NQ5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | S | doub | 1.42Å | 1.43Å | |
| C | O | sing | 1.43Å | 1.42Å | |
| S | O1 | doub | 1.42Å | 1.43Å | |
| S | N | sing | 1.66Å | 1.62Å | |
| S | C2 | sing | 1.81Å | 1.78Å | |
| O | C1 | sing | 1.43Å | 1.41Å | |
| O7 | C23 | sing | 1.44Å | 1.45Å | |
| O7 | C22 | sing | 1.44Å | 1.45Å | |
| N | C3 | sing | 1.40Å | 1.42Å | |
| C23 | C21 | sing | 1.54Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C22 | C21 | sing | 1.54Å | 1.55Å | |
| C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C7 | sing | 1.40Å | 1.40Å | Aromatic |
| O3 | C8 | sing | 1.43Å | 1.42Å | |
| O3 | C7 | sing | 1.36Å | 1.35Å | |
| C21 | N2 | sing | 1.47Å | 1.47Å | |
| C4 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C7 | N1 | doub | 1.32Å | 1.32Å | Aromatic |
| N2 | C18 | sing | 1.47Å | 1.47Å | |
| N2 | C19 | sing | 1.47Å | 1.47Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| C17 | C16 | sing | 1.53Å | 1.51Å | |
| C17 | O6 | sing | 1.43Å | 1.43Å | |
| C16 | O5 | sing | 1.43Å | 1.43Å | |
| C5 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C9 | sing | 1.48Å | 1.49Å | |
| N1 | C6 | sing | 1.32Å | 1.34Å | Aromatic |
| C19 | C20 | sing | 1.53Å | 1.51Å | |
| C24 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| C24 | C15 | doub | 1.39Å | 1.38Å | Aromatic |
| C20 | O6 | sing | 1.43Å | 1.44Å | |
| C9 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| O5 | C15 | sing | 1.36Å | 1.38Å | |
| C15 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C14 | C13 | sing | 1.51Å | 1.50Å | |
| C11 | C12 | sing | 1.51Å | 1.49Å | |
| C13 | O4 | sing | 1.44Å | 1.43Å | |
| C12 | O4 | sing | 1.44Å | 1.43Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C8 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C24 | H14 | sing | 1.08Å | 1.08Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| C2 | H16 | sing | 1.09Å | 1.10Å | |
| C1 | H17 | sing | 1.09Å | 1.10Å | |
| C1 | H18 | sing | 1.09Å | 1.10Å | |
| C | H19 | sing | 1.09Å | 1.10Å | |
| C | H20 | sing | 1.09Å | 1.10Å | |
| C | H21 | sing | 1.09Å | 1.10Å | |
| N | H22 | sing | 0.97Å | 1.00Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H29 | sing | 1.09Å | 1.10Å | |
| C18 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C23 | H32 | sing | 1.09Å | 1.10Å | |
| C12 | H28 | sing | 1.09Å | 1.10Å | |
| C13 | H33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | S | O1 | 119.5° | 121.0° |
| O2 | S | N | 104.9° | 104.3° |
| O2 | S | C2 | 108.8° | 110.5° |
| C | O | C1 | 112.4° | 114.0° |
| O | C | H19 | 109.5° | 109.5° |
