A1H9Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.40Å | 1.40Å | |
| C2 | C3 | doub | 1.37Å | 1.37Å | |
| C3 | C4 | sing | 1.41Å | 1.45Å | |
| C4 | N1 | sing | 1.35Å | 1.39Å | |
| N1 | C5 | sing | 1.36Å | 1.37Å | |
| C1 | C5 | doub | 1.35Å | 1.35Å | |
| N1 | C6 | sing | 1.47Å | 1.47Å | |
| C3 | N2 | sing | 1.40Å | 1.41Å | |
| C6 | C7 | sing | 1.51Å | 1.53Å | |
| C7 | N3 | sing | 1.35Å | 1.34Å | |
| N3 | C8 | sing | 1.47Å | 1.47Å | |
| C6 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | C10 | sing | 1.53Å | 1.51Å | |
| C10 | C11 | sing | 1.53Å | 1.50Å | |
| C11 | C12 | sing | 1.53Å | 1.49Å | |
| C10 | C12 | sing | 1.53Å | 1.50Å | |
| C7 | O1 | doub | 1.21Å | 1.22Å | |
| C4 | O2 | doub | 1.22Å | 1.23Å | |
| C8 | C13 | sing | 1.53Å | 1.55Å | |
| C8 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | C15 | sing | 1.51Å | 1.53Å | |
| C14 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.55Å | 1.53Å | |
| C17 | C18 | sing | 1.55Å | 1.52Å | |
| C18 | N4 | sing | 1.47Å | 1.45Å | |
| N4 | C19 | sing | 1.34Å | 1.32Å | |
| C16 | C19 | sing | 1.51Å | 1.52Å | |
| C19 | O3 | doub | 1.21Å | 1.23Å | |
| N2 | C20 | sing | 1.35Å | 1.36Å | |
| C20 | C21 | sing | 1.51Å | 1.52Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C21 | C23 | sing | 1.53Å | 1.53Å | |
| C15 | N5 | sing | 1.35Å | 1.33Å | |
| N5 | C24 | sing | 1.47Å | 1.45Å | |
| C20 | O4 | doub | 1.21Å | 1.23Å | |
| C15 | O5 | doub | 1.21Å | 1.22Å | |
| C13 | O6 | sing | 1.43Å | 1.42Å | |
| N3 | H6 | sing | 0.97Å | 1.00Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C24 | H34 | sing | 1.09Å | 1.10Å | |
| C24 | H33 | sing | 1.09Å | 1.10Å | |
| C24 | H32 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| N2 | H5 | sing | 0.97Å | 1.00Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| N4 | H23 | sing | 0.97Å | 1.00Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| N5 | H31 | sing | 0.97Å | 1.00Å | |
| O6 | H35 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 120.0° | 119.2° |
| C2 | C1 | C5 | 119.9° | 120.0° |
| C2 | C1 | H1 | 120.0° | 120.0° |
| C1 | C2 | H2 | 120.0° | 120.4° |
| C2 | C3 | C4 | 120.7° | 119.2° |
| C2 | C3 | N2 | 126.7° | 120.4° |
| C3 | C2 | H2 | 120.0° | 120.4° |
