A1CRL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.51Å | 1.49Å | |
| N1 | C2 | doub | 1.30Å | 1.35Å | Aromatic |
| N1 | N2 | sing | 1.40Å | 1.37Å | Aromatic |
| C7 | C6 | sing | 1.53Å | 1.55Å | |
| C7 | C8 | sing | 1.53Å | 1.52Å | |
| C6 | C5 | sing | 1.53Å | 1.54Å | |
| C2 | C22 | sing | 1.46Å | 1.43Å | Aromatic |
| C3 | N2 | sing | 1.46Å | 1.45Å | |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| N2 | C11 | sing | 1.37Å | 1.35Å | Aromatic |
| C22 | C11 | doub | 1.41Å | 1.42Å | Aromatic |
| C22 | C21 | sing | 1.40Å | 1.41Å | Aromatic |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C11 | N3 | sing | 1.33Å | 1.34Å | Aromatic |
| C5 | C4 | sing | 1.53Å | 1.55Å | |
| C5 | C10 | sing | 1.53Å | 1.54Å | |
| C21 | C13 | doub | 1.40Å | 1.39Å | Aromatic |
| N3 | C12 | doub | 1.31Å | 1.31Å | Aromatic |
| C9 | C10 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.40Å | 1.42Å | Aromatic |
| C13 | C14 | sing | 1.48Å | 1.48Å | |
| O1 | C14 | doub | 1.22Å | 1.24Å | |
| C14 | N4 | sing | 1.35Å | 1.35Å | |
| N4 | C15 | sing | 1.47Å | 1.45Å | |
| C15 | C16 | sing | 1.51Å | 1.50Å | |
| C16 | O2 | doub | 1.21Å | 1.21Å | |
| C16 | N5 | sing | 1.35Å | 1.32Å | |
| C17 | N5 | sing | 1.47Å | 1.46Å | |
| C17 | C18 | sing | 1.54Å | 1.51Å | |
| N5 | C20 | sing | 1.47Å | 1.47Å | |
| C18 | C19 | sing | 1.55Å | 1.52Å | |
| C20 | C19 | sing | 1.55Å | 1.53Å | |
| C21 | CL1 | sing | 1.74Å | 1.77Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H30 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| C8 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| C9 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H18 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| N4 | H20 | sing | 0.97Å | 1.00Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | N1 | 121.7° | 126.2° |
| C1 | C2 | C22 | 129.0° | 126.2° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | N1 | N2 | 107.4° | 110.2° |
| N1 | C2 | C22 | 109.2° | 107.5° |
| N1 | N2 | C3 | 119.8° | 125.4° |
| N1 | N2 | C11 | 110.9° | 109.3° |
| C6 | C7 | C8 | 114.1° | 109.4° |
| C7 | C6 | C5 | 117.2° | 109.4° |
| C7 | C6 | H10 | 107.5° | 109.5° |
| C7 | C6 | H9 | 107.5° | 109.4° |
| C6 | C7 | H11 | 108.3° | 109.5° |
| C6 | C7 | H12 | 108.3° | 109.5° |
| C7 | C8 | C9 | 114.0° | 109.5° |
| C8 | C7 | H11 | 108.3° | 109.5° |