| O | C | H20 | 109.5° | 109.5° |
| O | C | H21 | 109.5° | 109.5° |
| O1 | S | N | 107.0° | 104.3° |
| O1 | S | C2 | 108.1° | 110.6° |
| N | S | C2 | 108.1° | 104.5° |
| S | N | C3 | 128.1° | 120.0° |
| S | N | H22 | 104.6° | 120.0° |
| S | C2 | C1 | 112.0° | 109.5° |
| S | C2 | H15 | 108.9° | 109.5° |
| S | C2 | H16 | 108.8° | 109.4° |
| O | C1 | C2 | 105.4° | 109.5° |
| O | C1 | H17 | 110.5° | 109.5° |
| O | C1 | H18 | 110.5° | 109.4° |
| C23 | O7 | C22 | 90.7° | 93.3° |
| O7 | C23 | C21 | 90.4° | 85.5° |
| O7 | C23 | H31 | 114.0° | 113.8° |
| O7 | C23 | H32 | 114.0° | 114.0° |
| O7 | C22 | C21 | 89.5° | 85.5° |
| O7 | C22 | H12 | 114.2° | 113.8° |
| O7 | C22 | H13 | 114.2° | 114.0° |
| N | C3 | C4 | 121.5° | 120.5° |
| N | C3 | C7 | 119.9° | 120.4° |
| C3 | N | H22 | 104.7° | 120.0° |
| C23 | C21 | C22 | 83.9° | 86.0° |
| C23 | C21 | N2 | 114.5° | 113.8° |
| C23 | C21 | H11 | 113.8° | 113.8° |
| C21 | C23 | H31 | 114.0° | 113.9° |
| C21 | C23 | H32 | 114.0° | 113.9° |
| C1 | C2 | H15 | 108.8° | 109.5° |
| C1 | C2 | H16 | 108.8° | 109.5° |
| C2 | C1 | H17 | 110.5° | 109.5° |
| C2 | C1 | H18 | 110.5° | 109.5° |
| C22 | C21 | N2 | 112.7° | 113.8° |
| C22 | C21 | H11 | 113.4° | 113.8° |
| C21 | C22 | H12 | 114.2° | 113.9° |
| C21 | C22 | H13 | 114.2° | 113.9° |
| C4 | C3 | C7 | 118.5° | 119.1° |
| C3 | C4 | C5 | 119.4° | 118.3° |
| C3 | C4 | H1 | 120.2° | 120.8° |
| C3 | C7 | O3 | 115.2° | 119.6° |
| C3 | C7 | N1 | 123.0° | 120.8° |
| C8 | O3 | C7 | 117.6° | 117.0° |
| O3 | C8 | H3 | 109.5° | 109.5° |
| O3 | C8 | H4 | 109.5° | 109.5° |
| O3 | C8 | H5 | 109.5° | 109.5° |
| O3 | C7 | N1 | 121.6° | 119.6° |
| C21 | N2 | C18 | 113.9° | 111.0° |
| C21 | N2 | C19 | 114.2° | 111.0° |
| N2 | C21 | H11 | 114.8° | 113.0° |
| C4 | C5 | C6 | 117.0° | 119.1° |
| C4 | C5 | C9 | 119.8° | 120.5° |
| C5 | C4 | H1 | 120.3° | 120.9° |
| C7 | N1 | C6 | 117.6° | 121.8° |
| C18 | N2 | C19 | 109.0° | 110.7° |
| N2 | C18 | C17 | 109.9° | 109.3° |
| N2 | C18 | H29 | 109.3° | 109.5° |
| N2 | C18 | H30 | 109.4° | 109.5° |
| N2 | C19 | C20 | 109.4° | 109.2° |
| N2 | C19 | H26 | 109.5° | 109.5° |
| N2 | C19 | H27 | 109.5° | 109.6° |
| C18 | C17 | C16 | 113.9° | 109.5° |
| C18 | C17 | O6 | 109.7° | 109.3° |
| C18 | C17 | H8 | 107.7° | 109.6° |
| C17 | C18 | H29 | 109.3° | 109.5° |
| C17 | C18 | H30 | 109.4° | 109.5° |
| C16 | C17 | O6 | 108.9° | 109.5° |
| C17 | C16 | O5 | 108.6° | 109.5° |
| C16 | C17 | H8 | 107.8° | 109.5° |
| C17 | C16 | H24 | 109.7° | 109.5° |
| C17 | C16 | H25 | 109.7° | 109.4° |