| C3 | C4 | N1 | 116.1° | 120.0° |
| C4 | C3 | N2 | 112.5° | 120.4° |
| C3 | C4 | O2 | 123.9° | 120.0° |
| C4 | N1 | C5 | 121.9° | 120.8° |
| C4 | N1 | C6 | 118.3° | 119.6° |
| N1 | C4 | O2 | 120.0° | 120.0° |
| N1 | C5 | C1 | 121.4° | 120.8° |
| C5 | N1 | C6 | 119.8° | 119.6° |
| N1 | C5 | H3 | 119.3° | 119.6° |
| C1 | C5 | H3 | 119.3° | 119.5° |
| C5 | C1 | H1 | 120.0° | 120.0° |
| N1 | C6 | C7 | 112.7° | 109.5° |
| N1 | C6 | C9 | 111.2° | 109.5° |
| N1 | C6 | H4 | 106.7° | 109.5° |
| C3 | N2 | C20 | 126.9° | 120.0° |
| C3 | N2 | H5 | 116.6° | 120.0° |
| C6 | C7 | N3 | 114.6° | 120.0° |
| C7 | C6 | C9 | 113.5° | 109.5° |
| C6 | C7 | O1 | 120.3° | 120.0° |
| C7 | C6 | H4 | 106.1° | 109.5° |
| C7 | N3 | C8 | 128.7° | 120.0° |
| N3 | C7 | O1 | 124.7° | 120.0° |
| C7 | N3 | H6 | 115.6° | 120.0° |
| N3 | C8 | C13 | 108.4° | 109.5° |
| N3 | C8 | C14 | 110.6° | 109.5° |
| C8 | N3 | H6 | 115.7° | 120.0° |
| N3 | C8 | H7 | 107.3° | 109.4° |
| C6 | C9 | C10 | 110.5° | 109.5° |
| C9 | C6 | H4 | 106.0° | 109.4° |
| C6 | C9 | H9 | 109.2° | 109.4° |
| C6 | C9 | H8 | 109.2° | 109.5° |
| C9 | C10 | C11 | 120.7° | 117.5° |
| C9 | C10 | C12 | 121.1° | 117.5° |
| C9 | C10 | H10 | 114.7° | 115.6° |
| C10 | C9 | H9 | 109.2° | 109.5° |
| C10 | C9 | H8 | 109.2° | 109.5° |
| C10 | C11 | C12 | 60.1° | 60.0° |
| C11 | C10 | C12 | 59.8° | 59.9° |
| C11 | C10 | H10 | 114.8° | 117.5° |
| C10 | C11 | H11 | 120.0° | 117.5° |
| C10 | C11 | H12 | 120.0° | 117.5° |
| C11 | C12 | C10 | 60.1° | 60.0° |
| C12 | C11 | H11 | 120.0° | 117.5° |
| C12 | C11 | H12 | 120.0° | 117.5° |
| C11 | C12 | H13 | 120.0° | 117.5° |
| C11 | C12 | H14 | 120.0° | 117.5° |
| C12 | C10 | H10 | 114.8° | 117.5° |
| C10 | C12 | H13 | 120.0° | 117.5° |
| C10 | C12 | H14 | 120.0° | 117.5° |
| C13 | C8 | C14 | 117.1° | 109.5° |
| C8 | C13 | C15 | 115.8° | 109.5° |
| C8 | C13 | O6 | 111.0° | 109.4° |
| C13 | C8 | H7 | 106.4° | 109.4° |
| C8 | C13 | H15 | 106.4° | 109.5° |
| C8 | C14 | C16 | 115.0° | 109.5° |
| C14 | C8 | H7 | 106.5° | 109.5° |
| C8 | C14 | H16 | 108.0° | 109.5° |
| C8 | C14 | H17 | 108.1° | 109.5° |
| C13 | C15 | N5 | 114.8° | 120.0° |
| C13 | C15 | O5 | 121.5° | 120.0° |
| C15 | C13 | O6 | 108.5° | 109.5° |