| C8 | C7 | H12 | 108.3° | 109.5° |
| C7 | C8 | H13 | 108.3° | 109.4° |
| C7 | C8 | H14 | 108.3° | 109.4° |
| C6 | C5 | C4 | 113.0° | 109.5° |
| C6 | C5 | C10 | 112.5° | 109.4° |
| C6 | C5 | H8 | 105.9° | 109.5° |
| C5 | C6 | H10 | 107.5° | 109.5° |
| C5 | C6 | H9 | 107.5° | 109.5° |
| C2 | C22 | C11 | 105.2° | 106.5° |
| C2 | C22 | C21 | 137.2° | 134.1° |
| N2 | C3 | C4 | 112.8° | 109.5° |
| C3 | N2 | C11 | 129.3° | 125.4° |
| N2 | C3 | H4 | 108.6° | 109.5° |
| N2 | C3 | H5 | 108.6° | 109.5° |
| C3 | C4 | C5 | 121.0° | 109.5° |
| C4 | C3 | H4 | 108.6° | 109.4° |
| C4 | C3 | H5 | 108.6° | 109.5° |
| C3 | C4 | H6 | 106.5° | 109.4° |
| C3 | C4 | H7 | 106.5° | 109.4° |
| N2 | C11 | C22 | 107.3° | 106.5° |
| N2 | C11 | N3 | 128.2° | 133.2° |
| C11 | C22 | C21 | 117.6° | 119.4° |
| C22 | C11 | N3 | 124.4° | 120.3° |
| C22 | C21 | C13 | 118.0° | 117.9° |
| C22 | C21 | CL1 | 121.0° | 121.1° |
| C8 | C9 | C10 | 113.3° | 109.5° |
| C9 | C8 | H13 | 108.3° | 109.5° |
| C9 | C8 | H14 | 108.3° | 109.5° |
| C8 | C9 | H15 | 108.5° | 109.5° |
| C8 | C9 | H16 | 108.5° | 109.5° |
| C11 | N3 | C12 | 117.3° | 121.9° |
| C4 | C5 | C10 | 113.0° | 109.5° |
| C5 | C4 | H6 | 106.5° | 109.5° |
| C5 | C4 | H7 | 106.5° | 109.5° |
| C4 | C5 | H8 | 105.7° | 109.5° |
| C5 | C10 | C9 | 114.0° | 109.5° |
| C10 | C5 | H8 | 105.8° | 109.5° |
| C5 | C10 | H18 | 108.3° | 109.5° |
| C5 | C10 | H17 | 108.3° | 109.5° |
| C21 | C13 | C12 | 118.7° | 119.2° |
| C21 | C13 | C14 | 120.1° | 120.4° |
| C13 | C21 | CL1 | 120.9° | 121.0° |
| N3 | C12 | C13 | 123.8° | 121.4° |
| N3 | C12 | H19 | 118.1° | 119.3° |
| C10 | C9 | H15 | 108.5° | 109.5° |
| C10 | C9 | H16 | 108.5° | 109.5° |
| C9 | C10 | H18 | 108.3° | 109.5° |
| C9 | C10 | H17 | 108.3° | 109.5° |
| C12 | C13 | C14 | 121.0° | 120.5° |
| C13 | C12 | H19 | 118.1° | 119.3° |
| C13 | C14 | O1 | 123.0° | 120.0° |
| C13 | C14 | N4 | 112.6° | 119.9° |
| O1 | C14 | N4 | 122.9° | 120.1° |
| C14 | N4 | C15 | 121.4° | 120.0° |
| C14 | N4 | H20 | 119.3° | 120.0° |
| N4 | C15 | C16 | 112.9° | 109.5° |
| C15 | N4 | H20 | 119.3° | 120.0° |
| N4 | C15 | H21 | 108.6° | 109.5° |
| N4 | C15 | H22 | 108.6° | 109.5° |
| C15 | C16 | O2 | 122.0° | 120.0° |
| C15 | C16 | N5 | 118.3° | 120.0° |
| C16 | C15 | H21 | 108.6° | 109.4° |
| C16 | C15 | H22 | 108.6° | 109.5° |
| O2 | C16 | N5 | 119.7° | 120.0° |