| C17 | O6 | C20 | 113.5° | 113.7° |
| O6 | C17 | H8 | 108.8° | 109.5° |
| C16 | O5 | C15 | 119.9° | 117.0° |
| O5 | C16 | H24 | 109.7° | 109.5° |
| O5 | C16 | H25 | 109.7° | 109.5° |
| C6 | C5 | C9 | 122.8° | 120.4° |
| C5 | C6 | N1 | 124.4° | 120.8° |
| C5 | C6 | H2 | 117.8° | 119.6° |
| C5 | C9 | C24 | 119.0° | 120.1° |
| C5 | C9 | C10 | 121.9° | 120.1° |
| N1 | C6 | H2 | 117.8° | 119.6° |
| C19 | C20 | O6 | 110.5° | 109.3° |
| C19 | C20 | H9 | 109.2° | 109.5° |
| C19 | C20 | H10 | 109.2° | 109.5° |
| C20 | C19 | H26 | 109.5° | 109.5° |
| C20 | C19 | H27 | 109.5° | 109.5° |
| C9 | C24 | C15 | 119.6° | 119.9° |
| C24 | C9 | C10 | 118.9° | 119.8° |
| C9 | C24 | H14 | 120.2° | 120.1° |
| C24 | C15 | O5 | 123.1° | 120.0° |
| C24 | C15 | C14 | 121.1° | 120.0° |
| C15 | C24 | H14 | 120.2° | 120.1° |
| O6 | C20 | H9 | 109.2° | 109.5° |
| O6 | C20 | H10 | 109.2° | 109.6° |
| C9 | C10 | C11 | 120.7° | 120.0° |
| C9 | C10 | H6 | 119.6° | 120.0° |
| O5 | C15 | C14 | 115.7° | 120.0° |
| C15 | C14 | C11 | 120.0° | 120.2° |
| C15 | C14 | C13 | 131.3° | 132.5° |
| C10 | C11 | C14 | 119.5° | 120.2° |
| C10 | C11 | C12 | 131.1° | 132.5° |
| C11 | C10 | H6 | 119.6° | 120.1° |
| C11 | C14 | C13 | 108.7° | 107.3° |
| C14 | C11 | C12 | 109.4° | 107.3° |
| C14 | C13 | O4 | 105.0° | 106.0° |
| C14 | C13 | H7 | 110.6° | 110.3° |
| C14 | C13 | H33 | 110.6° | 110.0° |
| C11 | C12 | O4 | 105.2° | 105.9° |
| C11 | C12 | H23 | 110.5° | 110.2° |
| C11 | C12 | H28 | 110.5° | 110.1° |
| C13 | O4 | C12 | 111.2° | 105.0° |
| O4 | C13 | H7 | 110.6° | 110.2° |
| O4 | C13 | H33 | 110.6° | 110.1° |
| O4 | C12 | H23 | 110.5° | 110.2° |
| O4 | C12 | H28 | 110.5° | 110.2° |
| H3 | C8 | H4 | 109.4° | 109.5° |
| H3 | C8 | H5 | 109.5° | 109.5° |
| H4 | C8 | H5 | 109.5° | 109.4° |
| H7 | C13 | H33 | 109.5° | 110.1° |
| H9 | C20 | H10 | 109.5° | 109.5° |
| H12 | C22 | H13 | 109.4° | 113.0° |
| H15 | C2 | H16 | 109.5° | 109.5° |
| H17 | C1 | H18 | 109.4° | 109.4° |
| H19 | C | H20 | 109.4° | 109.4° |
| H19 | C | H21 | 109.4° | 109.5° |
| H20 | C | H21 | 109.5° | 109.5° |
| H23 | C12 | H28 | 109.5° | 110.1° |
| H24 | C16 | H25 | 109.5° | 109.5° |
| H26 | C19 | H27 | 109.5° | 109.5° |
| H29 | C18 | H30 | 109.5° | 109.5° |
| H31 | C23 | H32 | 109.5° | 113.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | S | O1 | N | 118.8° | 116.8° |
| O2 | S | O1 | C2 | 125.0° | 131.4° |
| O2 | S | N | C2 | 116.0° | 116.0° |
| O2 | S | N | C3 | 168.7° | 51.0° |
| O2 | S | C2 | C1 | 48.6° | 68.4° |
| O2 | S | C2 | H15 | 71.7° | 51.7° |
| O2 | S | C2 | H16 | 169.0° | 171.6° |