| C15 | C13 | H15 | 106.7° | 109.5° |
| C14 | C16 | C17 | 113.2° | 110.5° |
| C14 | C16 | C19 | 115.1° | 110.5° |
| C16 | C14 | H16 | 108.1° | 109.5° |
| C16 | C14 | H17 | 108.1° | 109.4° |
| C14 | C16 | H18 | 107.7° | 110.4° |
| C16 | C17 | C18 | 105.4° | 101.7° |
| C17 | C16 | C19 | 105.2° | 104.2° |
| C16 | C17 | H19 | 110.5° | 110.9° |
| C16 | C17 | H20 | 110.5° | 111.0° |
| C17 | C16 | H18 | 107.7° | 110.5° |
| C17 | C18 | N4 | 104.5° | 105.5° |
| C18 | C17 | H19 | 110.5° | 111.0° |
| C18 | C17 | H20 | 110.5° | 111.0° |
| C17 | C18 | H21 | 110.7° | 110.2° |
| C17 | C18 | H22 | 110.7° | 110.2° |
| C18 | N4 | C19 | 114.6° | 111.3° |
| N4 | C18 | H21 | 110.7° | 110.2° |
| N4 | C18 | H22 | 110.7° | 110.3° |
| C18 | N4 | H23 | 122.7° | 124.3° |
| N4 | C19 | C16 | 108.7° | 110.1° |
| N4 | C19 | O3 | 125.5° | 124.9° |
| C19 | N4 | H23 | 122.7° | 124.4° |
| C16 | C19 | O3 | 125.7° | 124.9° |
| C19 | C16 | H18 | 107.7° | 110.6° |
| N2 | C20 | C21 | 116.2° | 119.9° |
| N2 | C20 | O4 | 122.3° | 120.0° |
| C20 | N2 | H5 | 116.6° | 120.1° |
| C20 | C21 | C22 | 110.5° | 109.5° |
| C20 | C21 | C23 | 110.1° | 109.4° |
| C21 | C20 | O4 | 121.5° | 120.0° |
| C20 | C21 | H24 | 108.4° | 109.5° |
| C22 | C21 | C23 | 111.3° | 109.4° |
| C22 | C21 | H24 | 108.2° | 109.4° |
| C21 | C22 | H26 | 109.5° | 109.5° |
| C21 | C22 | H25 | 109.5° | 109.5° |
| C21 | C22 | H27 | 109.4° | 109.5° |
| C23 | C21 | H24 | 108.2° | 109.5° |
| C21 | C23 | H30 | 109.5° | 109.4° |
| C21 | C23 | H29 | 109.5° | 109.5° |
| C21 | C23 | H28 | 109.5° | 109.5° |
| C15 | N5 | C24 | 123.9° | 120.0° |
| N5 | C15 | O5 | 123.6° | 120.0° |
| C15 | N5 | H31 | 118.0° | 120.0° |
| N5 | C24 | H34 | 109.5° | 109.4° |
| N5 | C24 | H33 | 109.5° | 109.5° |
| N5 | C24 | H32 | 109.5° | 109.4° |
| C24 | N5 | H31 | 118.0° | 120.1° |
| O6 | C13 | H15 | 108.0° | 109.5° |
| C13 | O6 | H35 | 109.5° | 114.0° |
| H19 | C17 | H20 | 109.5° | 110.9° |
| H26 | C22 | H25 | 109.4° | 109.5° |
| H26 | C22 | H27 | 109.5° | 109.4° |
| H25 | C22 | H27 | 109.5° | 109.5° |
| H34 | C24 | H33 | 109.5° | 109.5° |
| H34 | C24 | H32 | 109.5° | 109.5° |
| H33 | C24 | H32 | 109.5° | 109.5° |
| H9 | C9 | H8 | 109.5° | 109.5° |
| H11 | C11 | H12 | 109.5° | 115.6° |
