A1IC7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.38Å | 1.31Å | |
| C1 | N2 | doub | 1.33Å | 1.36Å | Aromatic |
| N2 | C2 | sing | 1.32Å | 1.34Å | Aromatic |
| C2 | N3 | doub | 1.32Å | 1.33Å | Aromatic |
| N3 | C3 | sing | 1.33Å | 1.33Å | Aromatic |
| C3 | C4 | doub | 1.40Å | 1.38Å | Aromatic |
| C4 | N4 | sing | 1.36Å | 1.38Å | Aromatic |
| N4 | C5 | doub | 1.30Å | 1.32Å | Aromatic |
| C5 | N5 | sing | 1.36Å | 1.36Å | Aromatic |
| N5 | C6 | sing | 1.47Å | 1.45Å | |
| C6 | O1 | sing | 1.44Å | 1.42Å | |
| O1 | C7 | sing | 1.44Å | 1.44Å | |
| C7 | C8 | sing | 1.53Å | 1.51Å | |
| C8 | N6 | sing | 1.47Å | 1.51Å | |
| N6 | C9 | sing | 1.47Å | 1.50Å | |
| C9 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.53Å | 1.54Å | |
| C11 | N7 | sing | 1.47Å | 1.49Å | |
| C11 | C12 | sing | 1.51Å | 1.54Å | |
| C12 | O2 | doub | 1.21Å | 1.24Å | |
| C12 | O3 | sing | 1.34Å | 1.23Å | |
| N6 | C13 | sing | 1.47Å | 1.41Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C15 | N8 | sing | 1.47Å | 1.49Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C16 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.37Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.36Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C22 | sing | 1.54Å | 1.53Å | |
| C22 | O4 | sing | 1.43Å | 1.43Å | |
| C22 | C23 | sing | 1.54Å | 1.54Å | |
| C23 | O5 | sing | 1.43Å | 1.42Å | |
| C1 | C4 | sing | 1.41Å | 1.41Å | Aromatic |
| C6 | C23 | sing | 1.54Å | 1.53Å | |
| C3 | N5 | sing | 1.37Å | 1.37Å | Aromatic |
| C16 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C2 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C13 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.08Å | 1.08Å | |
| C19 | H26 | sing | 1.08Å | 1.08Å | |
| C21 | H28 | sing | 1.08Å | 1.08Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| N7 | H14 | sing | 1.01Å | 1.00Å | |
| N7 | H15 | sing | 1.01Å | 1.00Å | |
| O3 | H34 | sing | 0.97Å | 0.95Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| N8 | H23 | sing | 1.01Å | 1.00Å | |
| N8 | H35 | sing | 1.01Å | 1.00Å | |
| C18 | H25 | sing | 1.08Å | 1.08Å | |
| C20 | H27 | sing | 1.08Å | 1.08Å | |
| O4 | H30 | sing | 0.97Å | 0.95Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| O5 | H32 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C1 | N2 | 118.5° | 120.7° |
| N1 | C1 | C4 | 123.2° | 120.8° |
| C1 | N1 | H2 | 109.5° | 120.0° |
| C1 | N1 | H1 | 109.5° | 120.0° |
| C1 | N2 | C2 | 117.7° | 121.2° |