| C16 | N5 | C17 | 126.2° | 125.7° |
| C16 | N5 | C20 | 122.0° | 125.6° |
| N5 | C17 | C18 | 104.1° | 107.2° |
| C17 | N5 | C20 | 111.8° | 108.7° |
| N5 | C17 | H23 | 110.8° | 109.9° |
| N5 | C17 | H24 | 110.8° | 109.9° |
| C17 | C18 | C19 | 104.8° | 103.0° |
| C18 | C17 | H23 | 110.8° | 109.9° |
| C18 | C17 | H24 | 110.8° | 109.9° |
| C17 | C18 | H25 | 110.6° | 110.7° |
| C17 | C18 | H26 | 110.6° | 110.7° |
| N5 | C20 | C19 | 103.8° | 104.8° |
| N5 | C20 | H30 | 110.9° | 110.4° |
| N5 | C20 | H29 | 110.9° | 110.4° |
| C18 | C19 | C20 | 103.3° | 101.6° |
| C19 | C18 | H25 | 110.7° | 110.7° |
| C19 | C18 | H26 | 110.6° | 110.7° |
| C18 | C19 | H27 | 111.0° | 111.0° |
| C18 | C19 | H28 | 111.0° | 111.1° |
| C19 | C20 | H30 | 110.8° | 110.4° |
| C19 | C20 | H29 | 110.9° | 110.3° |
| C20 | C19 | H27 | 111.0° | 111.0° |
| C20 | C19 | H28 | 111.0° | 111.0° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H1 | 109.5° | 109.4° |
| H3 | C1 | H1 | 109.5° | 109.5° |
| H4 | C3 | H5 | 109.5° | 109.4° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H10 | C6 | H9 | 109.5° | 109.5° |
| H11 | C7 | H12 | 109.5° | 109.5° |
| H30 | C20 | H29 | 109.5° | 110.3° |
| H13 | C8 | H14 | 109.5° | 109.4° |
| H15 | C9 | H16 | 109.5° | 109.5° |
| H18 | C10 | H17 | 109.5° | 109.4° |
| H21 | C15 | H22 | 109.4° | 109.6° |
| H23 | C17 | H24 | 109.5° | 110.0° |
| H25 | C18 | H26 | 109.5° | 110.8° |
| H27 | C19 | H28 | 109.4° | 110.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | N1 | C22 | 176.2° | 179.6° |
| C1 | C2 | N1 | N2 | 176.6° | 179.9° |
| C1 | C2 | C22 | C11 | 175.4° | 180.0° |
| C1 | C2 | C22 | C21 | 3.3° | 0.2° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H1 | 120.0° | 120.0° |
| C2 | C1 | H3 | H1 | 120.0° | 120.1° |
| C2 | N1 | N2 | C3 | 179.4° | 179.8° |
| C2 | N1 | N2 | C11 | 1.2° | 0.2° |
| N1 | C2 | C22 | C11 | 0.4° | 0.3° |
| N1 | C2 | C22 | C21 | 179.1° | 179.8° |
| N1 | C2 | C1 | H2 | 0.0° | 90.4° |
| N1 | C2 | C1 | H3 | 120.0° | 29.6° |
| N1 | C2 | C1 | H1 | 120.0° | 149.7° |
| N2 | N1 | C2 | C22 | 0.5° | 0.3° |
| N1 | N2 | C3 | C11 | 177.8° | 179.9° |
| N1 | N2 | C3 | C4 | 100.9° | 90.0° |
| N1 | N2 | C11 | C22 | 1.5° | 0.1° |
| N1 | N2 | C11 | N3 | 180.0° | 179.8° |
| N1 | N2 | C3 | H4 | 138.5° | 150.0° |
| N1 | N2 | C3 | H5 | 19.6° | 30.0° |