| H13 | C12 | H14 | 109.5° | 115.5° |
| H16 | C14 | H17 | 109.5° | 109.4° |
| H21 | C18 | H22 | 109.5° | 110.3° |
| H30 | C23 | H29 | 109.5° | 109.5° |
| H30 | C23 | H28 | 109.5° | 109.5° |
| H29 | C23 | H28 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | H2 | 180.0° | 179.5° |
| C1 | C2 | C3 | C4 | 2.6° | 0.8° |
| C2 | C1 | C5 | N1 | 0.5° | 0.0° |
| C2 | C1 | C5 | H1 | 180.0° | 179.4° |
| C1 | C2 | C3 | N2 | 179.7° | 180.0° |
| C2 | C1 | C5 | H3 | 179.5° | 180.0° |
| C2 | C3 | C4 | N2 | 177.5° | 179.2° |
| C2 | C3 | C4 | N1 | 2.5° | 0.5° |
| C3 | C2 | C1 | C5 | 1.6° | 0.6° |
| C2 | C3 | C4 | O2 | 179.6° | 179.5° |
| C2 | C3 | N2 | C20 | 24.1° | 120.4° |
| C3 | C2 | C1 | H1 | 178.4° | 180.0° |
| C2 | C3 | N2 | H5 | 155.9° | 59.5° |
| C3 | C4 | N1 | O2 | 177.9° | 179.9° |
| C3 | C4 | N1 | C5 | 1.4° | 0.1° |
| C3 | C4 | N1 | C6 | 177.4° | 179.7° |
| C4 | C3 | N2 | C20 | 158.6° | 60.3° |
| C4 | C3 | C2 | H2 | 177.4° | 179.7° |
| C4 | C3 | N2 | H5 | 21.4° | 119.7° |
| C4 | N1 | C5 | C6 | 178.8° | 179.6° |
| C4 | N1 | C5 | C1 | 0.5° | 0.3° |
| N1 | C4 | C3 | N2 | 180.0° | 179.7° |
| C4 | N1 | C6 | C7 | 97.9° | 119.7° |
| C4 | N1 | C6 | C9 | 133.3° | 120.3° |
| C4 | N1 | C5 | H3 | 179.5° | 179.7° |
| C4 | N1 | C6 | H4 | 18.2° | 0.4° |
| N1 | C5 | C1 | H3 | 180.0° | 179.9° |
| C5 | N1 | C6 | C7 | 83.2° | 60.0° |
| C5 | N1 | C6 | C9 | 45.5° | 60.1° |
| C5 | N1 | C4 | O2 | 179.4° | 180.0° |
| C5 | N1 | C6 | H4 | 160.7° | 180.0° |
| N1 | C5 | C1 | H1 | 179.5° | 179.4° |
| C1 | C5 | N1 | C6 | 178.4° | 179.9° |
| C5 | C1 | C2 | H2 | 178.4° | 179.9° |
| N1 | C6 | C7 | C9 | 127.5° | 120.0° |
| N1 | C6 | C7 | H4 | 116.4° | 120.0° |
| N1 | C6 | C7 | N3 | 138.9° | 180.0° |
| N1 | C6 | C9 | H4 | 115.6° | 119.9° |
| N1 | C6 | C9 | C10 | 74.0° | 64.9° |
| N1 | C6 | C7 | O1 | 48.7° | 0.0° |
| C6 | N1 | C4 | O2 | 0.5° | 0.4° |
| C6 | N1 | C5 | H3 | 1.6° | 0.0° |
| N1 | C6 | C9 | H9 | 46.2° | 55.1° |
| N1 | C6 | C9 | H8 | 165.9° | 175.0° |
| N2 | C3 | C4 | O2 | 2.1° | 0.2° |
| C3 | N2 | C20 | H5 | 180.0° | 179.9° |
| C3 | N2 | C20 | C21 | 172.6° | 175.3° |
| C3 | N2 | C20 | O4 | 6.3° | 4.7° |
| N2 | C3 | C2 | H2 | 0.2° | 0.5° |
| C6 | C7 | N3 | O1 | 172.0° | 180.0° |
| C6 | C7 | N3 | C8 | 153.6° | 179.9° |