| O2 | S | N | H22 | 68.9° | 128.9° |
| C | O | C1 | C2 | 155.2° | 180.0° |
| C | O | C1 | H17 | 35.9° | 60.0° |
| C | O | C1 | H18 | 85.4° | 60.0° |
| O | C | H19 | H20 | 120.0° | 120.0° |
| O | C | H19 | H21 | 120.0° | 120.0° |
| O | C | H20 | H21 | 120.0° | 120.0° |
| O1 | S | N | C2 | 116.2° | 116.1° |
| O1 | S | N | C3 | 63.4° | 178.9° |
| O1 | S | C2 | C1 | 179.8° | 68.4° |
| O1 | S | C2 | H15 | 59.4° | 171.6° |
| O1 | S | C2 | H16 | 59.8° | 51.6° |
| O1 | S | N | H22 | 59.0° | 1.0° |
| S | N | C3 | H22 | 122.4° | 179.9° |
| N | S | C2 | C1 | 64.8° | 180.0° |
| S | N | C3 | C4 | 53.8° | 34.9° |
| S | N | C3 | C7 | 122.4° | 145.0° |
| N | S | C2 | H15 | 174.8° | 60.0° |
| N | S | C2 | H16 | 55.6° | 60.0° |
| S | C2 | C1 | O | 71.6° | 180.0° |
| C2 | S | N | C3 | 52.7° | 65.0° |
| S | C2 | C1 | H15 | 120.4° | 120.0° |
| S | C2 | C1 | H16 | 120.4° | 120.0° |
| S | C2 | H15 | H16 | 118.9° | 119.9° |
| S | C2 | C1 | H17 | 47.8° | 60.0° |
| S | C2 | C1 | H18 | 169.1° | 60.0° |
| C2 | S | N | H22 | 175.2° | 115.1° |
| O | C1 | C2 | H17 | 119.3° | 120.0° |
| O | C1 | C2 | H18 | 119.4° | 120.0° |
| O | C1 | C2 | H15 | 48.8° | 60.0° |
| O | C1 | C2 | H16 | 168.0° | 60.0° |
| O | C1 | H17 | H18 | 121.9° | 120.0° |
| C1 | O | C | H19 | 180.0° | 180.0° |
| C1 | O | C | H20 | 60.0° | 60.0° |
| C1 | O | C | H21 | 60.0° | 60.0° |
| O7 | C23 | C21 | H31 | 116.6° | 114.1° |
| O7 | C23 | C21 | H32 | 116.6° | 114.3° |
| C23 | O7 | C22 | C21 | 17.9° | 24.1° |
| O7 | C23 | C21 | N2 | 129.2° | 136.8° |
| O7 | C23 | C21 | H11 | 95.9° | 91.8° |
| C23 | O7 | C22 | H12 | 98.5° | 138.3° |
| C23 | O7 | C22 | H13 | 134.4° | 90.1° |
| O7 | C23 | H31 | H32 | 129.1° | 132.1° |
| O7 | C22 | C21 | H12 | 116.5° | 114.1° |
| O7 | C22 | C21 | H13 | 116.5° | 114.3° |
| O7 | C22 | C21 | N2 | 131.1° | 136.8° |
| O7 | C22 | C21 | H11 | 96.3° | 91.8° |
| O7 | C22 | H12 | H13 | 129.5° | 132.1° |
| C22 | O7 | C23 | H31 | 134.8° | 90.1° |
| C22 | O7 | C23 | H32 | 98.4° | 138.3° |
| N | C3 | C4 | C7 | 176.2° | 179.9° |
| N | C3 | C7 | O3 | 11.0° | 0.0° |
| N | C3 | C4 | C5 | 172.7° | 180.0° |
| N | C3 | C7 | N1 | 173.0° | 179.9° |
| N | C3 | C4 | H1 | 7.3° | 0.2° |
| C23 | C21 | C22 | N2 | 114.0° | 114.3° |
| C23 | C21 | C22 | H11 | 113.4° | 114.3° |
| C23 | C21 | N2 | H11 | 134.4° | 131.8° |
| C23 | C21 | N2 | C18 | 60.2° | 81.5° |
| C23 | C21 | N2 | C19 | 173.8° | 154.9° |
| C23 | C21 | C22 | H12 | 99.4° | 136.6° |
| C23 | C21 | C22 | H13 | 133.5° | 91.8° |
| C21 | C23 | H31 | H32 | 129.1° | 132.1° |
| C1 | C2 | H15 | H16 | 118.8° | 120.0° |