| N2 | C1 | C4 | 118.2° | 118.4° |
| N2 | C2 | N3 | 128.7° | 122.4° |
| N2 | C2 | H3 | 115.7° | 118.8° |
| C2 | N3 | C3 | 112.0° | 120.7° |
| N3 | C2 | H3 | 115.6° | 118.8° |
| N3 | C3 | C4 | 126.4° | 119.0° |
| N3 | C3 | N5 | 127.0° | 134.9° |
| C3 | C4 | N4 | 109.6° | 107.1° |
| C3 | C4 | C1 | 117.0° | 118.2° |
| C4 | C3 | N5 | 106.5° | 106.1° |
| C4 | N4 | C5 | 104.9° | 109.4° |
| N4 | C4 | C1 | 133.4° | 134.7° |
| N4 | C5 | N5 | 112.9° | 110.0° |
| N4 | C5 | H4 | 123.5° | 125.0° |
| C5 | N5 | C6 | 128.8° | 126.3° |
| C5 | N5 | C3 | 105.9° | 107.4° |
| N5 | C5 | H4 | 123.5° | 125.0° |
| N5 | C6 | O1 | 107.6° | 110.3° |
| N5 | C6 | C23 | 114.8° | 110.4° |
| C6 | N5 | C3 | 125.2° | 126.3° |
| N5 | C6 | H5 | 109.8° | 110.4° |
| C6 | O1 | C7 | 108.2° | 105.2° |
| O1 | C6 | C23 | 105.5° | 104.8° |
| O1 | C6 | H5 | 110.3° | 110.5° |
| O1 | C7 | C8 | 108.8° | 110.4° |
| O1 | C7 | C22 | 105.9° | 104.8° |
| O1 | C7 | H6 | 108.9° | 110.4° |
| C7 | C8 | N6 | 113.6° | 109.5° |
| C8 | C7 | C22 | 117.3° | 110.4° |
| C8 | C7 | H6 | 108.0° | 110.3° |
| C7 | C8 | H7 | 108.4° | 109.5° |
| C7 | C8 | H8 | 108.4° | 109.4° |
| C8 | N6 | C9 | 111.1° | 111.0° |
| C8 | N6 | C13 | 112.3° | 111.0° |
| N6 | C8 | H7 | 108.4° | 109.5° |
| N6 | C8 | H8 | 108.4° | 109.5° |
| N6 | C9 | C10 | 112.3° | 109.4° |
| C9 | N6 | C13 | 110.3° | 111.0° |
| N6 | C9 | H9 | 108.8° | 109.5° |
| N6 | C9 | H10 | 108.8° | 109.4° |
| C9 | C10 | C11 | 116.5° | 109.4° |
| C10 | C9 | H9 | 108.8° | 109.5° |
| C10 | C9 | H10 | 108.7° | 109.5° |
| C9 | C10 | H11 | 107.7° | 109.5° |
| C9 | C10 | H12 | 107.7° | 109.5° |
| C10 | C11 | N7 | 111.8° | 109.5° |
| C10 | C11 | C12 | 112.5° | 109.5° |
| C11 | C10 | H11 | 107.7° | 109.5° |
| C11 | C10 | H12 | 107.7° | 109.4° |
| C10 | C11 | H13 | 107.6° | 109.5° |
| N7 | C11 | C12 | 109.1° | 109.4° |
| N7 | C11 | H13 | 108.2° | 109.5° |
| C11 | N7 | H14 | 109.5° | 111.0° |
| C11 | N7 | H15 | 109.5° | 111.0° |
| C11 | C12 | O2 | 116.7° | 120.0° |
| C11 | C12 | O3 | 117.5° | 120.0° |
| C12 | C11 | H13 | 107.6° | 109.5° |
| O2 | C12 | O3 | 125.8° | 120.0° |
| C12 | O3 | H34 | 109.5° | 117.0° |
| N6 | C13 | C14 | 113.2° | 109.5° |
| N6 | C13 | H17 | 108.5° | 109.5° |
| N6 | C13 | H18 | 108.6° | 109.5° |
| C13 | C14 | C15 | 112.4° | 109.5° |
| C14 | C13 | H17 | 108.6° | 109.5° |
| C14 | C13 | H18 | 108.5° | 109.5° |
| C13 | C14 | H19 | 108.8° | 109.5° |
| C13 | C14 | H20 | 108.7° | 109.5° |
| C14 | C15 | N8 | 109.2° | 109.4° |