| C7 | C6 | C9 | H4 | 116.1° | 120.0° |
| C7 | C6 | C9 | C10 | 157.7° | 175.0° |
| C6 | C7 | N3 | H6 | 26.5° | 0.1° |
| C7 | C6 | C9 | H9 | 82.1° | 65.0° |
| C7 | C6 | C9 | H8 | 37.6° | 55.0° |
| C7 | N3 | C8 | H6 | 180.0° | 179.9° |
| N3 | C7 | C6 | C9 | 93.5° | 60.0° |
| C7 | N3 | C8 | C13 | 63.2° | 155.0° |
| C7 | N3 | C8 | C14 | 66.5° | 84.9° |
| N3 | C7 | C6 | H4 | 22.5° | 60.0° |
| C7 | N3 | C8 | H7 | 177.7° | 35.1° |
| C8 | N3 | C7 | O1 | 18.4° | 0.1° |
| N3 | C8 | C13 | C14 | 126.0° | 120.1° |
| N3 | C8 | C13 | H7 | 115.1° | 119.9° |
| N3 | C8 | C14 | H7 | 116.3° | 120.0° |
| N3 | C8 | C13 | C15 | 149.7° | 175.0° |
| N3 | C8 | C14 | C16 | 45.5° | 65.0° |
| N3 | C8 | C13 | O6 | 25.4° | 65.1° |
| N3 | C8 | C13 | H15 | 91.9° | 54.9° |
| N3 | C8 | C14 | H16 | 166.3° | 175.0° |
| N3 | C8 | C14 | H17 | 75.3° | 55.0° |
| C6 | C9 | C10 | H9 | 120.1° | 120.0° |
| C6 | C9 | C10 | H8 | 120.2° | 120.0° |
| C6 | C9 | C10 | C11 | 80.1° | 175.0° |
| C6 | C9 | C10 | C12 | 151.1° | 116.4° |
| C9 | C6 | C7 | O1 | 78.8° | 120.0° |
| C6 | C9 | C10 | H10 | 64.1° | 29.3° |
| C6 | C9 | H9 | H8 | 119.6° | 120.0° |
| C9 | C10 | C11 | C12 | 110.5° | 107.5° |
| C9 | C10 | C11 | H10 | 144.1° | 145.1° |
| C9 | C10 | C12 | H10 | 144.8° | 145.0° |
| C10 | C9 | C6 | H4 | 41.6° | 55.0° |
| C10 | C9 | H9 | H8 | 119.5° | 120.0° |
| C9 | C10 | C11 | H11 | 140.0° | 145.0° |
| C9 | C10 | C11 | H12 | 1.0° | 0.0° |
| C9 | C10 | C12 | H13 | 140.7° | 0.1° |
| C9 | C10 | C12 | H14 | 0.3° | 145.0° |
| C10 | C11 | C12 | H11 | 109.5° | 107.5° |
| C10 | C11 | C12 | H12 | 109.5° | 107.5° |
| C11 | C10 | C12 | H10 | 105.4° | 107.5° |
| C11 | C10 | C9 | H9 | 40.1° | 55.1° |
| C11 | C10 | C9 | H8 | 159.7° | 65.0° |
| C10 | C11 | H11 | H12 | 144.7° | 145.6° |
| C11 | C10 | C12 | H13 | 109.5° | 107.6° |
| C11 | C10 | C12 | H14 | 109.5° | 107.5° |
| C12 | C11 | H11 | H12 | 144.6° | 145.7° |
| C11 | C12 | H13 | H14 | 144.7° | 145.7° |
| C12 | C10 | C9 | H9 | 31.0° | 123.6° |
| C12 | C10 | C9 | H8 | 88.7° | 3.6° |
| C10 | C12 | H13 | H14 | 144.7° | 145.6° |
| O1 | C7 | N3 | H6 | 161.6° | 179.9° |
| O1 | C7 | C6 | H4 | 165.2° | 120.0° |
| C13 | C8 | C14 | H7 | 118.8° | 120.0° |
| C8 | C13 | C15 | O6 | 125.6° | 119.9° |
