VQR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | C8 | sing | 1.54Å | 1.52Å | |
| C9 | N1 | sing | 1.47Å | 1.46Å | |
| C8 | C7 | sing | 1.55Å | 1.53Å | |
| N1 | C10 | sing | 1.34Å | 1.33Å | |
| C7 | C10 | sing | 1.51Å | 1.52Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C10 | O3 | doub | 1.21Å | 1.24Å | |
| O2 | C2 | doub | 1.21Å | 1.20Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | O1 | sing | 1.34Å | 1.34Å | |
| C2 | C3 | sing | 1.51Å | 1.50Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C5 | N2 | sing | 1.46Å | 1.47Å | |
| C15 | C14 | sing | 1.53Å | 1.52Å | |
| O1 | C1 | sing | 1.45Å | 1.45Å | |
| C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| N3 | C12 | sing | 1.47Å | 1.45Å | |
| N3 | C17 | sing | 1.35Å | 1.35Å | |
| O6 | C17 | sing | 1.35Å | 1.35Å | |
| O6 | C18 | sing | 1.45Å | 1.45Å | |
| C20 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.37Å | Aromatic |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C12 | C11 | sing | 1.51Å | 1.53Å | |
| C19 | C18 | sing | 1.51Å | 1.50Å | |
| C19 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | O5 | doub | 1.22Å | 1.22Å | |
| C23 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| N2 | C11 | sing | 1.35Å | 1.34Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C14 | C16 | sing | 1.53Å | 1.52Å | |
| C11 | O4 | doub | 1.21Å | 1.23Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.08Å | 1.08Å | |
| C21 | H17 | sing | 1.08Å | 1.08Å | |
| C22 | H18 | sing | 1.08Å | 1.08Å | |
| C23 | H19 | sing | 1.08Å | 1.08Å | |
| C24 | H20 | sing | 1.08Å | 1.08Å | |
| C3 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C4 | H23 | sing | 1.09Å | 1.10Å | |
| C4 | H24 | sing | 1.09Å | 1.10Å | |
| C5 | H25 | sing | 1.09Å | 1.10Å | |
| C6 | H26 | sing | 1.09Å | 1.10Å | |
| C6 | H27 | sing | 1.09Å | 1.10Å | |
| C7 | H28 | sing | 1.09Å | 1.10Å | |
| C8 | H29 | sing | 1.09Å | 1.10Å | |
| C8 | H30 | sing | 1.09Å | 1.10Å | |
| C9 | H31 | sing | 1.09Å | 1.10Å | |
| C9 | H32 | sing | 1.09Å | 1.10Å | |
| N1 | H33 | sing | 0.97Å | 1.00Å | |
| N2 | H34 | sing | 0.97Å | 1.00Å | |
| N3 | H35 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | C9 | N1 | 102.6° | 105.5° |
| C9 | C8 | C7 | 102.7° | 101.7° |
| C9 | C8 | H29 | 111.1° | 111.0° |
| C9 | C8 | H30 | 111.1° | 111.0° |
| C8 | C9 | H31 | 111.2° | 110.2° |
| C8 | C9 | H32 | 111.1° | 110.2° |
| C9 | N1 | C10 | 113.5° | 111.3° |
| N1 | C9 | H31 | 111.2° | 110.4° |