| C2 | C1 | H17 | H18 | 121.9° | 120.0° |
| C22 | C21 | N2 | H11 | 131.9° | 131.8° |
| C22 | C21 | N2 | C18 | 153.8° | 177.9° |
| C22 | C21 | N2 | C19 | 80.1° | 58.5° |
| C21 | C22 | H12 | H13 | 129.5° | 132.0° |
| C22 | C21 | C23 | H31 | 133.7° | 91.6° |
| C22 | C21 | C23 | H32 | 99.6° | 136.8° |
| C4 | C3 | C7 | O3 | 172.6° | 180.0° |
| C3 | C4 | C5 | H1 | 180.0° | 179.8° |
| C4 | C3 | C7 | N1 | 3.3° | 0.0° |
| C3 | C4 | C5 | C6 | 2.1° | 0.1° |
| C3 | C4 | C5 | C9 | 170.8° | 179.9° |
| C4 | C3 | N | H22 | 68.7° | 145.0° |
| C3 | C7 | O3 | C8 | 170.4° | 180.0° |
| C3 | C7 | O3 | N1 | 176.1° | 180.0° |
| C7 | C3 | C4 | C5 | 3.6° | 0.1° |
| C3 | C7 | N1 | C6 | 1.5° | 0.1° |
| C7 | C3 | C4 | H1 | 176.4° | 179.9° |
| C7 | C3 | N | H22 | 115.1° | 35.1° |
| C8 | O3 | C7 | N1 | 5.7° | 0.0° |
| O3 | C8 | H3 | H4 | 120.0° | 120.0° |
| O3 | C8 | H3 | H5 | 120.0° | 120.1° |
| O3 | C8 | H4 | H5 | 120.0° | 120.0° |
| O3 | C7 | N1 | C6 | 174.3° | 180.0° |
| C7 | O3 | C8 | H3 | 180.0° | 60.0° |
| C7 | O3 | C8 | H4 | 60.0° | 60.0° |
| C7 | O3 | C8 | H5 | 60.0° | 180.0° |
| C21 | N2 | C18 | C19 | 128.8° | 123.8° |
| C21 | N2 | C18 | C17 | 171.2° | 177.6° |
| C21 | N2 | C19 | C20 | 171.7° | 177.6° |
| N2 | C21 | C22 | H12 | 14.6° | 109.1° |
| N2 | C21 | C22 | H13 | 112.4° | 22.5° |
| C21 | N2 | C19 | H26 | 51.7° | 62.5° |
| C21 | N2 | C19 | H27 | 68.4° | 57.6° |
| C21 | N2 | C18 | H29 | 68.8° | 57.7° |
| C21 | N2 | C18 | H30 | 51.1° | 62.4° |
| N2 | C21 | C23 | H31 | 114.1° | 22.7° |
| N2 | C21 | C23 | H32 | 12.6° | 108.9° |
| C4 | C5 | C6 | C9 | 172.7° | 179.9° |
| C4 | C5 | C6 | N1 | 0.2° | 0.0° |
| C4 | C5 | C9 | C24 | 29.4° | 0.0° |
| C4 | C5 | C9 | C10 | 145.8° | 180.0° |
| C4 | C5 | C6 | H2 | 179.8° | 179.9° |
| C7 | N1 | C6 | C5 | 0.1° | 0.0° |
| C7 | N1 | C6 | H2 | 179.9° | 180.0° |
| N2 | C18 | C17 | H29 | 120.0° | 119.9° |
| N2 | C18 | C17 | H30 | 120.1° | 120.0° |
| N2 | C18 | C17 | C16 | 179.7° | 176.8° |
| N2 | C18 | C17 | O6 | 57.3° | 56.9° |
| C18 | N2 | C19 | C20 | 59.7° | 58.6° |
| N2 | C18 | C17 | H8 | 60.9° | 63.1° |
| C18 | N2 | C21 | H11 | 74.2° | 50.3° |
| C18 | N2 | C19 | H26 | 179.7° | 61.3° |
| C18 | N2 | C19 | H27 | 60.2° | 178.6° |
| N2 | C18 | H29 | H30 | 119.8° | 120.1° |
| C19 | N2 | C18 | C17 | 60.1° | 58.6° |
| N2 | C19 | C20 | H26 | 120.0° | 119.9° |
| N2 | C19 | C20 | H27 | 120.0° | 120.0° |
| N2 | C19 | C20 | O6 | 57.1° | 56.9° |
| N2 | C19 | C20 | H9 | 63.0° | 176.8° |
| N2 | C19 | C20 | H10 | 177.3° | 63.2° |
| C19 | N2 | C21 | H11 | 51.8° | 73.3° |
