A1CG7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N09 | N10 | doub | 1.29Å | 1.35Å | Aromatic |
| N09 | N08 | sing | 1.41Å | 1.35Å | Aromatic |
| N10 | N11 | sing | 1.28Å | 1.36Å | Aromatic |
| N08 | C07 | sing | 1.35Å | 1.34Å | Aromatic |
| N11 | C07 | doub | 1.31Å | 1.34Å | Aromatic |
| C07 | N06 | sing | 1.38Å | 1.42Å | |
| C01 | N02 | sing | 1.46Å | 1.45Å | |
| N03 | N02 | sing | 1.40Å | 1.43Å | |
| N03 | C04 | doub | 1.30Å | 1.44Å | |
| C05 | N06 | sing | 1.47Å | 1.43Å | |
| C05 | C04 | sing | 1.51Å | 1.52Å | |
| N02 | C15 | sing | 1.37Å | 1.45Å | |
| C04 | C12 | sing | 1.42Å | 1.51Å | |
| C15 | N16 | sing | 1.33Å | 1.42Å | |
| C15 | C14 | doub | 1.41Å | 1.48Å | |
| N16 | C17 | doub | 1.32Å | 1.45Å | |
| C12 | C14 | sing | 1.41Å | 1.51Å | |
| C12 | O13 | doub | 1.22Å | 1.20Å | |
| C14 | C20 | sing | 1.46Å | 1.50Å | |
| C17 | N18 | sing | 1.37Å | 1.43Å | |
| C17 | N19 | sing | 1.36Å | 1.46Å | |
| C20 | N19 | sing | 1.35Å | 1.44Å | |
| C20 | O21 | doub | 1.22Å | 1.17Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C05 | H4 | sing | 1.09Å | 1.10Å | |
| C05 | H5 | sing | 1.09Å | 1.10Å | |
| N06 | H6 | sing | 0.97Å | 1.00Å | |
| N08 | H7 | sing | 0.97Å | 1.00Å | |
| N18 | H9 | sing | 0.97Å | 1.00Å | |
| N18 | H10 | sing | 0.97Å | 1.00Å | |
| N19 | H8 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N10 | N09 | N08 | 108.9° | 106.8° |
| N09 | N10 | N11 | 108.2° | 110.3° |
| N09 | N08 | C07 | 105.8° | 105.3° |
| N09 | N08 | H7 | 127.1° | 127.4° |
| N10 | N11 | C07 | 105.9° | 110.5° |
| N08 | C07 | N11 | 111.1° | 107.1° |
| N08 | C07 | N06 | 122.7° | 126.5° |
| C07 | N08 | H7 | 127.1° | 127.4° |
| N11 | C07 | N06 | 126.2° | 126.4° |
| C07 | N06 | C05 | 109.4° | 120.0° |
| C07 | N06 | H6 | 109.5° | 120.0° |
| C01 | N02 | N03 | 123.6° | 119.8° |
| C01 | N02 | C15 | 120.0° | 119.7° |
| N02 | C01 | H1 | 109.5° | 109.5° |
| N02 | C01 | H2 | 109.5° | 109.5° |
| N02 | C01 | H3 | 109.5° | 109.5° |
| N02 | N03 | C04 | 124.9° | 122.0° |
| N03 | N02 | C15 | 116.4° | 120.5° |
| N03 | C04 | C05 | 114.9° | 119.7° |
| N03 | C04 | C12 | 120.4° | 120.5° |
| N06 | C05 | C04 | 107.5° | 109.5° |
| N06 | C05 | H4 | 109.9° | 109.5° |
| N06 | C05 | H5 | 110.0° | 109.5° |
| C05 | N06 | H6 | 109.5° | 120.0° |
| C05 | C04 | C12 | 124.6° | 119.7° |
| C04 | C05 | H4 | 109.9° | 109.5° |
| C04 | C05 | H5 | 110.0° | 109.5° |
| N02 | C15 | N16 | 112.6° | 121.7° |
| N02 | C15 | C14 | 122.6° | 119.1° |