| N1 | C9 | H32 | 111.2° | 110.0° |
| C9 | N1 | H33 | 123.2° | 124.3° |
| C8 | C7 | C10 | 102.5° | 104.2° |
| C8 | C7 | C6 | 116.6° | 110.5° |
| C8 | C7 | H28 | 109.2° | 110.6° |
| C7 | C8 | H29 | 111.2° | 110.9° |
| C7 | C8 | H30 | 111.1° | 111.0° |
| N1 | C10 | C7 | 107.9° | 110.1° |
| N1 | C10 | O3 | 126.4° | 124.9° |
| C10 | N1 | H33 | 123.2° | 124.3° |
| C10 | C7 | C6 | 109.7° | 110.5° |
| C7 | C10 | O3 | 125.7° | 124.9° |
| C10 | C7 | H28 | 109.3° | 110.5° |
| C7 | C6 | C5 | 116.6° | 109.5° |
| C7 | C6 | H26 | 107.6° | 109.5° |
| C7 | C6 | H27 | 107.7° | 109.4° |
| C6 | C7 | H28 | 109.2° | 110.4° |
| O2 | C2 | O1 | 122.6° | 120.0° |
| O2 | C2 | C3 | 123.2° | 120.0° |
| C5 | C4 | C3 | 113.8° | 109.5° |
| C4 | C5 | C6 | 113.6° | 109.5° |
| C4 | C5 | N2 | 111.0° | 109.4° |
| C5 | C4 | H23 | 108.4° | 109.5° |
| C5 | C4 | H24 | 108.4° | 109.5° |
| C4 | C5 | H25 | 107.7° | 109.4° |
| C4 | C3 | C2 | 113.0° | 109.4° |
| C4 | C3 | H21 | 108.6° | 109.5° |
| C4 | C3 | H22 | 108.6° | 109.5° |
| C3 | C4 | H23 | 108.4° | 109.5° |
| C3 | C4 | H24 | 108.3° | 109.5° |
| O1 | C2 | C3 | 114.1° | 119.9° |
| C2 | O1 | C1 | 117.8° | 116.9° |
| C2 | C3 | H21 | 108.6° | 109.5° |
| C2 | C3 | H22 | 108.6° | 109.5° |
| C6 | C5 | N2 | 108.1° | 109.5° |
| C6 | C5 | H25 | 107.8° | 109.5° |
| C5 | C6 | H26 | 107.7° | 109.5° |
| C5 | C6 | H27 | 107.7° | 109.5° |
| C5 | N2 | C11 | 128.0° | 120.0° |
| N2 | C5 | H25 | 108.5° | 109.5° |
| C5 | N2 | H34 | 116.0° | 120.0° |
| C15 | C14 | C13 | 110.1° | 109.5° |
| C15 | C14 | C16 | 110.8° | 109.5° |
| C15 | C14 | H7 | 107.1° | 109.5° |
| C14 | C15 | H8 | 109.5° | 109.5° |
| C14 | C15 | H9 | 109.4° | 109.5° |
| C14 | C15 | H10 | 109.5° | 109.5° |
| O1 | C1 | H1 | 109.5° | 109.5° |
| O1 | C1 | H2 | 109.5° | 109.5° |
| O1 | C1 | H3 | 109.5° | 109.4° |
| C20 | C21 | C22 | 120.2° | 120.0° |
| C21 | C20 | C19 | 120.4° | 120.0° |
| C21 | C20 | H16 | 119.8° | 119.9° |
| C20 | C21 | H17 | 119.9° | 120.0° |
| C21 | C22 | C23 | 119.8° | 120.0° |
| C22 | C21 | H17 | 119.9° | 120.0° |
| C21 | C22 | H18 | 120.1° | 120.0° |
| C12 | N3 | C17 | 123.3° | 120.1° |
| N3 | C12 | C13 | 111.1° | 109.5° |
| N3 | C12 | C11 | 112.2° | 109.5° |
| N3 | C12 | H4 | 107.8° | 109.5° |
| C12 | N3 | H35 | 118.3° | 120.0° |
| N3 | C17 | O6 | 110.0° | 120.0° |
| N3 | C17 | O5 | 125.7° | 119.9° |
| C17 | N3 | H35 | 118.4° | 119.9° |
| C17 | O6 | C18 | 116.0° | 117.0° |
| O6 | C17 | O5 | 124.2° | 120.0° |