| C6 | C7 | C8 | H11 | 120.7° | 120.0° |
| C6 | C7 | C8 | H12 | 120.7° | 120.0° |
| C7 | C6 | C5 | H10 | 121.1° | 120.0° |
| C7 | C6 | C5 | H9 | 121.1° | 119.9° |
| C6 | C7 | C8 | C9 | 7.7° | 60.0° |
| C7 | C6 | C5 | C4 | 160.7° | 180.0° |
| C7 | C6 | C5 | C10 | 31.1° | 60.0° |
| C7 | C6 | C5 | H8 | 84.0° | 60.0° |
| C7 | C6 | H10 | H9 | 116.5° | 120.0° |
| C6 | C7 | H11 | H12 | 117.9° | 120.0° |
| C6 | C7 | C8 | H13 | 112.9° | 60.0° |
| C6 | C7 | C8 | H14 | 128.4° | 179.9° |
| C8 | C7 | C6 | C5 | 46.0° | 60.0° |
| C7 | C8 | C9 | H13 | 120.6° | 120.0° |
| C7 | C8 | C9 | H14 | 120.7° | 120.0° |
| C7 | C8 | C9 | C10 | 42.2° | 60.0° |
| C8 | C7 | C6 | H10 | 167.1° | 60.0° |
| C8 | C7 | C6 | H9 | 75.1° | 180.0° |
| C8 | C7 | H11 | H12 | 117.8° | 120.0° |
| C7 | C8 | H13 | H14 | 117.9° | 119.9° |
| C7 | C8 | C9 | H15 | 78.4° | 180.0° |
| C7 | C8 | C9 | H16 | 162.7° | 60.0° |
| C6 | C5 | C4 | C3 | 19.1° | 65.0° |
| C6 | C5 | C4 | C10 | 129.3° | 119.9° |
| C6 | C5 | C4 | H8 | 115.4° | 120.0° |
| C6 | C5 | C10 | H8 | 115.2° | 120.0° |
| C6 | C5 | C10 | C9 | 19.5° | 60.0° |
| C6 | C5 | C4 | H6 | 140.7° | 175.0° |
| C6 | C5 | C4 | H7 | 102.5° | 54.9° |
| C5 | C6 | H10 | H9 | 116.5° | 120.0° |
| C5 | C6 | C7 | H11 | 166.7° | 180.0° |
| C5 | C6 | C7 | H12 | 74.7° | 60.0° |
| C6 | C5 | C10 | H18 | 101.2° | 179.9° |
| C6 | C5 | C10 | H17 | 140.2° | 60.0° |
| C2 | C22 | C11 | N2 | 1.1° | 0.2° |
| C2 | C22 | C11 | C21 | 179.0° | 179.8° |
| C2 | C22 | C11 | N3 | 179.7° | 180.0° |
| C2 | C22 | C21 | C13 | 178.5° | 179.9° |
| C2 | C22 | C21 | CL1 | 2.2° | 0.2° |
| C22 | C2 | C1 | H2 | 175.3° | 90.1° |
| C22 | C2 | C1 | H3 | 64.7° | 149.9° |
| C22 | C2 | C1 | H1 | 55.3° | 29.9° |
| N2 | C3 | C4 | H4 | 120.5° | 120.1° |
| N2 | C3 | C4 | H5 | 120.5° | 120.0° |
| C3 | N2 | C11 | C22 | 179.4° | 180.0° |
| C3 | N2 | C11 | N3 | 2.1° | 0.3° |
| N2 | C3 | C4 | C5 | 138.7° | 180.0° |
| N2 | C3 | H4 | H5 | 118.5° | 120.0° |
| N2 | C3 | C4 | H6 | 17.1° | 60.0° |
| N2 | C3 | C4 | H7 | 99.7° | 60.0° |
| C4 | C3 | N2 | C11 | 76.8° | 90.0° |
| C3 | C4 | C5 | H6 | 121.6° | 119.9° |
| C3 | C4 | C5 | H7 | 121.6° | 119.9° |
| C3 | C4 | C5 | C10 | 148.4° | 175.0° |
| C4 | C3 | H4 | H5 | 118.5° | 119.9° |
| C3 | C4 | H6 | H7 | 114.8° | 120.0° |
| C3 | C4 | C5 | H8 | 96.3° | 55.0° |
| N2 | C11 | C22 | N3 | 178.6° | 179.8° |