| C14 | C15 | C16 | 115.2° | 109.5° |
| C14 | C15 | H21 | 109.2° | 109.5° |
| C15 | C14 | H19 | 108.7° | 109.5° |
| C15 | C14 | H20 | 108.8° | 109.5° |
| N8 | C15 | C16 | 104.3° | 109.5° |
| N8 | C15 | H21 | 109.5° | 109.4° |
| C15 | N8 | H23 | 109.5° | 111.0° |
| C15 | N8 | H35 | 109.4° | 111.0° |
| C15 | C16 | C17 | 119.5° | 120.0° |
| C15 | C16 | C21 | 119.3° | 120.0° |
| C16 | C15 | H21 | 109.4° | 109.5° |
| C16 | C17 | C18 | 120.8° | 120.0° |
| C17 | C16 | C21 | 119.1° | 120.0° |
| C16 | C17 | H24 | 119.6° | 120.0° |
| C17 | C18 | C19 | 119.4° | 120.0° |
| C18 | C17 | H24 | 119.6° | 120.0° |
| C17 | C18 | H25 | 120.3° | 120.0° |
| C18 | C19 | C20 | 119.9° | 120.0° |
| C18 | C19 | H26 | 120.0° | 120.0° |
| C19 | C18 | H25 | 120.3° | 120.0° |
| C19 | C20 | C21 | 120.8° | 120.0° |
| C20 | C19 | H26 | 120.1° | 120.0° |
| C19 | C20 | H27 | 119.6° | 120.0° |
| C20 | C21 | C16 | 118.5° | 120.0° |
| C20 | C21 | H28 | 120.7° | 120.0° |
| C21 | C20 | H27 | 119.6° | 120.0° |
| C7 | C22 | O4 | 111.0° | 110.5° |
| C7 | C22 | C23 | 104.9° | 104.0° |
| C7 | C22 | H29 | 108.2° | 110.6° |
| C22 | C7 | H6 | 107.7° | 110.5° |
| O4 | C22 | C23 | 114.6° | 110.5° |
| O4 | C22 | H29 | 109.6° | 110.5° |
| C22 | O4 | H30 | 109.5° | 114.0° |
| C22 | C23 | O5 | 116.6° | 110.5° |
| C22 | C23 | C6 | 99.7° | 104.1° |
| C23 | C22 | H29 | 108.2° | 110.5° |
| C22 | C23 | H31 | 107.6° | 110.5° |
| O5 | C23 | C6 | 115.4° | 110.5° |
| O5 | C23 | H31 | 109.1° | 110.6° |
| C23 | O5 | H32 | 109.5° | 114.0° |
| C23 | C6 | H5 | 108.7° | 110.4° |
| C6 | C23 | H31 | 107.7° | 110.5° |
| C16 | C21 | H28 | 120.7° | 120.0° |
| H9 | C9 | H10 | 109.5° | 109.5° |
| H17 | C13 | H18 | 109.5° | 109.5° |
| H2 | N1 | H1 | 109.5° | 120.0° |
| H7 | C8 | H8 | 109.5° | 109.5° |
| H11 | C10 | H12 | 109.4° | 109.5° |
| H14 | N7 | H15 | 109.4° | 111.0° |
| H19 | C14 | H20 | 109.4° | 109.4° |
| H23 | N8 | H35 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | N2 | C4 | 175.7° | 179.8° |
| N1 | C1 | N2 | C2 | 176.7° | 179.7° |
| N1 | C1 | C4 | C3 | 177.5° | 179.7° |
| N1 | C1 | C4 | N4 | 3.5° | 0.2° |
| C1 | N1 | H2 | H1 | 120.0° | 179.9° |
| C1 | N2 | C2 | N3 | 0.5° | 0.1° |
| N2 | C1 | C4 | C3 | 2.1° | 0.0° |
| N2 | C1 | C4 | N4 | 179.0° | 180.0° |
| C1 | N2 | C2 | H3 | 179.5° | 180.0° |
| N2 | C1 | N1 | H2 | 0.0° | 0.1° |
| N2 | C1 | N1 | H1 | 120.0° | 180.0° |
| N2 | C2 | N3 | H3 | 180.0° | 179.9° |
| N2 | C2 | N3 | C3 | 0.9° | 0.0° |