| O6 | C18 | C19 | 104.5° | 109.4° |
| O6 | C18 | H14 | 110.7° | 109.5° |
| O6 | C18 | H15 | 110.7° | 109.5° |
| C20 | C19 | C18 | 121.0° | 120.0° |
| C20 | C19 | C24 | 118.9° | 120.0° |
| C19 | C20 | H16 | 119.8° | 120.1° |
| C22 | C23 | C24 | 120.1° | 120.0° |
| C23 | C22 | H18 | 120.1° | 120.0° |
| C22 | C23 | H19 | 120.0° | 120.0° |
| C13 | C12 | C11 | 111.7° | 109.5° |
| C12 | C13 | C14 | 116.3° | 109.4° |
| C13 | C12 | H4 | 106.8° | 109.5° |
| C12 | C13 | H5 | 107.7° | 109.5° |
| C12 | C13 | H6 | 107.7° | 109.5° |
| C12 | C11 | N2 | 117.7° | 120.0° |
| C12 | C11 | O4 | 120.0° | 120.0° |
| C11 | C12 | H4 | 106.9° | 109.4° |
| C18 | C19 | C24 | 120.1° | 120.0° |
| C19 | C18 | H14 | 110.7° | 109.5° |
| C19 | C18 | H15 | 110.7° | 109.5° |
| C19 | C24 | C23 | 120.6° | 120.0° |
| C19 | C24 | H20 | 119.7° | 120.0° |
| C24 | C23 | H19 | 119.9° | 120.0° |
| C23 | C24 | H20 | 119.7° | 120.0° |
| N2 | C11 | O4 | 122.2° | 120.0° |
| C11 | N2 | H34 | 116.0° | 120.0° |
| C13 | C14 | C16 | 114.4° | 109.4° |
| C14 | C13 | H5 | 107.7° | 109.4° |
| C14 | C13 | H6 | 107.8° | 109.5° |
| C13 | C14 | H7 | 107.0° | 109.4° |
| C16 | C14 | H7 | 107.0° | 109.5° |
| C14 | C16 | H11 | 109.5° | 109.5° |
| C14 | C16 | H12 | 109.4° | 109.4° |
| C14 | C16 | H13 | 109.4° | 109.5° |
| H1 | C1 | H2 | 109.4° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.4° |
| H2 | C1 | H3 | 109.4° | 109.5° |
| H5 | C13 | H6 | 109.5° | 109.5° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H8 | C15 | H10 | 109.5° | 109.4° |
| H9 | C15 | H10 | 109.5° | 109.4° |
| H11 | C16 | H12 | 109.5° | 109.4° |
| H11 | C16 | H13 | 109.5° | 109.5° |
| H12 | C16 | H13 | 109.5° | 109.5° |
| H14 | C18 | H15 | 109.4° | 109.5° |
| H21 | C3 | H22 | 109.5° | 109.5° |
| H23 | C4 | H24 | 109.5° | 109.5° |
| H26 | C6 | H27 | 109.4° | 109.5° |
| H29 | C8 | H30 | 109.5° | 110.9° |
| H31 | C9 | H32 | 109.5° | 110.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C8 | C9 | N1 | H31 | 118.9° | 119.1° |
| C8 | C9 | N1 | H32 | 118.9° | 118.9° |
| C9 | C8 | C7 | H29 | 118.9° | 118.1° |
| C9 | C8 | C7 | H30 | 118.9° | 118.2° |
| C8 | C9 | N1 | C10 | 20.0° | 16.6° |
| C9 | C8 | C7 | C10 | 30.8° | 24.8° |
| C9 | C8 | C7 | C6 | 150.7° | 143.5° |
| C9 | C8 | C7 | H28 | 85.0° | 93.9° |
| C9 | C8 | H29 | H30 | 123.1° | 123.8° |
| C8 | C9 | H31 | H32 | 123.2° | 122.0° |
| C8 | C9 | N1 | H33 | 160.0° | 162.9° |
| N1 | C9 | C8 | C7 | 30.8° | 25.2° |