| C04 | C12 | C14 | 115.2° | 118.5° |
| C04 | C12 | O13 | 121.0° | 120.8° |
| N16 | C15 | C14 | 124.8° | 119.2° |
| C15 | N16 | C17 | 118.7° | 121.7° |
| C15 | C14 | C12 | 120.5° | 119.3° |
| C15 | C14 | C20 | 115.5° | 118.5° |
| N16 | C17 | N18 | 119.4° | 118.5° |
| N16 | C17 | N19 | 119.2° | 123.0° |
| C14 | C12 | O13 | 123.8° | 120.7° |
| C12 | C14 | C20 | 124.0° | 122.1° |
| C14 | C20 | N19 | 119.4° | 117.4° |
| C14 | C20 | O21 | 122.3° | 121.3° |
| N18 | C17 | N19 | 121.4° | 118.5° |
| C17 | N18 | H9 | 120.0° | 120.0° |
| C17 | N18 | H10 | 120.0° | 120.0° |
| C17 | N19 | C20 | 122.4° | 120.2° |
| C17 | N19 | H8 | 118.8° | 119.9° |
| N19 | C20 | O21 | 118.3° | 121.3° |
| C20 | N19 | H8 | 118.9° | 119.9° |
| H1 | C01 | H2 | 109.4° | 109.4° |
| H1 | C01 | H3 | 109.5° | 109.4° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H4 | C05 | H5 | 109.5° | 109.5° |
| H9 | N18 | H10 | 119.9° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N10 | N09 | N08 | C07 | 0.6° | 0.0° |
| N09 | N10 | N11 | C07 | 0.5° | 0.4° |
| N10 | N09 | N08 | H7 | 179.4° | 180.0° |
| N08 | N09 | N10 | N11 | 0.7° | 0.2° |
| N09 | N08 | C07 | H7 | 180.0° | 179.9° |
| N09 | N08 | C07 | N11 | 0.4° | 0.3° |
| N09 | N08 | C07 | N06 | 178.9° | 180.0° |
| N10 | N11 | C07 | N08 | 0.1° | 0.4° |
| N10 | N11 | C07 | N06 | 178.4° | 179.9° |
| N08 | C07 | N11 | N06 | 178.5° | 179.7° |
| N08 | C07 | N06 | C05 | 7.7° | 0.0° |
| N08 | C07 | N06 | H6 | 127.7° | 180.0° |
| N11 | C07 | N06 | C05 | 170.6° | 179.7° |
| N11 | C07 | N06 | H6 | 50.6° | 0.3° |
| N11 | C07 | N08 | H7 | 179.7° | 179.8° |
| C07 | N06 | C05 | H6 | 120.0° | 180.0° |
| C07 | N06 | C05 | C04 | 94.6° | 180.0° |
| C07 | N06 | C05 | H4 | 25.0° | 60.0° |
| C07 | N06 | C05 | H5 | 145.6° | 60.0° |
| N06 | C07 | N08 | H7 | 1.2° | 0.1° |
| C01 | N02 | N03 | C15 | 178.5° | 180.0° |
| C01 | N02 | N03 | C04 | 179.2° | 180.0° |
| C01 | N02 | C15 | N16 | 0.3° | 0.0° |
| C01 | N02 | C15 | C14 | 179.7° | 179.8° |
| N02 | C01 | H1 | H2 | 120.0° | 120.0° |
| N02 | C01 | H1 | H3 | 120.0° | 120.0° |
| N02 | C01 | H2 | H3 | 120.0° | 120.0° |
| N02 | N03 | C04 | C05 | 175.3° | 180.0° |
| N02 | N03 | C04 | C12 | 1.2° | 0.1° |
| N03 | N02 | C15 | N16 | 178.8° | 180.0° |
| N03 | N02 | C15 | C14 | 1.7° | 0.2° |
| N03 | N02 | C01 | H1 | 0.0° | 90.0° |
| N03 | N02 | C01 | H2 | 120.0° | 30.0° |
| N03 | N02 | C01 | H3 | 120.0° | 150.1° |
| N03 | C04 | C05 | N06 | 158.0° | 0.0° |