| C2 | N2 | C1 | C4 | 1.0° | 0.1° |
| C2 | N3 | C3 | C4 | 0.4° | 0.0° |
| C2 | N3 | C3 | N5 | 177.2° | 180.0° |
| N3 | C3 | C4 | N5 | 177.3° | 180.0° |
| N3 | C3 | C4 | N4 | 179.0° | 179.9° |
| N3 | C3 | N5 | C5 | 177.9° | 179.9° |
| N3 | C3 | N5 | C6 | 4.9° | 0.0° |
| N3 | C3 | C4 | C1 | 1.8° | 0.0° |
| C3 | N3 | C2 | H3 | 179.1° | 180.0° |
| C3 | C4 | N4 | C1 | 179.0° | 179.9° |
| C3 | C4 | N4 | C5 | 2.0° | 0.0° |
| C4 | C3 | N5 | C5 | 0.6° | 0.1° |
| C4 | C3 | N5 | C6 | 177.8° | 180.0° |
| C4 | N4 | C5 | N5 | 1.7° | 0.0° |
| N4 | C4 | C3 | N5 | 1.6° | 0.0° |
| C4 | N4 | C5 | H4 | 178.3° | 180.0° |
| N4 | C5 | N5 | H4 | 180.0° | 180.0° |
| N4 | C5 | N5 | C6 | 176.4° | 180.0° |
| C5 | N4 | C4 | C1 | 179.0° | 179.9° |
| N4 | C5 | N5 | C3 | 0.7° | 0.1° |
| C5 | N5 | C6 | C3 | 176.5° | 179.9° |
| C5 | N5 | C6 | O1 | 77.2° | 28.7° |
| C5 | N5 | C6 | C23 | 39.9° | 86.7° |
| C5 | N5 | C6 | H5 | 162.8° | 151.0° |
| N5 | C6 | O1 | C23 | 123.0° | 118.8° |
| N5 | C6 | O1 | H5 | 119.7° | 122.3° |
| N5 | C6 | O1 | C7 | 158.0° | 159.4° |
| N5 | C6 | C23 | C22 | 158.1° | 142.8° |
| N5 | C6 | C23 | O5 | 76.2° | 98.6° |
| N5 | C6 | C23 | H5 | 123.4° | 122.3° |
| C6 | N5 | C5 | H4 | 3.6° | 0.1° |
| N5 | C6 | C23 | H31 | 45.9° | 24.1° |
| C6 | O1 | C7 | C8 | 141.5° | 159.4° |
| C6 | O1 | C7 | C22 | 14.6° | 40.6° |
| O1 | C6 | C23 | C22 | 39.7° | 24.0° |
| O1 | C6 | C23 | O5 | 165.5° | 142.7° |
| O1 | C6 | C23 | H5 | 118.3° | 118.9° |
| O1 | C6 | N5 | C3 | 99.3° | 151.4° |
| C6 | O1 | C7 | H6 | 101.1° | 78.4° |
| O1 | C6 | C23 | H31 | 72.4° | 94.6° |
| O1 | C7 | C8 | C22 | 120.1° | 115.4° |
| O1 | C7 | C8 | H6 | 118.0° | 122.3° |
| O1 | C7 | C8 | N6 | 173.4° | 68.4° |
| O1 | C7 | C22 | H6 | 116.4° | 118.9° |
| O1 | C7 | C22 | O4 | 113.2° | 142.6° |
| O1 | C7 | C22 | C23 | 11.0° | 24.0° |
| C7 | O1 | C6 | C23 | 35.0° | 40.6° |
| C7 | O1 | C6 | H5 | 82.3° | 78.3° |
| O1 | C7 | C22 | H29 | 126.4° | 94.7° |
| O1 | C7 | C8 | H7 | 66.0° | 171.6° |
| O1 | C7 | C8 | H8 | 52.8° | 51.6° |
| C7 | C8 | N6 | H7 | 120.6° | 120.0° |
| C7 | C8 | N6 | H8 | 120.6° | 120.0° |
| C7 | C8 | N6 | C9 | 79.4° | 78.2° |
| C7 | C8 | N6 | C13 | 156.5° | 157.9° |
| C8 | C7 | C22 | H6 | 122.0° | 122.2° |
| C8 | C7 | C22 | O4 | 125.2° | 98.5° |
| C8 | C7 | C22 | C23 | 110.5° | 142.8° |
| C8 | C7 | C22 | H29 | 4.8° | 24.1° |
| C7 | C8 | H7 | H8 | 118.1° | 120.0° |
| C8 | N6 | C9 | C13 | 125.2° | 123.9° |
| C8 | N6 | C9 | C10 | 108.8° | 56.0° |