| C9 | N1 | C10 | H33 | 180.0° | 179.6° |
| C9 | N1 | C10 | C7 | 0.0° | 0.0° |
| C9 | N1 | C10 | O3 | 179.8° | 179.7° |
| N1 | C9 | C8 | H29 | 149.7° | 92.9° |
| N1 | C9 | C8 | H30 | 88.1° | 143.3° |
| N1 | C9 | H31 | H32 | 123.2° | 121.8° |
| C8 | C7 | C10 | N1 | 19.9° | 16.5° |
| C8 | C7 | C10 | C6 | 124.5° | 118.7° |
| C8 | C7 | C10 | H28 | 115.7° | 118.8° |
| C8 | C7 | C6 | H28 | 124.3° | 122.7° |
| C8 | C7 | C10 | O3 | 159.9° | 163.8° |
| C8 | C7 | C6 | C5 | 47.8° | 178.7° |
| C8 | C7 | C6 | H26 | 73.3° | 61.2° |
| C8 | C7 | C6 | H27 | 168.8° | 58.8° |
| C7 | C8 | H29 | H30 | 123.1° | 123.8° |
| C7 | C8 | C9 | H31 | 149.7° | 144.4° |
| C7 | C8 | C9 | H32 | 88.1° | 93.6° |
| N1 | C10 | C7 | O3 | 179.8° | 179.8° |
| N1 | C10 | C7 | C6 | 144.5° | 135.2° |
| N1 | C10 | C7 | H28 | 95.8° | 102.3° |
| C10 | N1 | C9 | H31 | 139.0° | 135.8° |
| C10 | N1 | C9 | H32 | 98.8° | 102.3° |
| C10 | C7 | C6 | H28 | 119.8° | 122.5° |
| C10 | C7 | C6 | C5 | 163.7° | 66.4° |
| C10 | C7 | C6 | H26 | 42.6° | 53.6° |
| C10 | C7 | C6 | H27 | 75.3° | 173.6° |
| C10 | C7 | C8 | H29 | 149.7° | 93.3° |
| C10 | C7 | C8 | H30 | 88.1° | 142.9° |
| C7 | C10 | N1 | H33 | 179.9° | 179.5° |
| C6 | C7 | C10 | O3 | 35.3° | 45.1° |
| C7 | C6 | C5 | C4 | 79.7° | 175.0° |
| C7 | C6 | C5 | H26 | 121.0° | 120.0° |
| C7 | C6 | C5 | H27 | 121.0° | 120.0° |
| C7 | C6 | C5 | N2 | 156.6° | 65.0° |
| C7 | C6 | C5 | H25 | 39.5° | 55.0° |
| C7 | C6 | H26 | H27 | 116.7° | 120.0° |
| C6 | C7 | C8 | H29 | 90.4° | 25.4° |
| C6 | C7 | C8 | H30 | 31.7° | 98.4° |
| O3 | C10 | C7 | H28 | 84.4° | 77.5° |
| O3 | C10 | N1 | H33 | 0.2° | 0.7° |
| O2 | C2 | C3 | C4 | 23.0° | 0.0° |
| O2 | C2 | O1 | C3 | 179.0° | 179.9° |
| O2 | C2 | O1 | C1 | 177.9° | 0.0° |
| O2 | C2 | C3 | H21 | 143.5° | 120.0° |
| O2 | C2 | C3 | H22 | 97.5° | 120.0° |
| C5 | C4 | C3 | H23 | 120.6° | 120.0° |
| C5 | C4 | C3 | H24 | 120.6° | 120.0° |
| C5 | C4 | C3 | C2 | 114.8° | 180.0° |
| C4 | C5 | C6 | N2 | 123.6° | 120.0° |
| C4 | C5 | C6 | H25 | 119.3° | 120.0° |
| C4 | C5 | N2 | H25 | 118.2° | 120.0° |
| C4 | C5 | N2 | C11 | 124.2° | 155.0° |
| C5 | C4 | C3 | H21 | 124.7° | 60.0° |
| C5 | C4 | C3 | H22 | 5.7° | 60.0° |
| C5 | C4 | H23 | H24 | 118.0° | 120.0° |
| C4 | C5 | C6 | H26 | 159.2° | 55.0° |
| C4 | C5 | C6 | H27 | 41.3° | 65.0° |
| C4 | C5 | N2 | H34 | 55.7° | 25.0° |
| C4 | C3 | C2 | O1 | 156.0° | 180.0° |
| C4 | C3 | C2 | H21 | 120.5° | 120.0° |