| C8 | C13 | C15 | H15 | 118.3° | 120.0° |
| C13 | C8 | C14 | C16 | 170.4° | 175.0° |
| C8 | C13 | C15 | N5 | 141.9° | 65.0° |
| C8 | C13 | C15 | O5 | 41.3° | 115.0° |
| C8 | C13 | O6 | H15 | 116.4° | 120.0° |
| C13 | C8 | N3 | H6 | 116.8° | 25.1° |
| C13 | C8 | C14 | H16 | 68.8° | 55.0° |
| C13 | C8 | C14 | H17 | 49.6° | 65.0° |
| C8 | C13 | O6 | H35 | 22.1° | 60.0° |
| C14 | C8 | C13 | C15 | 23.7° | 65.0° |
| C8 | C14 | C16 | H16 | 120.8° | 120.1° |
| C8 | C14 | C16 | H17 | 120.8° | 120.0° |
| C8 | C14 | C16 | C17 | 164.3° | 175.0° |
| C8 | C14 | C16 | C19 | 74.7° | 70.3° |
| C14 | C8 | C13 | O6 | 100.6° | 55.0° |
| C14 | C8 | N3 | H6 | 113.5° | 94.9° |
| C14 | C8 | C13 | H15 | 142.1° | 175.0° |
| C8 | C14 | H16 | H17 | 117.5° | 120.0° |
| C8 | C14 | C16 | H18 | 45.5° | 52.4° |
| C13 | C15 | N5 | O5 | 176.8° | 179.9° |
| C13 | C15 | N5 | C24 | 178.9° | 180.0° |
| C15 | C13 | O6 | H15 | 115.3° | 120.0° |
| C15 | C13 | C8 | H7 | 95.2° | 55.1° |
| C13 | C15 | N5 | H31 | 1.1° | 0.1° |
| C15 | C13 | O6 | H35 | 106.3° | 60.0° |
| C14 | C16 | C17 | C19 | 126.4° | 118.7° |
| C14 | C16 | C17 | H18 | 118.9° | 122.5° |
| C14 | C16 | C17 | C18 | 132.6° | 143.5° |
| C14 | C16 | C19 | N4 | 123.7° | 134.9° |
| C14 | C16 | C19 | H18 | 120.1° | 122.6° |
| C14 | C16 | C19 | O3 | 59.3° | 45.1° |
| C16 | C14 | C8 | H7 | 70.8° | 55.0° |
| C14 | C16 | C17 | H19 | 13.2° | 25.4° |
| C14 | C16 | C17 | H20 | 108.1° | 98.4° |
| C16 | C14 | H16 | H17 | 117.5° | 119.9° |
| C16 | C17 | C18 | H19 | 119.3° | 118.1° |
| C16 | C17 | C18 | H20 | 119.3° | 118.2° |
| C16 | C17 | C18 | N4 | 11.0° | 25.4° |
| C17 | C16 | C19 | N4 | 1.5° | 16.2° |
| C17 | C16 | C19 | H18 | 114.6° | 118.7° |
| C17 | C16 | C19 | O3 | 175.4° | 163.8° |
| C16 | C17 | H19 | H20 | 121.9° | 123.8° |
| C17 | C16 | C14 | H16 | 74.9° | 65.0° |
| C17 | C16 | C14 | H17 | 43.5° | 55.0° |
| C16 | C17 | C18 | H21 | 130.2° | 144.4° |
| C16 | C17 | C18 | H22 | 108.2° | 93.6° |
| C17 | C18 | N4 | H21 | 119.2° | 118.9° |
| C17 | C18 | N4 | H22 | 119.2° | 119.0° |
| C17 | C18 | N4 | C19 | 13.3° | 17.1° |
| C18 | C17 | C16 | C19 | 6.1° | 24.8° |
| C18 | C17 | H19 | H20 | 121.9° | 123.8° |
| C18 | C17 | C16 | H18 | 108.6° | 94.0° |