| N2 | C11 | C22 | C21 | 179.8° | 179.9° |
| N2 | C11 | N3 | C12 | 177.8° | 179.8° |
| C11 | N2 | C3 | H4 | 43.7° | 30.0° |
| C11 | N2 | C3 | H5 | 162.7° | 150.0° |
| C11 | C22 | C21 | C13 | 0.1° | 0.1° |
| C22 | C11 | N3 | C12 | 0.5° | 0.1° |
| C11 | C22 | C21 | CL1 | 179.2° | 180.0° |
| C21 | C22 | C11 | N3 | 1.3° | 0.1° |
| C22 | C21 | C13 | CL1 | 179.3° | 179.9° |
| C22 | C21 | C13 | C12 | 3.0° | 0.0° |
| C22 | C21 | C13 | C14 | 179.6° | 180.0° |
| C8 | C9 | C10 | C5 | 57.6° | 60.0° |
| C8 | C9 | C10 | H15 | 120.5° | 120.0° |
| C8 | C9 | C10 | H16 | 120.6° | 120.0° |
| C9 | C8 | C7 | H11 | 128.4° | 180.0° |
| C9 | C8 | C7 | H12 | 113.0° | 60.0° |
| C9 | C8 | H13 | H14 | 118.0° | 120.1° |
| C8 | C9 | H15 | H16 | 118.3° | 120.0° |
| C8 | C9 | C10 | H18 | 63.0° | 180.0° |
| C8 | C9 | C10 | H17 | 178.3° | 60.0° |
| C11 | N3 | C12 | C13 | 3.6° | 0.0° |
| C11 | N3 | C12 | H19 | 176.3° | 180.0° |
| C4 | C5 | C10 | H8 | 115.3° | 120.0° |
| C4 | C5 | C10 | C9 | 110.1° | 180.0° |
| C5 | C4 | C3 | H4 | 100.7° | 59.9° |
| C5 | C4 | C3 | H5 | 18.2° | 60.0° |
| C5 | C4 | H6 | H7 | 114.8° | 120.1° |
| C4 | C5 | C6 | H10 | 78.2° | 60.0° |
| C4 | C5 | C6 | H9 | 39.6° | 60.1° |
| C4 | C5 | C10 | H18 | 129.3° | 60.0° |
| C4 | C5 | C10 | H17 | 10.6° | 60.0° |
| C5 | C10 | C9 | H18 | 120.6° | 120.0° |
| C5 | C10 | C9 | H17 | 120.7° | 120.0° |
| C10 | C5 | C4 | H6 | 90.0° | 55.1° |
| C10 | C5 | C4 | H7 | 26.8° | 65.0° |
| C10 | C5 | C6 | H10 | 152.2° | 60.0° |
| C10 | C5 | C6 | H9 | 90.0° | 180.0° |
| C5 | C10 | C9 | H15 | 62.9° | 180.0° |
| C5 | C10 | C9 | H16 | 178.2° | 60.0° |
| C5 | C10 | H18 | H17 | 117.9° | 120.0° |
| C21 | C13 | C12 | N3 | 5.0° | 0.0° |
| C21 | C13 | C12 | C14 | 176.6° | 180.0° |
| C21 | C13 | C14 | O1 | 120.1° | 0.1° |
| C21 | C13 | C14 | N4 | 73.8° | 179.9° |
| C21 | C13 | C12 | H19 | 175.0° | 180.0° |
| N3 | C12 | C13 | H19 | 180.0° | 179.9° |
| N3 | C12 | C13 | C14 | 178.4° | 179.9° |
| C9 | C10 | C5 | H8 | 134.6° | 60.0° |
| C10 | C9 | C8 | H13 | 162.8° | 60.0° |
| C10 | C9 | C8 | H14 | 78.5° | 180.0° |
| C10 | C9 | H15 | H16 | 118.3° | 120.0° |
| C9 | C10 | H18 | H17 | 117.9° | 120.0° |
| C12 | C13 | C14 | O1 | 56.5° | 180.0° |
| C12 | C13 | C14 | N4 | 109.6° | 0.0° |
| C12 | C13 | C21 | CL1 | 176.3° | 180.0° |
| C13 | C14 | O1 | N4 | 164.7° | 180.0° |