| N2 | C19 | H26 | H27 | 120.0° | 120.2° |
| C19 | N2 | C18 | H29 | 60.0° | 178.5° |
| C19 | N2 | C18 | H30 | 179.8° | 61.3° |
| C18 | C17 | C16 | O6 | 122.8° | 119.8° |
| C18 | C17 | C16 | H8 | 119.3° | 120.1° |
| C18 | C17 | O6 | H8 | 117.5° | 120.0° |
| C18 | C17 | C16 | O5 | 54.3° | 175.2° |
| C18 | C17 | O6 | C20 | 55.8° | 58.7° |
| C18 | C17 | C16 | H24 | 65.5° | 64.8° |
| C18 | C17 | C16 | H25 | 174.2° | 55.2° |
| C17 | C18 | H29 | H30 | 119.8° | 120.1° |
| C16 | C17 | O6 | H8 | 117.2° | 120.1° |
| C17 | C16 | O5 | H24 | 119.9° | 120.0° |
| C17 | C16 | O5 | H25 | 119.9° | 120.0° |
| C16 | C17 | O6 | C20 | 178.9° | 178.6° |
| C17 | C16 | O5 | C15 | 168.5° | 180.0° |
| C17 | C16 | H24 | H25 | 120.4° | 120.0° |
| C16 | C17 | C18 | H29 | 59.6° | 63.3° |
| C16 | C17 | C18 | H30 | 60.2° | 56.8° |
| O6 | C17 | C16 | O5 | 68.5° | 65.0° |
| C17 | O6 | C20 | C19 | 56.2° | 58.7° |
| C17 | O6 | C20 | H9 | 63.9° | 178.6° |
| C17 | O6 | C20 | H10 | 176.4° | 61.4° |
| O6 | C17 | C16 | H24 | 171.7° | 55.0° |
| O6 | C17 | C16 | H25 | 51.4° | 175.0° |
| O6 | C17 | C18 | H29 | 62.7° | 176.8° |
| O6 | C17 | C18 | H30 | 177.4° | 63.1° |
| C16 | O5 | C15 | C24 | 9.2° | 0.6° |
| C16 | O5 | C15 | C14 | 172.9° | 180.0° |
| O5 | C16 | C17 | H8 | 173.7° | 55.1° |
| O5 | C16 | H24 | H25 | 120.4° | 120.0° |
| C5 | C6 | N1 | H2 | 180.0° | 179.9° |
| C6 | C5 | C9 | C24 | 143.1° | 180.0° |
| C6 | C5 | C9 | C10 | 41.7° | 0.0° |
| C6 | C5 | C4 | H1 | 177.9° | 179.9° |
| C9 | C5 | C6 | N1 | 172.5° | 180.0° |
| C5 | C9 | C24 | C10 | 175.3° | 180.0° |
| C5 | C9 | C24 | C15 | 174.8° | 180.0° |
| C5 | C9 | C10 | C11 | 174.1° | 180.0° |
| C9 | C5 | C4 | H1 | 9.1° | 0.1° |
| C9 | C5 | C6 | H2 | 7.5° | 0.0° |
| C5 | C9 | C10 | H6 | 5.9° | 0.2° |
| C5 | C9 | C24 | H14 | 5.2° | 0.1° |
| C19 | C20 | O6 | H9 | 120.1° | 119.9° |
| C19 | C20 | O6 | H10 | 120.2° | 120.0° |
| C19 | C20 | H9 | H10 | 119.5° | 120.1° |
| C20 | C19 | H26 | H27 | 120.0° | 120.1° |
| C9 | C24 | C15 | H14 | 180.0° | 179.9° |
| C9 | C24 | C15 | O5 | 177.5° | 179.7° |
| C9 | C24 | C15 | C14 | 0.3° | 0.3° |
| C24 | C9 | C10 | C11 | 1.1° | 0.0° |
| C24 | C9 | C10 | H6 | 178.9° | 179.8° |
| C15 | C24 | C9 | C10 | 0.5° | 0.0° |
| C24 | C15 | O5 | C14 | 177.9° | 179.4° |
| C24 | C15 | C14 | C11 | 0.7° | 0.5° |
| C24 | C15 | C14 | C13 | 179.0° | 180.0° |
| C20 | O6 | C17 | H8 | 61.7° | 61.3° |
| O6 | C20 | H9 | H10 | 119.5° | 120.1° |
| O6 | C20 | C19 | H26 | 177.1° | 63.1° |
| O6 | C20 | C19 | H27 | 62.8° | 176.9° |
| C9 | C10 | C11 | H6 | 180.0° | 179.8° |
| C9 | C10 | C11 | C14 | 0.7° | 0.2° |