| C4 | C3 | C2 | H22 | 120.5° | 120.0° |
| C3 | C4 | C5 | C6 | 68.4° | 175.0° |
| C3 | C4 | C5 | N2 | 53.6° | 65.0° |
| C4 | C3 | H21 | H22 | 118.4° | 120.0° |
| C3 | C4 | H23 | H24 | 118.0° | 120.0° |
| C3 | C4 | C5 | H25 | 172.3° | 55.0° |
| C2 | O1 | C1 | H1 | 180.0° | 60.0° |
| C2 | O1 | C1 | H2 | 60.0° | 60.1° |
| C2 | O1 | C1 | H3 | 60.0° | 179.9° |
| O1 | C2 | C3 | H21 | 35.5° | 60.1° |
| O1 | C2 | C3 | H22 | 83.4° | 60.0° |
| C3 | C2 | O1 | C1 | 3.1° | 180.0° |
| C2 | C3 | H21 | H22 | 118.4° | 120.0° |
| C2 | C3 | C4 | H23 | 5.8° | 60.0° |
| C2 | C3 | C4 | H24 | 124.6° | 59.9° |
| C6 | C5 | N2 | H25 | 116.6° | 120.1° |
| C6 | C5 | N2 | C11 | 110.6° | 85.0° |
| C6 | C5 | C4 | H23 | 52.2° | 55.0° |
| C6 | C5 | C4 | H24 | 171.0° | 65.0° |
| C5 | C6 | H26 | H27 | 116.8° | 120.0° |
| C5 | C6 | C7 | H28 | 76.5° | 56.1° |
| C6 | C5 | N2 | H34 | 69.4° | 95.0° |
| C5 | N2 | C11 | C12 | 7.7° | 175.6° |
| C5 | N2 | C11 | H34 | 180.0° | 180.0° |
| C5 | N2 | C11 | O4 | 173.4° | 4.4° |
| N2 | C5 | C4 | H23 | 174.3° | 175.0° |
| N2 | C5 | C4 | H24 | 67.0° | 55.0° |
| N2 | C5 | C6 | H26 | 35.6° | 175.0° |
| N2 | C5 | C6 | H27 | 82.3° | 54.9° |
| C15 | C14 | C13 | C12 | 45.3° | 66.7° |
| C15 | C14 | C13 | C16 | 125.6° | 120.0° |
| C15 | C14 | C13 | H7 | 116.0° | 120.0° |
| C15 | C14 | C16 | H7 | 116.4° | 120.0° |
| C15 | C14 | C13 | H5 | 75.6° | 53.3° |
| C15 | C14 | C13 | H6 | 166.3° | 173.3° |
| C14 | C15 | H8 | H9 | 120.0° | 120.0° |
| C14 | C15 | H8 | H10 | 120.0° | 120.1° |
| C14 | C15 | H9 | H10 | 120.0° | 120.0° |
| C15 | C14 | C16 | H11 | 180.0° | 180.0° |
| C15 | C14 | C16 | H12 | 60.0° | 60.0° |
| C15 | C14 | C16 | H13 | 60.0° | 60.0° |
| O1 | C1 | H1 | H2 | 120.0° | 120.1° |
| O1 | C1 | H1 | H3 | 120.0° | 119.9° |
| O1 | C1 | H2 | H3 | 120.0° | 120.0° |
| C20 | C21 | C22 | H17 | 180.0° | 180.0° |
| C21 | C20 | C19 | H16 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.0° | 0.0° |
| C21 | C20 | C19 | C18 | 179.7° | 179.9° |
| C21 | C20 | C19 | C24 | 0.5° | 0.4° |
| C20 | C21 | C22 | H18 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 0.3° | 0.1° |
| C21 | C22 | C23 | H18 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 0.0° | 0.2° |
| C22 | C21 | C20 | H16 | 179.7° | 180.0° |
| C21 | C22 | C23 | H19 | 180.0° | 180.0° |
| C12 | N3 | C17 | H35 | 180.0° | 180.0° |
| C12 | N3 | C17 | O6 | 168.1° | 174.9° |
| N3 | C12 | C13 | C11 | 126.1° | 120.0° |
| N3 | C12 | C13 | H4 | 117.4° | 120.0° |