| C13 | C14 | N4 | C15 | 172.6° | 179.9° |
| C14 | C13 | C21 | CL1 | 0.3° | 0.1° |
| C14 | C13 | C12 | H19 | 1.6° | 0.0° |
| C13 | C14 | N4 | H20 | 7.4° | 0.0° |
| O1 | C14 | N4 | C15 | 6.4° | 0.0° |
| O1 | C14 | N4 | H20 | 173.6° | 180.0° |
| C14 | N4 | C15 | H20 | 180.0° | 179.9° |
| C14 | N4 | C15 | C16 | 154.8° | 180.0° |
| C14 | N4 | C15 | H21 | 84.6° | 60.1° |
| C14 | N4 | C15 | H22 | 34.3° | 60.0° |
| N4 | C15 | C16 | H21 | 120.5° | 120.0° |
| N4 | C15 | C16 | H22 | 120.5° | 120.0° |
| N4 | C15 | C16 | O2 | 22.2° | 0.0° |
| N4 | C15 | C16 | N5 | 159.9° | 180.0° |
| N4 | C15 | H21 | H22 | 118.4° | 120.0° |
| C15 | C16 | O2 | N5 | 177.9° | 180.0° |
| C15 | C16 | N5 | C17 | 1.4° | 0.0° |
| C15 | C16 | N5 | C20 | 179.1° | 180.0° |
| C16 | C15 | N4 | H20 | 25.2° | 0.1° |
| C16 | C15 | H21 | H22 | 118.4° | 120.0° |
| O2 | C16 | N5 | C17 | 179.4° | 180.0° |
| O2 | C16 | N5 | C20 | 3.0° | 0.0° |
| O2 | C16 | C15 | H21 | 142.7° | 120.0° |
| O2 | C16 | C15 | H22 | 98.4° | 120.0° |
| C16 | N5 | C17 | C20 | 177.9° | 180.0° |
| C16 | N5 | C17 | C18 | 172.2° | 178.9° |
| C16 | N5 | C20 | C19 | 166.0° | 155.9° |
| C16 | N5 | C20 | H30 | 75.0° | 37.0° |
| C16 | N5 | C20 | H29 | 46.9° | 85.3° |
| N5 | C16 | C15 | H21 | 39.4° | 60.0° |
| N5 | C16 | C15 | H22 | 79.5° | 60.0° |
| C16 | N5 | C17 | H23 | 68.6° | 61.7° |
| C16 | N5 | C17 | H24 | 53.0° | 59.5° |
| N5 | C17 | C18 | H23 | 119.1° | 119.4° |
| N5 | C17 | C18 | H24 | 119.1° | 119.4° |
| N5 | C17 | C18 | C19 | 28.1° | 22.2° |
| C17 | N5 | C20 | C19 | 12.0° | 24.1° |
| C17 | N5 | C20 | H30 | 107.1° | 143.0° |
| C17 | N5 | C20 | H29 | 131.1° | 94.7° |
| N5 | C17 | H23 | H24 | 122.5° | 121.1° |
| N5 | C17 | C18 | H25 | 147.4° | 96.2° |
| N5 | C17 | C18 | H26 | 91.2° | 140.6° |
| C18 | C17 | N5 | C20 | 10.0° | 1.0° |
| C17 | C18 | C19 | H25 | 119.3° | 118.4° |
| C17 | C18 | C19 | H26 | 119.3° | 118.3° |
| C17 | C18 | C19 | C20 | 35.4° | 35.5° |
| C18 | C17 | H23 | H24 | 122.5° | 121.1° |
| C17 | C18 | H25 | H26 | 122.1° | 123.2° |
| C17 | C18 | C19 | H27 | 83.6° | 82.6° |
| C17 | C18 | C19 | H28 | 154.4° | 153.6° |
| N5 | C20 | C19 | C18 | 28.7° | 37.0° |
| N5 | C20 | C19 | H30 | 119.1° | 118.8° |
| N5 | C20 | C19 | H29 | 119.1° | 118.9° |
| N5 | C20 | H30 | H29 | 122.7° | 122.3° |
| C20 | N5 | C17 | H23 | 109.2° | 118.4° |
