O7P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.51Å | 1.53Å | |
| C02 | C03 | doub | 1.40Å | 1.40Å | Aromatic |
| C02 | C27 | sing | 1.38Å | 1.41Å | Aromatic |
| C03 | C04 | sing | 1.43Å | 1.46Å | |
| C03 | C06 | sing | 1.40Å | 1.43Å | Aromatic |
| C04 | N05 | trip | 1.14Å | 1.17Å | |
| C06 | C07 | doub | 1.38Å | 1.41Å | Aromatic |
| C07 | C08 | sing | 1.39Å | 1.41Å | Aromatic |
| C08 | C27 | doub | 1.39Å | 1.40Å | Aromatic |
| C08 | O09 | sing | 1.36Å | 1.35Å | |
| C10 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | O09 | sing | 1.36Å | 1.35Å | |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.51Å | 1.47Å | |
| C13 | C25 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | N16 | sing | 1.35Å | 1.37Å | |
| C15 | O24 | doub | 1.21Å | 1.20Å | |
| C17 | C18 | sing | 1.50Å | 1.54Å | |
| C17 | N16 | sing | 1.47Å | 1.45Å | |
| C18 | N19 | sing | 1.33Å | 1.45Å | |
| C18 | O23 | doub | 1.21Å | 1.22Å | |
| C20 | N19 | sing | 1.47Å | 1.49Å | |
| C21 | C22 | sing | 1.53Å | 1.49Å | |
| C21 | N19 | sing | 1.46Å | 1.44Å | |
| C22 | N16 | sing | 1.47Å | 1.44Å | |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.70Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C06 | H4 | sing | 1.08Å | 1.08Å | |
| C07 | H5 | sing | 1.08Å | 1.08Å | |
| C11 | H6 | sing | 1.08Å | 1.08Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.08Å | 1.08Å | |
| C26 | H20 | sing | 1.08Å | 1.08Å | |
| C27 | H21 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 122.3° | 120.0° |
| C01 | C02 | C27 | 115.2° | 120.1° |
| C02 | C01 | H1 | 109.5° | 109.5° |
| C02 | C01 | H2 | 109.5° | 109.5° |
| C02 | C01 | H3 | 109.5° | 109.5° |
| C03 | C02 | C27 | 122.5° | 119.9° |
| C02 | C03 | C04 | 119.3° | 120.1° |
| C02 | C03 | C06 | 115.4° | 119.8° |
| C02 | C27 | C08 | 121.8° | 120.1° |
| C02 | C27 | H21 | 119.1° | 120.0° |
| C04 | C03 | C06 | 125.3° | 120.1° |
| C03 | C04 | N05 | 179.3° | 179.9° |
| C03 | C06 | C07 | 122.4° | 119.9° |
| C03 | C06 | H4 | 118.8° | 120.1° |
| C06 | C07 | C08 | 120.2° | 120.1° |
| C07 | C06 | H4 | 118.8° | 120.1° |
| C06 | C07 | H5 | 119.9° | 119.9° |
| C07 | C08 | C27 | 117.6° | 120.2° |
| C07 | C08 | O09 | 122.0° | 119.9° |
| C08 | C07 | H5 | 119.9° | 120.0° |
| C27 | C08 | O09 | 120.4° | 119.9° |
| C08 | C27 | H21 | 119.1° | 119.9° |
| C08 | O09 | C10 | 123.0° | 118.0° |
| C11 | C10 | C26 | 118.1° | 119.9° |
| C11 | C10 | O09 | 120.6° | 120.0° |
| C10 | C11 | C12 | 121.1° | 119.9° |
| C10 | C11 | H6 | 119.4° | 120.1° |
| C26 | C10 | O09 | 121.1° | 120.1° |
| C10 | C26 | C25 | 120.9° | 120.0° |
| C10 | C26 | H20 | 119.6° | 120.0° |
| C11 | C12 | C13 | 120.9° | 120.0° |
| C12 | C11 | H6 | 119.4° | 120.0° |
| C11 | C12 | H7 | 119.6° | 120.0° |
| C12 | C13 | C14 | 125.3° | 119.9° |
| C12 | C13 | C25 | 117.8° | 120.1° |
| C13 | C12 | H7 | 119.5° | 120.0° |
| C14 | C13 | C25 | 116.8° | 120.0° |