| N3 | C12 | C11 | H4 | 118.0° | 120.0° |
| C12 | N3 | C17 | O5 | 8.2° | 5.1° |
| N3 | C12 | C11 | N2 | 80.0° | 161.3° |
| N3 | C12 | C13 | C14 | 156.4° | 174.5° |
| N3 | C12 | C11 | O4 | 101.1° | 18.7° |
| N3 | C12 | C13 | H5 | 35.4° | 54.6° |
| N3 | C12 | C13 | H6 | 82.6° | 65.5° |
| N3 | C17 | O6 | O5 | 176.4° | 180.0° |
| N3 | C17 | O6 | C18 | 173.9° | 180.0° |
| C17 | N3 | C12 | C13 | 59.0° | 81.7° |
| C17 | N3 | C12 | C11 | 66.8° | 158.3° |
| C17 | N3 | C12 | H4 | 175.8° | 38.4° |
| C17 | O6 | C18 | C19 | 133.0° | 180.0° |
| C17 | O6 | C18 | H14 | 13.7° | 60.0° |
| C17 | O6 | C18 | H15 | 107.8° | 60.0° |
| O6 | C17 | N3 | H35 | 11.9° | 5.0° |
| O6 | C18 | C19 | C20 | 120.3° | 89.7° |
| O6 | C18 | C19 | H14 | 119.2° | 120.0° |
| O6 | C18 | C19 | H15 | 119.2° | 120.0° |
| O6 | C18 | C19 | C24 | 58.8° | 90.0° |
| C18 | O6 | C17 | O5 | 2.4° | 0.0° |
| O6 | C18 | H14 | H15 | 122.2° | 120.0° |
| C20 | C19 | C18 | C24 | 179.1° | 179.7° |
| C20 | C19 | C24 | C23 | 0.5° | 0.6° |
| C20 | C19 | C18 | H14 | 120.4° | 30.3° |
| C20 | C19 | C18 | H15 | 1.1° | 150.3° |
| C19 | C20 | C21 | H17 | 179.7° | 180.0° |
| C20 | C19 | C24 | H20 | 179.4° | 179.7° |
| C22 | C23 | C24 | C19 | 0.3° | 0.5° |
| C22 | C23 | C24 | H19 | 180.0° | 179.8° |
| C23 | C22 | C21 | H17 | 180.0° | 180.0° |
| C22 | C23 | C24 | H20 | 179.7° | 179.8° |
| C13 | C12 | C11 | H4 | 116.5° | 120.0° |
| C13 | C12 | C11 | N2 | 154.5° | 78.7° |
| C12 | C13 | C14 | H5 | 121.0° | 120.0° |
| C12 | C13 | C14 | H6 | 121.0° | 120.0° |
| C12 | C13 | C14 | C16 | 80.3° | 173.3° |
| C13 | C12 | C11 | O4 | 24.4° | 101.3° |
| C12 | C13 | H5 | H6 | 116.9° | 120.1° |
| C12 | C13 | C14 | H7 | 161.4° | 53.3° |
| C13 | C12 | N3 | H35 | 121.0° | 98.3° |
| C12 | C11 | N2 | O4 | 179.0° | 180.0° |
| C11 | C12 | C13 | C14 | 77.5° | 65.4° |
| C11 | C12 | C13 | H5 | 161.5° | 174.6° |
| C11 | C12 | C13 | H6 | 43.5° | 54.5° |
| C12 | C11 | N2 | H34 | 172.3° | 4.3° |
| C11 | C12 | N3 | H35 | 113.2° | 21.7° |
| C18 | C19 | C24 | C23 | 179.7° | 179.7° |
| C19 | C18 | H14 | H15 | 122.3° | 120.0° |
| C18 | C19 | C20 | H16 | 0.3° | 0.0° |
| C18 | C19 | C24 | H20 | 0.3° | 0.0° |
| C19 | C24 | C23 | H20 | 180.0° | 179.7° |
| C24 | C19 | C18 | H14 | 60.4° | 150.0° |
| C24 | C19 | C18 | H15 | 178.0° | 30.0° |
| C24 | C19 | C20 | H16 | 179.5° | 179.8° |
| C19 | C24 | C23 | H19 | 179.7° | 179.7° |
| O5 | C17 | N3 | H35 | 171.8° | 175.0° |