| C9 | C10 | C11 | C12 | 179.1° | 179.8° |
| C10 | C9 | C24 | H14 | 179.4° | 179.9° |
| O5 | C15 | C14 | C11 | 177.3° | 180.0° |
| O5 | C15 | C14 | C13 | 1.1° | 0.5° |
| O5 | C15 | C24 | H14 | 2.5° | 0.4° |
| C15 | O5 | C16 | H24 | 48.7° | 60.0° |
| C15 | O5 | C16 | H25 | 71.6° | 60.0° |
| C15 | C14 | C11 | C10 | 0.2° | 0.5° |
| C15 | C14 | C11 | C13 | 178.7° | 179.6° |
| C15 | C14 | C11 | C12 | 178.5° | 179.5° |
| C15 | C14 | C13 | O4 | 177.4° | 163.0° |
| C15 | C14 | C13 | H7 | 63.3° | 43.7° |
| C14 | C15 | C24 | H14 | 179.7° | 179.8° |
| C15 | C14 | C13 | H33 | 58.1° | 78.0° |
| C10 | C11 | C14 | C12 | 178.7° | 180.0° |
| C10 | C11 | C14 | C13 | 178.9° | 179.9° |
| C10 | C11 | C12 | O4 | 177.1° | 162.3° |
| C10 | C11 | C12 | H23 | 57.8° | 43.1° |
| C10 | C11 | C12 | H28 | 63.6° | 78.6° |
| C11 | C14 | C13 | O4 | 4.1° | 17.5° |
| C14 | C11 | C12 | O4 | 4.4° | 17.7° |
| C14 | C11 | C10 | H6 | 179.3° | 180.0° |
| C11 | C14 | C13 | H7 | 115.2° | 136.8° |
| C14 | C11 | C12 | H23 | 123.7° | 136.9° |
| C14 | C11 | C12 | H28 | 115.0° | 101.4° |
| C11 | C14 | C13 | H33 | 123.4° | 101.6° |
| C13 | C14 | C11 | C12 | 0.1° | 0.1° |
| C14 | C13 | O4 | H7 | 119.3° | 119.4° |
| C14 | C13 | O4 | H33 | 119.3° | 119.0° |
| C14 | C13 | O4 | C12 | 7.1° | 28.3° |
| C14 | C13 | H7 | H33 | 122.1° | 121.6° |
| C11 | C12 | O4 | C13 | 7.2° | 28.4° |
| C11 | C12 | O4 | H23 | 119.3° | 119.2° |
| C11 | C12 | O4 | H28 | 119.3° | 119.1° |
| C12 | C11 | C10 | H6 | 0.9° | 0.1° |
| C11 | C12 | H23 | H28 | 122.0° | 121.7° |
| O4 | C13 | H7 | H33 | 122.1° | 121.7° |
| C13 | O4 | C12 | H23 | 126.5° | 147.6° |
| C13 | O4 | C12 | H28 | 112.2° | 90.7° |
| C12 | O4 | C13 | H7 | 112.2° | 147.6° |
| O4 | C12 | H23 | H28 | 121.9° | 121.7° |
| C12 | O4 | C13 | H33 | 126.4° | 90.7° |
| H3 | C8 | H4 | H5 | 120.0° | 120.0° |
| H8 | C17 | C16 | H24 | 53.8° | 175.1° |
| H8 | C17 | C16 | H25 | 66.5° | 64.9° |
| H8 | C17 | C18 | H29 | 179.0° | 56.8° |
| H8 | C17 | C18 | H30 | 59.2° | 176.9° |
| H9 | C20 | C19 | H26 | 57.0° | 56.8° |
| H9 | C20 | C19 | H27 | 177.0° | 63.2° |
| H10 | C20 | C19 | H26 | 62.7° | 176.9° |
| H10 | C20 | C19 | H27 | 57.3° | 56.8° |
| H11 | C21 | C22 | H12 | 147.2° | 22.4° |
| H11 | C21 | C22 | H13 | 20.2° | 154.0° |
| H11 | C21 | C23 | H31 | 20.7° | 154.1° |
| H11 | C21 | C23 | H32 | 147.4° | 22.5° |
| H15 | C2 | C1 | H17 | 168.2° | 180.0° |
| H15 | C2 | C1 | H18 | 70.5° | 60.0° |
| H16 | C2 | C1 | H17 | 72.6° | 60.0° |
| H16 | C2 | C1 | H18 | 48.7° | 180.0° |
| H19 | C | H20 | H21 | 120.0° | 120.0° |