| C8 | N6 | C13 | C14 | 57.5° | 164.2° |
| N6 | C8 | C7 | C22 | 66.5° | 176.2° |
| C8 | N6 | C9 | H9 | 130.8° | 64.1° |
| C8 | N6 | C9 | H10 | 11.6° | 175.9° |
| C8 | N6 | C13 | H17 | 178.0° | 44.2° |
| C8 | N6 | C13 | H18 | 63.1° | 75.8° |
| N6 | C8 | C7 | H6 | 55.4° | 53.9° |
| N6 | C8 | H7 | H8 | 118.1° | 120.0° |
| N6 | C9 | C10 | H9 | 120.4° | 120.0° |
| N6 | C9 | C10 | H10 | 120.4° | 119.9° |
| N6 | C9 | C10 | C11 | 173.1° | 174.1° |
| C9 | N6 | C13 | C14 | 67.1° | 71.9° |
| N6 | C9 | H9 | H10 | 118.7° | 120.0° |
| C9 | N6 | C13 | H17 | 53.5° | 168.1° |
| C9 | N6 | C13 | H18 | 172.4° | 48.1° |
| C9 | N6 | C8 | H7 | 160.0° | 161.8° |
| C9 | N6 | C8 | H8 | 41.2° | 41.8° |
| N6 | C9 | C10 | H11 | 65.8° | 54.1° |
| N6 | C9 | C10 | H12 | 52.1° | 65.9° |
| C9 | C10 | C11 | H11 | 121.0° | 120.0° |
| C9 | C10 | C11 | H12 | 121.0° | 120.0° |
| C9 | C10 | C11 | N7 | 64.7° | 61.8° |
| C9 | C10 | C11 | C12 | 58.4° | 178.3° |
| C10 | C9 | N6 | C13 | 126.0° | 68.0° |
| C10 | C9 | H9 | H10 | 118.7° | 120.0° |
| C9 | C10 | H11 | H12 | 116.8° | 120.0° |
| C9 | C10 | C11 | H13 | 176.7° | 58.2° |
| C10 | C11 | N7 | C12 | 125.0° | 120.0° |
| C10 | C11 | N7 | H13 | 118.3° | 120.0° |
| C10 | C11 | C12 | H13 | 118.3° | 120.0° |
| C10 | C11 | C12 | O2 | 109.0° | 100.0° |
| C10 | C11 | C12 | O3 | 70.3° | 80.0° |
| C11 | C10 | C9 | H9 | 52.7° | 65.9° |
| C11 | C10 | C9 | H10 | 66.4° | 54.2° |
| C11 | C10 | H11 | H12 | 116.8° | 120.0° |
| C10 | C11 | N7 | H14 | 180.0° | 178.6° |
| C10 | C11 | N7 | H15 | 60.0° | 54.7° |
| N7 | C11 | C12 | H13 | 117.1° | 120.0° |
| N7 | C11 | C12 | O2 | 15.5° | 20.0° |
| N7 | C11 | C12 | O3 | 165.1° | 160.0° |
| N7 | C11 | C10 | H11 | 56.3° | 178.2° |
| N7 | C11 | C10 | H12 | 174.3° | 58.2° |
| C11 | N7 | H14 | H15 | 120.0° | 123.9° |
| C11 | C12 | O2 | O3 | 179.3° | 180.0° |
| C12 | C11 | C10 | H11 | 179.4° | 58.2° |
| C12 | C11 | C10 | H12 | 62.6° | 61.8° |
| C12 | C11 | N7 | H14 | 55.0° | 58.6° |
| C12 | C11 | N7 | H15 | 65.0° | 65.3° |
| C11 | C12 | O3 | H34 | 179.3° | 180.0° |
| O2 | C12 | C11 | H13 | 132.7° | 140.0° |
| O2 | C12 | O3 | H34 | 0.0° | 0.0° |
| O3 | C12 | C11 | H13 | 48.0° | 40.0° |
| N6 | C13 | C14 | H17 | 120.5° | 120.0° |
| N6 | C13 | C14 | H18 | 120.6° | 120.1° |
| N6 | C13 | C14 | C15 | 160.0° | 175.0° |
| C13 | N6 | C9 | H9 | 5.5° | 172.0° |
| C13 | N6 | C9 | H10 | 113.6° | 52.0° |
| N6 | C13 | H17 | H18 | 118.3° | 120.0° |
| C13 | N6 | C8 | H7 | 35.9° | 37.9° |