| C20 | N5 | C17 | H24 | 129.1° | 120.5° |
| N5 | C20 | C19 | H27 | 90.3° | 81.1° |
| N5 | C20 | C19 | H28 | 147.8° | 155.1° |
| C18 | C19 | C20 | H27 | 119.0° | 118.1° |
| C18 | C19 | C20 | H28 | 119.0° | 118.1° |
| C18 | C19 | C20 | H30 | 90.4° | 155.8° |
| C18 | C19 | C20 | H29 | 147.8° | 81.9° |
| C19 | C18 | C17 | H23 | 91.1° | 141.6° |
| C19 | C18 | C17 | H24 | 147.2° | 97.2° |
| C19 | C18 | H25 | H26 | 122.1° | 123.3° |
| C18 | C19 | H27 | H28 | 122.9° | 124.0° |
| C19 | C20 | H30 | H29 | 122.6° | 122.2° |
| C20 | C19 | C18 | H25 | 154.7° | 82.9° |
| C20 | C19 | C18 | H26 | 83.9° | 153.8° |
| C20 | C19 | H27 | H28 | 122.9° | 123.8° |
| H2 | C1 | H3 | H1 | 120.0° | 120.0° |
| H4 | C3 | C4 | H6 | 137.6° | 60.0° |
| H4 | C3 | C4 | H7 | 20.9° | 179.9° |
| H5 | C3 | C4 | H6 | 103.4° | 180.0° |
| H5 | C3 | C4 | H7 | 139.9° | 60.0° |
| H6 | C4 | C5 | H8 | 25.3° | 64.9° |
| H7 | C4 | C5 | H8 | 142.1° | 175.0° |
| H8 | C5 | C6 | H10 | 37.1° | 180.0° |
| H8 | C5 | C6 | H9 | 154.9° | 60.0° |
| H8 | C5 | C10 | H18 | 14.0° | 60.0° |
| H8 | C5 | C10 | H17 | 104.7° | 180.0° |
| H10 | C6 | C7 | H11 | 72.2° | 60.0° |
| H10 | C6 | C7 | H12 | 46.4° | 180.0° |
| H9 | C6 | C7 | H11 | 45.6° | 60.0° |
| H9 | C6 | C7 | H12 | 164.2° | 60.0° |
| H11 | C7 | C8 | H13 | 7.8° | 59.9° |
| H11 | C7 | C8 | H14 | 110.9° | 60.0° |
| H12 | C7 | C8 | H13 | 126.4° | 180.0° |
| H12 | C7 | C8 | H14 | 7.7° | 60.1° |
| H30 | C20 | C19 | H27 | 150.6° | 37.7° |
| H30 | C20 | C19 | H28 | 28.7° | 86.0° |
| H29 | C20 | C19 | H27 | 28.8° | 160.0° |
| H29 | C20 | C19 | H28 | 93.1° | 36.2° |
| H13 | C8 | C9 | H15 | 42.3° | 60.0° |
| H13 | C8 | C9 | H16 | 76.7° | 180.0° |
| H14 | C8 | C9 | H15 | 160.9° | 60.0° |
| H14 | C8 | C9 | H16 | 42.0° | 60.0° |
| H15 | C9 | C10 | H18 | 176.5° | 60.0° |
| H15 | C9 | C10 | H17 | 57.8° | 60.0° |
| H16 | C9 | C10 | H18 | 57.6° | 60.0° |
| H16 | C9 | C10 | H17 | 61.1° | 180.0° |
| H20 | N4 | C15 | H21 | 95.4° | 120.0° |
| H20 | N4 | C15 | H22 | 145.7° | 119.9° |
| H23 | C17 | C18 | H25 | 28.2° | 23.2° |
| H23 | C17 | C18 | H26 | 149.7° | 100.0° |
| H24 | C17 | C18 | H25 | 93.5° | 144.4° |
| H24 | C17 | C18 | H26 | 28.0° | 21.1° |
| H25 | C18 | C19 | H27 | 35.7° | 159.1° |
| H25 | C18 | C19 | H28 | 86.3° | 35.2° |
| H26 | C18 | C19 | H27 | 157.1° | 35.8° |
| H26 | C18 | C19 | H28 | 35.2° | 88.1° |