| C13 | C14 | C15 | 114.2° | 109.5° |
| C13 | C14 | H8 | 108.3° | 109.4° |
| C13 | C14 | H9 | 108.3° | 109.5° |
| C13 | C25 | C26 | 121.1° | 120.0° |
| C13 | C25 | H19 | 119.4° | 120.0° |
| N16 | C15 | O24 | 131.4° | 120.0° |
| C15 | N16 | C17 | 116.4° | 121.4° |
| C15 | N16 | C22 | 128.2° | 121.3° |
| N16 | C15 | C14 | 118.4° | 120.0° |
| O24 | C15 | C14 | 110.3° | 120.0° |
| C18 | C17 | N16 | 118.8° | 108.9° |
| C17 | C18 | N19 | 120.5° | 123.0° |
| C17 | C18 | O23 | 115.9° | 118.5° |
| C18 | C17 | H10 | 107.1° | 109.6° |
| C18 | C17 | H11 | 107.1° | 109.6° |
| C17 | N16 | C22 | 115.5° | 117.3° |
| N16 | C17 | H10 | 107.1° | 109.6° |
| N16 | C17 | H11 | 107.1° | 109.5° |
| N19 | C18 | O23 | 123.7° | 118.5° |
| C18 | N19 | C20 | 125.2° | 117.7° |
| C18 | N19 | C21 | 117.2° | 124.6° |
| C20 | N19 | C21 | 117.6° | 117.7° |
| N19 | C20 | H12 | 109.5° | 109.5° |
| N19 | C20 | H13 | 109.5° | 109.5° |
| N19 | C20 | H14 | 109.5° | 109.4° |
| C22 | C21 | N19 | 119.4° | 110.8° |
| C21 | C22 | N16 | 117.3° | 108.2° |
| C22 | C21 | H15 | 106.9° | 109.2° |
| C22 | C21 | H16 | 106.9° | 109.2° |
| C21 | C22 | H17 | 107.5° | 109.7° |
| C21 | C22 | H18 | 107.5° | 109.7° |
| N19 | C21 | H15 | 106.9° | 109.2° |
| N19 | C21 | H16 | 106.9° | 109.2° |
| N16 | C22 | H17 | 107.5° | 109.8° |
| N16 | C22 | H18 | 107.5° | 109.7° |
| C26 | C25 | H19 | 119.4° | 120.0° |
| C25 | C26 | H20 | 119.6° | 120.0° |
| C15 | C14 | H8 | 108.3° | 109.5° |
| C15 | C14 | H9 | 108.3° | 109.5° |
| H1 | C01 | H2 | 109.4° | 109.4° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H8 | C14 | H9 | 109.4° | 109.5° |
| H10 | C17 | H11 | 109.5° | 109.7° |
| H12 | C20 | H13 | 109.5° | 109.5° |
| H12 | C20 | H14 | 109.4° | 109.4° |
| H13 | C20 | H14 | 109.5° | 109.5° |
| H15 | C21 | H16 | 109.5° | 109.2° |
| H17 | C22 | H18 | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | C27 | 180.0° | 179.6° |
| C01 | C02 | C03 | C04 | 0.5° | 0.1° |
| C01 | C02 | C03 | C06 | 179.3° | 180.0° |
| C01 | C02 | C27 | C08 | 179.5° | 179.7° |
| C02 | C01 | H1 | H2 | 120.0° | 120.0° |
| C02 | C01 | H1 | H3 | 120.0° | 120.1° |
| C02 | C01 | H2 | H3 | 120.0° | 120.1° |
| C01 | C02 | C27 | H21 | 0.5° | 0.0° |
| C02 | C03 | C04 | C06 | 178.7° | 179.9° |
| C02 | C03 | C04 | N05 | 14.5° | 107.2° |
| C02 | C03 | C06 | C07 | 0.7° | 0.1° |
| C03 | C02 | C27 | C08 | 0.4° | 0.6° |
| C03 | C02 | C01 | H1 | 90.0° | 90.1° |
| C03 | C02 | C01 | H2 | 150.0° | 150.0° |
| C03 | C02 | C01 | H3 | 30.0° | 29.9° |
| C02 | C03 | C06 | H4 | 179.3° | 180.0° |
| C03 | C02 | C27 | H21 | 179.6° | 179.6° |
| C27 | C02 | C03 | C04 | 179.5° | 179.7° |
| C27 | C02 | C03 | C06 | 0.7° | 0.4° |
| C02 | C27 | C08 | C07 | 1.5° | 0.6° |
| C02 | C27 | C08 | H21 | 180.0° | 179.7° |
| C02 | C27 | C08 | O09 | 179.1° | 179.7° |
| C27 | C02 | C01 | H1 | 90.0° | 90.3° |
| C27 | C02 | C01 | H2 | 30.0° | 29.7° |
| C27 | C02 | C01 | H3 | 150.0° | 149.7° |