| C13 | N6 | C8 | H8 | 82.9° | 82.1° |
| N6 | C13 | C14 | H19 | 79.5° | 65.0° |
| N6 | C13 | C14 | H20 | 39.6° | 55.0° |
| C13 | C14 | C15 | H19 | 120.5° | 120.0° |
| C13 | C14 | C15 | H20 | 120.4° | 120.0° |
| C13 | C14 | C15 | N8 | 177.6° | 65.0° |
| C13 | C14 | C15 | C16 | 65.6° | 175.0° |
| C14 | C13 | H17 | H18 | 118.3° | 120.0° |
| C13 | C14 | C15 | H21 | 57.9° | 55.0° |
| C13 | C14 | H19 | H20 | 118.7° | 120.0° |
| C14 | C15 | N8 | C16 | 123.6° | 120.1° |
| C14 | C15 | N8 | H21 | 119.5° | 120.0° |
| C14 | C15 | C16 | H21 | 123.3° | 120.0° |
| C14 | C15 | C16 | C17 | 138.5° | 99.9° |
| C14 | C15 | C16 | C21 | 58.1° | 79.7° |
| C15 | C14 | C13 | H17 | 39.5° | 55.0° |
| C15 | C14 | C13 | H18 | 79.4° | 64.9° |
| C15 | C14 | H19 | H20 | 118.7° | 120.0° |
| C14 | C15 | N8 | H23 | 180.0° | 60.0° |
| C14 | C15 | N8 | H35 | 60.0° | 63.9° |
| N8 | C15 | C16 | H21 | 117.1° | 120.0° |
| N8 | C15 | C16 | C17 | 101.9° | 140.0° |
| N8 | C15 | C16 | C21 | 61.6° | 40.3° |
| N8 | C15 | C14 | H19 | 62.0° | 175.0° |
| N8 | C15 | C14 | H20 | 57.1° | 55.0° |
| C15 | N8 | H23 | H35 | 120.0° | 124.0° |
| C15 | C16 | C17 | C21 | 163.5° | 179.7° |
| C15 | C16 | C17 | C18 | 175.5° | 180.0° |
| C15 | C16 | C21 | C20 | 177.7° | 179.9° |
| C15 | C16 | C17 | H24 | 4.5° | 0.1° |
| C15 | C16 | C21 | H28 | 2.2° | 0.0° |
| C16 | C15 | C14 | H19 | 54.9° | 55.0° |
| C16 | C15 | C14 | H20 | 174.0° | 65.0° |
| C16 | C15 | N8 | H23 | 56.4° | 60.0° |
| C16 | C15 | N8 | H35 | 63.6° | 176.0° |
| C16 | C17 | C18 | H24 | 180.0° | 179.9° |
| C16 | C17 | C18 | C19 | 5.0° | 0.1° |
| C17 | C16 | C21 | C20 | 14.2° | 0.3° |
| C17 | C16 | C15 | H21 | 15.2° | 20.1° |
| C17 | C16 | C21 | H28 | 165.8° | 179.6° |
| C16 | C17 | C18 | H25 | 175.0° | 179.9° |
| C17 | C18 | C19 | H25 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.5° | 0.2° |
| C18 | C17 | C16 | C21 | 12.0° | 0.3° |
| C17 | C18 | C19 | H26 | 179.5° | 180.0° |
| C18 | C19 | C20 | H26 | 180.0° | 179.8° |
| C18 | C19 | C20 | C21 | 3.0° | 0.3° |
| C19 | C18 | C17 | H24 | 175.0° | 180.0° |
| C18 | C19 | C20 | H27 | 177.0° | 180.0° |
| C19 | C20 | C21 | H27 | 180.0° | 179.8° |
| C19 | C20 | C21 | C16 | 9.9° | 0.0° |
| C19 | C20 | C21 | H28 | 170.1° | 179.9° |
| C20 | C19 | C18 | H25 | 179.5° | 179.8° |
| C20 | C21 | C16 | H28 | 180.0° | 179.9° |
| C21 | C20 | C19 | H26 | 177.0° | 180.0° |
| C7 | C22 | O4 | C23 | 118.5° | 114.6° |
| C7 | C22 | O4 | H29 | 119.5° | 122.7° |
| C7 | C22 | C23 | H29 | 115.4° | 118.8° |