| N03 | C04 | C05 | C12 | 176.4° | 179.9° |
| C04 | N03 | N02 | C15 | 2.3° | 0.0° |
| N03 | C04 | C12 | C14 | 0.5° | 0.3° |
| N03 | C04 | C12 | O13 | 179.5° | 180.0° |
| N03 | C04 | C05 | H4 | 38.4° | 120.0° |
| N03 | C04 | C05 | H5 | 82.2° | 120.0° |
| N06 | C05 | C04 | H4 | 119.7° | 120.0° |
| N06 | C05 | C04 | H5 | 119.7° | 120.0° |
| N06 | C05 | C04 | C12 | 25.6° | 179.9° |
| N06 | C05 | H4 | H5 | 120.9° | 120.0° |
| C05 | C04 | C12 | C14 | 176.7° | 179.8° |
| C05 | C04 | C12 | O13 | 3.4° | 0.1° |
| C04 | C05 | H4 | H5 | 120.9° | 120.0° |
| C04 | C05 | N06 | H6 | 145.4° | 0.0° |
| N02 | C15 | N16 | C14 | 179.4° | 179.8° |
| N02 | C15 | N16 | C17 | 179.2° | 179.7° |
| N02 | C15 | C14 | C12 | 0.1° | 0.5° |
| N02 | C15 | C14 | C20 | 179.7° | 179.7° |
| C15 | N02 | C01 | H1 | 178.5° | 90.0° |
| C15 | N02 | C01 | H2 | 61.6° | 150.0° |
| C15 | N02 | C01 | H3 | 58.4° | 30.0° |
| C04 | C12 | C14 | C15 | 1.0° | 0.5° |
| C04 | C12 | C14 | O13 | 179.9° | 179.7° |
| C04 | C12 | C14 | C20 | 179.2° | 179.7° |
| C12 | C04 | C05 | H4 | 145.3° | 59.9° |
| C12 | C04 | C05 | H5 | 94.1° | 60.1° |
| N16 | C15 | C14 | C12 | 179.5° | 179.8° |
| N16 | C15 | C14 | C20 | 0.3° | 0.0° |
| C15 | N16 | C17 | N18 | 178.4° | 179.9° |
| C15 | N16 | C17 | N19 | 2.3° | 0.0° |
| C14 | C15 | N16 | C17 | 1.4° | 0.0° |
| C15 | C14 | C12 | C20 | 179.8° | 179.8° |
| C15 | C14 | C12 | O13 | 179.1° | 179.8° |
| C15 | C14 | C20 | N19 | 0.2° | 0.0° |
| C15 | C14 | C20 | O21 | 179.9° | 180.0° |
| N16 | C17 | N18 | N19 | 179.2° | 179.9° |
| N16 | C17 | N19 | C20 | 2.3° | 0.1° |
| N16 | C17 | N18 | H9 | 0.0° | 180.0° |
| N16 | C17 | N18 | H10 | 180.0° | 0.1° |
| N16 | C17 | N19 | H8 | 177.7° | 180.0° |
| C12 | C14 | C20 | N19 | 179.6° | 179.8° |
| C12 | C14 | C20 | O21 | 0.3° | 0.2° |
| O13 | C12 | C14 | C20 | 0.7° | 0.0° |
| C14 | C20 | N19 | C17 | 1.2° | 0.0° |
| C14 | C20 | N19 | O21 | 179.9° | 179.9° |
| C14 | C20 | N19 | H8 | 178.8° | 180.0° |
| N18 | C17 | N19 | C20 | 178.5° | 180.0° |
| C17 | N18 | H9 | H10 | 180.0° | 179.9° |
| N18 | C17 | N19 | H8 | 1.5° | 0.1° |
| C17 | N19 | C20 | H8 | 180.0° | 179.9° |
| C17 | N19 | C20 | O21 | 178.9° | 179.9° |
| N19 | C17 | N18 | H9 | 179.2° | 0.1° |
| N19 | C17 | N18 | H10 | 0.8° | 180.0° |
| O21 | C20 | N19 | H8 | 1.1° | 0.0° |
| H1 | C01 | H2 | H3 | 120.0° | 119.9° |
| H4 | C05 | N06 | H6 | 94.9° | 120.0° |
| H5 | C05 | N06 | H6 | 25.7° | 120.0° |