| C17 | C18 | H21 | H22 | 122.3° | 122.0° |
| C17 | C18 | N4 | H23 | 166.7° | 163.0° |
| C18 | N4 | C19 | H23 | 180.0° | 180.0° |
| C18 | N4 | C19 | C16 | 9.5° | 0.4° |
| C18 | N4 | C19 | O3 | 167.5° | 179.5° |
| N4 | C18 | C17 | H19 | 108.3° | 92.6° |
| N4 | C18 | C17 | H20 | 130.4° | 143.6° |
| N4 | C18 | H21 | H22 | 122.3° | 122.0° |
| N4 | C19 | C16 | O3 | 177.0° | 180.0° |
| N4 | C19 | C16 | H18 | 116.2° | 102.5° |
| C19 | N4 | C18 | H21 | 132.5° | 136.0° |
| C19 | N4 | C18 | H22 | 105.9° | 102.0° |
| C19 | C16 | C17 | H19 | 113.2° | 93.3° |
| C19 | C16 | C17 | H20 | 125.5° | 142.9° |
| C19 | C16 | C14 | H16 | 46.1° | 49.8° |
| C19 | C16 | C14 | H17 | 164.5° | 169.7° |
| C16 | C19 | N4 | H23 | 170.5° | 179.6° |
| O3 | C19 | C16 | H18 | 60.8° | 77.5° |
| O3 | C19 | N4 | H23 | 12.5° | 0.4° |
| N2 | C20 | C21 | O4 | 178.9° | 180.0° |
| N2 | C20 | C21 | C22 | 101.9° | 60.0° |
| N2 | C20 | C21 | C23 | 134.7° | 180.0° |
| N2 | C20 | C21 | H24 | 16.5° | 60.0° |
| C20 | C21 | C22 | C23 | 122.6° | 120.0° |
| C20 | C21 | C22 | H24 | 118.5° | 120.1° |
| C20 | C21 | C23 | H24 | 118.3° | 120.1° |
| C20 | C21 | C22 | H26 | 180.0° | 60.0° |
| C20 | C21 | C22 | H25 | 60.0° | 180.0° |
| C20 | C21 | C22 | H27 | 60.0° | 60.0° |
| C21 | C20 | N2 | H5 | 7.5° | 4.6° |
| C20 | C21 | C23 | H30 | 180.0° | 60.1° |
| C20 | C21 | C23 | H29 | 60.0° | 180.0° |
| C20 | C21 | C23 | H28 | 60.0° | 60.0° |
| C22 | C21 | C23 | H24 | 118.9° | 119.9° |
| C22 | C21 | C20 | O4 | 79.2° | 120.0° |
| C21 | C22 | H26 | H25 | 120.0° | 120.0° |
| C21 | C22 | H26 | H27 | 120.0° | 120.0° |
| C21 | C22 | H25 | H27 | 120.0° | 120.0° |
| C22 | C21 | C23 | H30 | 57.1° | 180.0° |
| C22 | C21 | C23 | H29 | 177.1° | 60.0° |
| C22 | C21 | C23 | H28 | 62.9° | 60.0° |
| C23 | C21 | C20 | O4 | 44.2° | 0.0° |
| C23 | C21 | C22 | H26 | 57.4° | 60.0° |
| C23 | C21 | C22 | H25 | 62.6° | 60.0° |
| C23 | C21 | C22 | H27 | 177.4° | 180.0° |
| C21 | C23 | H30 | H29 | 120.0° | 120.0° |
| C21 | C23 | H30 | H28 | 120.0° | 120.0° |
| C21 | C23 | H29 | H28 | 120.0° | 120.0° |
| C15 | N5 | C24 | H31 | 180.0° | 179.9° |
| N5 | C15 | C13 | O6 | 16.3° | 175.1° |
| N5 | C15 | C13 | H15 | 99.9° | 55.0° |
| C15 | N5 | C24 | H34 | 180.0° | 180.0° |