| C7 | C22 | C23 | O5 | 154.7° | 118.6° |
| C7 | C22 | C23 | C6 | 29.8° | 0.0° |
| C22 | C7 | C8 | H7 | 54.1° | 56.2° |
| C22 | C7 | C8 | H8 | 172.9° | 63.8° |
| C7 | C22 | O4 | H30 | 180.0° | 176.1° |
| C7 | C22 | C23 | H31 | 82.4° | 118.6° |
| O4 | C22 | C23 | H29 | 122.7° | 122.6° |
| O4 | C22 | C23 | O5 | 32.8° | 0.0° |
| O4 | C22 | C23 | C6 | 92.1° | 118.6° |
| O4 | C22 | C7 | H6 | 3.2° | 23.7° |
| O4 | C22 | C23 | H31 | 155.7° | 122.7° |
| C22 | C23 | O5 | C6 | 116.5° | 114.6° |
| C22 | C23 | O5 | H31 | 122.1° | 122.7° |
| C22 | C23 | C6 | H31 | 112.1° | 118.6° |
| C22 | C23 | C6 | H5 | 78.6° | 94.9° |
| C23 | C22 | C7 | H6 | 127.4° | 94.9° |
| C23 | C22 | O4 | H30 | 61.5° | 61.5° |
| C22 | C23 | O5 | H32 | 180.0° | 65.3° |
| O5 | C23 | C6 | H31 | 122.1° | 122.7° |
| O5 | C23 | C6 | H5 | 47.2° | 23.7° |
| O5 | C23 | C22 | H29 | 89.9° | 122.6° |
| C1 | C4 | C3 | N5 | 179.2° | 180.0° |
| C4 | C1 | N1 | H2 | 175.4° | 179.7° |
| C4 | C1 | N1 | H1 | 64.6° | 0.2° |
| C23 | C6 | N5 | C3 | 143.5° | 93.2° |
| C6 | C23 | C22 | H29 | 145.2° | 118.8° |
| C6 | C23 | O5 | H32 | 63.5° | 180.0° |
| C3 | N5 | C5 | H4 | 179.3° | 180.0° |
| C3 | N5 | C6 | H5 | 20.7° | 29.1° |
| C21 | C16 | C15 | H21 | 178.6° | 160.2° |
| C21 | C16 | C17 | H24 | 168.0° | 179.8° |
| C16 | C21 | C20 | H27 | 170.1° | 179.8° |
| H5 | C6 | C23 | H31 | 169.3° | 146.5° |
| H9 | C9 | C10 | H11 | 173.8° | 174.1° |
| H9 | C9 | C10 | H12 | 68.3° | 54.1° |
| H10 | C9 | C10 | H11 | 54.6° | 65.8° |
| H10 | C9 | C10 | H12 | 172.5° | 174.1° |
| H17 | C13 | C14 | H19 | 159.9° | 175.0° |
| H17 | C13 | C14 | H20 | 81.0° | 65.0° |
| H18 | C13 | C14 | H19 | 41.0° | 55.1° |
| H18 | C13 | C14 | H20 | 160.1° | 175.0° |
| H21 | C15 | C14 | H19 | 178.3° | 65.1° |
| H21 | C15 | C14 | H20 | 62.6° | 175.0° |
| H21 | C15 | N8 | H23 | 60.5° | 180.0° |
| H21 | C15 | N8 | H35 | 179.4° | 56.0° |
| H24 | C17 | C18 | H25 | 5.0° | 0.0° |
| H26 | C19 | C18 | H25 | 0.5° | 0.0° |
| H26 | C19 | C20 | H27 | 3.1° | 0.2° |
| H28 | C21 | C20 | H27 | 9.9° | 0.3° |
| H29 | C22 | C7 | H6 | 117.2° | 146.3° |
| H29 | C22 | O4 | H30 | 60.4° | 61.2° |
| H29 | C22 | C23 | H31 | 33.0° | 0.1° |
| H6 | C7 | C8 | H7 | 176.0° | 66.2° |
| H6 | C7 | C8 | H8 | 65.2° | 173.9° |
| H11 | C10 | C11 | H13 | 62.2° | 61.8° |
| H12 | C10 | C11 | H13 | 55.7° | 178.2° |
| H13 | C11 | N7 | H14 | 61.8° | 61.3° |
| H13 | C11 | N7 | H15 | 178.3° | 174.7° |
| H31 | C23 | O5 | H32 | 57.9° | 57.3° |
