | C12 | C14 | H19 | 117.7° | 120.0° |
| C12 | C13 | O6 | N4 | 178.6° | 179.9° |
| C13 | C12 | C14 | H20 | 55.9° | 60.0° |
| C13 | C12 | C14 | H21 | 175.9° | 60.0° |
| C13 | C12 | C14 | H22 | 64.1° | 180.0° |
| C12 | C13 | N4 | C15 | 178.6° | 180.0° |
| C12 | C13 | N4 | H23 | 1.4° | 0.1° |
| C13 | C12 | N3 | C8 | 91.8° | 155.0° |
| C14 | C12 | C13 | O6 | 86.9° | 120.0° |
| C12 | C14 | H20 | H21 | 120.0° | 120.0° |
| C12 | C14 | H20 | H22 | 120.0° | 120.1° |
| C12 | C14 | H21 | H22 | 120.0° | 120.1° |
| C14 | C12 | N3 | C8 | 145.8° | 84.9° |
| C14 | C12 | C13 | N4 | 94.4° | 59.9° |
| H19 | C12 | C13 | O6 | 155.2° | 120.0° |
| H19 | C12 | C14 | H20 | 61.9° | 180.0° |
| H19 | C12 | C14 | H21 | 58.1° | 60.0° |
| H19 | C12 | C14 | H22 | 178.1° | 60.0° |
| H19 | C12 | N3 | C8 | 28.1° | 35.1° |
| H19 | C12 | C13 | N4 | 23.5° | 60.1° |
| O6 | C13 | N4 | C15 | 2.8° | 0.0° |
| O6 | C13 | N4 | H23 | 177.3° | 180.0° |
| H20 | C14 | H21 | H22 | 120.0° | 119.9° |
| C15 | N4 | H23 | C13 | 180.0° | 179.9° |
| N4 | C15 | C16 | C17 | 121.5° | 120.0° |
| N4 | C15 | C16 | H24 | 119.6° | 120.0° |
| N4 | C15 | C17 | H24 | 119.8° | 120.1° |
| N4 | C15 | C16 | O7 | 167.5° | 15.0° |
| N4 | C15 | C17 | C18 | 91.0° | 65.0° |
| N4 | C15 | C17 | H25 | 29.5° | 54.9° |
| N4 | C15 | C17 | H26 | 148.5° | 175.0° |
| N4 | C15 | C16 | C19 | 23.8° | 165.0° |
| H23 | N4 | C15 | C16 | 82.6° | 95.1° |
| H23 | N4 | C15 | C17 | 39.2° | 25.0° |
| H23 | N4 | C15 | H24 | 158.4° | 145.0° |
| C16 | C15 | C17 | H24 | 119.0° | 119.9° |
| C15 | C16 | O7 | C19 | 169.3° | 180.0° |
| C16 | C15 | C17 | C18 | 147.8° | 175.0° |
| C16 | C15 | C17 | H25 | 91.7° | 65.1° |
| C16 | C15 | C17 | H26 | 27.3° | 55.0° |
| C15 | C16 | C19 | F1 | 130.2° | 179.9° |
| C15 | C16 | C19 | H28 | 114.8° | 60.0° |
| C15 | C16 | C19 | H29 | 15.2° | 60.0° |
| C16 | C15 | N4 | C13 | 97.4° | 85.0° |
| C17 | C15 | C16 | O7 | 45.9° | 105.0° |
| C15 | C17 | C18 | H25 | 120.5° | 120.0° |
| C15 | C17 | C18 | H26 | 120.5° | 120.0° |
| C15 | C17 | H25 | H26 | 118.6° | 120.1° |
| C15 | C17 | C18 | O8 | 29.7° | 0.0° |
| C15 | C17 | C18 | O9 | 150.4° | 180.0° |
| C17 | C15 | C16 | C19 | 145.3° | 74.9° |
| C17 | C15 | N4 | C13 | 140.8° | 155.0° |
| H24 | C15 | C16 | O7 | 73.0° | 135.1° |
| H24 | C15 | C17 | C18 | 28.8° | 55.1° |
| H24 | C15 | C17 | H25 | 149.3° | 175.0° |
| H24 | C15 | C17 | H26 | 91.6° | 64.9° |
| H24 | C15 | C16 | C19 | 95.8° | 45.0° |
| H24 | C15 | N4 | C13 | 21.6° | 35.0° |
| O7 | C16 | C19 | F1 | 61.0° | 0.0° |
| O7 | C16 | C19 | H28 | 54.0° | 120.0° |
| O7 | C16 | C19 | H29 | 176.0° | 120.0° |
| C18 | C17 | H25 | H26 | 118.5° | 120.0° |
| C17 | C18 | O8 | O9 | 179.9° | 180.0° |
| C17 | C18 | O9 | H27 | 179.9° | 180.0° |
| H25 | C17 | C18 | O8 | 150.1° | 120.0° |
| H25 | C17 | C18 | O9 | 30.0° | 60.0° |
| H26 | C17 | C18 | O8 | 90.8° | 120.0° |
| H26 | C17 | C18 | O9 | 89.1° | 60.0° |
| O8 | C18 | O9 | H27 | 0.0° | 0.0° |
| F1 | C19 | H28 | H29 | 132.9° | 120.0° |
| F1 | C19 | H28 | C16 | 94.1° | 120.0° |
| F1 | C19 | H29 | C16 | 94.1° | 120.0° |
| H28 | C19 | H29 | C16 | 133.0° | 120.0° |