| C24 | C23 | C22 | H18 | 180.0° | 179.8° |
| N2 | C11 | C12 | H4 | 38.1° | 41.3° |
| C11 | N2 | C5 | H25 | 6.0° | 35.0° |
| C13 | C14 | C16 | H7 | 118.3° | 120.0° |
| C14 | C13 | C12 | H4 | 39.0° | 54.5° |
| C14 | C13 | H5 | H6 | 116.9° | 120.0° |
| C13 | C14 | C15 | H8 | 180.0° | 55.9° |
| C13 | C14 | C15 | H9 | 60.0° | 64.1° |
| C13 | C14 | C15 | H10 | 60.0° | 175.9° |
| C13 | C14 | C16 | H11 | 54.7° | 60.0° |
| C13 | C14 | C16 | H12 | 65.2° | 180.0° |
| C13 | C14 | C16 | H13 | 174.8° | 60.0° |
| C16 | C14 | C13 | H5 | 158.8° | 66.7° |
| C16 | C14 | C13 | H6 | 40.7° | 53.3° |
| C16 | C14 | C15 | H8 | 52.4° | 175.9° |
| C16 | C14 | C15 | H9 | 67.7° | 55.9° |
| C16 | C14 | C15 | H10 | 172.3° | 64.1° |
| C14 | C16 | H11 | H12 | 120.0° | 120.0° |
| C14 | C16 | H11 | H13 | 120.0° | 120.1° |
| C14 | C16 | H12 | H13 | 120.0° | 120.0° |
| O4 | C11 | C12 | H4 | 140.9° | 138.7° |
| O4 | C11 | N2 | H34 | 6.6° | 175.6° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H4 | C12 | C13 | H5 | 82.0° | 65.4° |
| H4 | C12 | C13 | H6 | 160.0° | 174.5° |
| H4 | C12 | N3 | H35 | 4.2° | 141.7° |
| H5 | C13 | C14 | H7 | 40.4° | 173.3° |
| H6 | C13 | C14 | H7 | 77.6° | 66.7° |
| H7 | C14 | C15 | H8 | 64.0° | 64.0° |
| H7 | C14 | C15 | H9 | 175.9° | 175.9° |
| H7 | C14 | C15 | H10 | 56.0° | 56.0° |
| H7 | C14 | C16 | H11 | 63.6° | 60.0° |
| H7 | C14 | C16 | H12 | 176.4° | 60.0° |
| H7 | C14 | C16 | H13 | 56.4° | NaN° |
| H8 | C15 | H9 | H10 | 120.0° | 119.9° |
| H11 | C16 | H12 | H13 | 120.0° | 120.0° |
| H16 | C20 | C21 | H17 | 0.3° | 0.1° |
| H17 | C21 | C22 | H18 | 0.0° | 0.0° |
| H18 | C22 | C23 | H19 | 0.0° | 0.0° |
| H19 | C23 | C24 | H20 | 0.3° | 0.0° |
| H21 | C3 | C4 | H23 | 114.7° | 180.0° |
| H21 | C3 | C4 | H24 | 4.0° | 60.0° |
| H22 | C3 | C4 | H23 | 126.3° | 60.0° |
| H22 | C3 | C4 | H24 | 114.9° | 179.9° |
| H23 | C4 | C5 | H25 | 67.0° | 65.0° |
| H24 | C4 | C5 | H25 | 51.7° | 175.0° |
| H25 | C5 | C6 | H26 | 81.5° | 65.0° |
| H25 | C5 | C6 | H27 | 160.6° | 175.0° |
| H25 | C5 | N2 | H34 | 174.0° | 145.0° |
| H26 | C6 | C7 | H28 | 162.4° | 176.1° |
| H27 | C6 | C7 | H28 | 44.5° | 63.9° |
| H28 | C7 | C8 | H29 | 33.9° | 148.0° |
| H28 | C7 | C8 | H30 | 156.1° | 24.2° |
| H29 | C8 | C9 | H31 | 91.4° | 26.3° |
| H29 | C8 | C9 | H32 | 30.8° | 148.3° |
| H30 | C8 | C9 | H31 | 30.8° | 97.4° |
| H30 | C8 | C9 | H32 | 153.0° | 24.5° |
| H31 | C9 | N1 | H33 | 41.1° | 43.8° |
| H32 | C9 | N1 | H33 | 81.1° | 78.1° |