| C04 | C03 | C06 | C07 | 179.5° | 180.0° |
| C04 | C03 | C06 | H4 | 0.5° | 0.1° |
| C06 | C03 | C04 | N05 | 166.8° | 72.9° |
| C03 | C06 | C07 | H4 | 180.0° | 179.9° |
| C03 | C06 | C07 | C08 | 0.4° | 0.1° |
| C03 | C06 | C07 | H5 | 179.6° | 180.0° |
| C06 | C07 | C08 | H5 | 180.0° | 179.9° |
| C06 | C07 | C08 | C27 | 1.5° | 0.3° |
| C06 | C07 | C08 | O09 | 179.1° | 179.9° |
| C07 | C08 | C27 | O09 | 177.6° | 179.7° |
| C07 | C08 | O09 | C10 | 21.2° | 67.4° |
| C08 | C07 | C06 | H4 | 179.6° | 180.0° |
| C07 | C08 | C27 | H21 | 178.5° | 179.7° |
| C27 | C08 | O09 | C10 | 161.3° | 112.3° |
| C27 | C08 | C07 | H5 | 178.5° | 179.8° |
| C08 | O09 | C10 | C11 | 56.3° | 6.1° |
| C08 | O09 | C10 | C26 | 127.6° | 174.2° |
| O09 | C08 | C07 | H5 | 0.9° | 0.1° |
| O09 | C08 | C27 | H21 | 0.9° | 0.1° |
| C11 | C10 | C26 | O09 | 176.2° | 179.8° |
| C10 | C11 | C12 | H6 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 2.3° | 0.0° |
| C11 | C10 | C26 | C25 | 1.1° | 0.0° |
| C10 | C11 | C12 | H7 | 177.7° | 180.0° |
| C11 | C10 | C26 | H20 | 178.9° | 180.0° |
| C26 | C10 | C11 | C12 | 1.5° | 0.0° |
| C10 | C26 | C25 | C13 | 1.5° | 0.0° |
| C10 | C26 | C25 | H20 | 180.0° | 180.0° |
| C26 | C10 | C11 | H6 | 178.5° | 179.9° |
| C10 | C26 | C25 | H19 | 178.5° | 179.9° |
| O09 | C10 | C11 | C12 | 177.7° | 179.8° |
| O09 | C10 | C26 | C25 | 177.3° | 179.7° |
| O09 | C10 | C11 | H6 | 2.3° | 0.3° |
| O09 | C10 | C26 | H20 | 2.7° | 0.2° |
| C11 | C12 | C13 | H7 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 179.0° | 180.0° |
| C11 | C12 | C13 | C25 | 2.6° | 0.0° |
| C12 | C13 | C14 | C25 | 176.4° | 180.0° |
| C12 | C13 | C25 | C26 | 2.2° | 0.0° |
| C12 | C13 | C14 | C15 | 113.6° | 90.0° |
| C13 | C12 | C11 | H6 | 177.7° | 179.9° |
| C12 | C13 | C14 | H8 | 7.1° | 150.0° |
| C12 | C13 | C14 | H9 | 125.7° | 30.0° |
| C12 | C13 | C25 | H19 | 177.8° | 179.9° |
| C13 | C14 | C15 | N16 | 161.7° | 180.0° |
| C13 | C14 | C15 | O24 | 18.0° | 0.0° |
| C14 | C13 | C25 | C26 | 178.9° | 180.0° |
| C13 | C14 | C15 | H8 | 120.7° | 120.0° |
| C13 | C14 | C15 | H9 | 120.7° | 120.0° |
| C14 | C13 | C12 | H7 | 1.0° | 0.0° |
| C13 | C14 | H8 | H9 | 117.8° | 120.0° |
| C14 | C13 | C25 | H19 | 1.1° | 0.1° |
| C13 | C25 | C26 | H19 | 180.0° | 179.8° |
| C25 | C13 | C14 | C15 | 62.8° | 90.0° |
| C25 | C13 | C12 | H7 | 177.4° | 179.9° |
| C25 | C13 | C14 | H8 | 176.5° | 30.0° |
| C25 | C13 | C14 | H9 | 57.9° | 150.0° |
| C13 | C25 | C26 | H20 | 178.5° | 180.0° |
| N16 | C15 | O24 | C14 | 179.7° | 179.9° |
| C15 | N16 | C17 | C18 | 158.1° | 137.3° |
| C15 | N16 | C17 | C22 | 178.9° | 179.9° |
| C15 | N16 | C22 | C21 | 140.3° | 118.5° |
| N16 | C15 | C14 | H8 | 77.6° | 60.0° |
| N16 | C15 | C14 | H9 | 41.0° | 60.0° |
| C15 | N16 | C17 | H10 | 36.8° | 102.8° |
| C15 | N16 | C17 | H11 | 80.6° | 17.5° |
| C15 | N16 | C22 | H17 | 98.5° | 1.1° |