| C15 | N5 | C24 | H33 | 60.0° | 59.9° |
| C15 | N5 | C24 | H32 | 60.0° | 60.1° |
| C24 | N5 | C15 | O5 | 2.1° | 0.1° |
| N5 | C24 | H34 | H33 | 120.0° | 120.0° |
| N5 | C24 | H34 | H32 | 120.0° | 119.9° |
| N5 | C24 | H33 | H32 | 120.0° | 120.0° |
| O4 | C20 | C21 | H24 | 162.3° | 120.0° |
| O4 | C20 | N2 | H5 | 173.7° | 175.4° |
| O5 | C15 | C13 | O6 | 166.9° | 5.0° |
| O5 | C15 | C13 | H15 | 77.0° | 125.0° |
| O5 | C15 | N5 | H31 | 177.9° | 180.0° |
| O6 | C13 | C8 | H7 | 140.5° | 175.0° |
| H6 | N3 | C8 | H7 | 2.3° | 145.1° |
| H3 | C5 | C1 | H1 | 0.5° | 0.6° |
| H4 | C6 | C9 | H9 | 161.8° | 175.0° |
| H4 | C6 | C9 | H8 | 78.5° | 65.0° |
| H7 | C8 | C13 | H15 | 23.2° | 65.0° |
| H7 | C8 | C14 | H16 | 50.0° | 65.0° |
| H7 | C8 | C14 | H17 | 168.4° | 175.0° |
| H10 | C10 | C9 | H9 | 175.8° | 90.7° |
| H10 | C10 | C9 | H8 | 56.1° | 149.3° |
| H10 | C10 | C11 | H11 | 4.1° | 0.1° |
| H10 | C10 | C11 | H12 | 145.1° | 145.1° |
| H10 | C10 | C12 | H13 | 4.1° | 145.0° |
| H10 | C10 | C12 | H14 | 145.1° | 0.1° |
| H15 | C13 | O6 | H35 | 138.4° | 180.0° |
| H19 | C17 | C16 | H18 | 132.1° | 147.9° |
| H19 | C17 | C18 | H21 | 10.9° | 26.3° |
| H19 | C17 | C18 | H22 | 132.5° | 148.3° |
| H20 | C17 | C16 | H18 | 10.8° | 24.1° |
| H20 | C17 | C18 | H21 | 110.4° | 97.4° |
| H20 | C17 | C18 | H22 | 11.2° | 24.5° |
| H24 | C21 | C22 | H26 | 61.5° | 180.0° |
| H24 | C21 | C22 | H25 | 178.5° | 60.0° |
| H24 | C21 | C22 | H27 | 58.5° | 60.1° |
| H24 | C21 | C23 | H30 | 61.8° | 60.0° |
| H24 | C21 | C23 | H29 | 58.2° | 60.0° |
| H24 | C21 | C23 | H28 | 178.2° | 179.9° |
| H26 | C22 | H25 | H27 | 120.0° | 120.0° |
| H34 | C24 | H33 | H32 | 120.0° | 120.1° |
| H34 | C24 | N5 | H31 | 0.0° | 0.1° |
| H33 | C24 | N5 | H31 | 120.1° | 119.9° |
| H32 | C24 | N5 | H31 | 119.9° | 120.0° |
| H1 | C1 | C2 | H2 | 1.6° | 0.6° |
| H11 | C11 | C12 | H13 | 0.0° | 145.0° |
| H11 | C11 | C12 | H14 | 141.0° | 0.0° |
| H12 | C11 | C12 | H13 | 141.0° | 0.0° |
| H12 | C11 | C12 | H14 | 0.0° | 145.1° |
| H16 | C14 | C16 | H18 | 166.3° | 172.5° |
| H17 | C14 | C16 | H18 | 75.4° | 67.6° |
| H21 | C18 | N4 | H23 | 47.5° | 44.0° |
| H22 | C18 | N4 | H23 | 74.0° | 78.0° |
| H30 | C23 | H29 | H28 | 120.0° | 120.1° |