| C15 | N16 | C22 | H18 | 19.2° | 121.8° |
| O24 | C15 | N16 | C17 | 178.5° | 180.0° |
| O24 | C15 | N16 | C22 | 0.2° | 0.1° |
| O24 | C15 | C14 | H8 | 102.7° | 119.9° |
| O24 | C15 | C14 | H9 | 138.7° | 120.0° |
| C18 | C17 | N16 | H10 | 121.3° | 119.9° |
| C18 | C17 | N16 | H11 | 121.3° | 119.8° |
| C17 | C18 | N19 | O23 | 179.5° | 179.9° |
| C17 | C18 | N19 | C20 | 179.3° | 175.6° |
| C17 | C18 | N19 | C21 | 0.2° | 4.3° |
| C18 | C17 | N16 | C22 | 20.8° | 42.8° |
| C18 | C17 | H10 | H11 | 115.8° | 120.3° |
| N16 | C17 | C18 | N19 | 1.5° | 12.7° |
| N16 | C17 | C18 | O23 | 178.9° | 167.2° |
| C17 | N16 | C22 | C21 | 38.3° | 61.5° |
| C17 | N16 | C15 | C14 | 1.1° | 0.0° |
| N16 | C17 | H10 | H11 | 115.8° | 120.3° |
| C17 | N16 | C22 | H17 | 82.8° | 178.8° |
| C17 | N16 | C22 | H18 | 159.5° | 58.1° |
| C18 | N19 | C20 | C21 | 179.1° | 179.9° |
| C18 | N19 | C21 | C22 | 17.4° | 21.9° |
| N19 | C18 | C17 | H10 | 122.9° | 107.1° |
| N19 | C18 | C17 | H11 | 119.8° | 132.5° |
| C18 | N19 | C20 | H12 | 180.0° | 0.1° |
| C18 | N19 | C20 | H13 | 60.0° | 120.0° |
| C18 | N19 | C20 | H14 | 60.0° | 120.0° |
| C18 | N19 | C21 | H15 | 104.0° | 142.2° |
| C18 | N19 | C21 | H16 | 138.8° | 98.4° |
| O23 | C18 | N19 | C20 | 0.2° | 4.4° |
| O23 | C18 | N19 | C21 | 179.3° | 175.6° |
| O23 | C18 | C17 | H10 | 57.6° | 72.9° |
| O23 | C18 | C17 | H11 | 59.7° | 47.5° |
| C20 | N19 | C21 | C22 | 161.8° | 158.1° |
| N19 | C20 | H12 | H13 | 120.0° | 120.0° |
| N19 | C20 | H12 | H14 | 120.0° | 119.9° |
| N19 | C20 | H13 | H14 | 120.0° | 120.0° |
| C20 | N19 | C21 | H15 | 76.8° | 37.7° |
| C20 | N19 | C21 | H16 | 40.4° | 81.6° |
| C22 | C21 | N19 | H15 | 121.4° | 120.3° |
| C22 | C21 | N19 | H16 | 121.4° | 120.3° |
| C21 | C22 | N16 | H17 | 121.1° | 119.7° |
| C21 | C22 | N16 | H18 | 121.1° | 119.6° |
| C22 | C21 | H15 | H16 | 115.5° | 119.3° |
| C21 | C22 | H17 | H18 | 116.5° | 120.6° |
| N19 | C21 | C22 | N16 | 38.0° | 46.7° |
| C21 | N19 | C20 | H12 | 0.9° | 180.0° |
| C21 | N19 | C20 | H13 | 119.1° | 60.0° |
| C21 | N19 | C20 | H14 | 120.9° | 60.1° |
| N19 | C21 | H15 | H16 | 115.5° | 119.4° |
| N19 | C21 | C22 | H17 | 83.2° | 166.4° |
| N19 | C21 | C22 | H18 | 159.1° | 72.9° |
| C22 | N16 | C15 | C14 | 179.8° | 180.0° |
| C22 | N16 | C17 | H10 | 142.1° | 77.1° |
| C22 | N16 | C17 | H11 | 100.6° | 162.6° |
| N16 | C22 | C21 | H15 | 83.4° | 167.0° |
| N16 | C22 | C21 | H16 | 159.4° | 73.6° |
| N16 | C22 | H17 | H18 | 116.4° | 120.7° |
| C15 | C14 | H8 | H9 | 117.9° | 120.0° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H4 | C06 | C07 | H5 | 0.4° | 0.1° |
| H6 | C11 | C12 | H7 | 2.3° | 0.1° |
| H12 | C20 | H13 | H14 | 119.9° | 120.0° |
| H15 | C21 | C22 | H17 | 155.5° | 73.3° |
| H15 | C21 | C22 | H18 | 37.7° | 47.4° |
| H16 | C21 | C22 | H17 | 38.2° | 46.1° |
| H16 | C21 | C22 | H18 | 79.5° | 166.7° |
| H19 | C25 | C26 | H20 | 1.5° | 0.1° |
