32Q
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| P11 | C3 | sing | 1.82Å | 1.78Å | |
| P11 | C11 | sing | 1.82Å | 1.79Å | |
| P11 | O12 | doub | 1.48Å | 1.51Å | |
| P11 | O13 | sing | 1.61Å | 1.48Å | |
| C1 | C3 | sing | 1.53Å | 1.52Å | |
| C1 | C6 | sing | 1.53Å | 1.54Å | |
| C3 | N10 | sing | 1.47Å | 1.54Å | |
| C6 | C8 | sing | 1.51Å | 1.50Å | |
| C8 | C17 | doub | 1.38Å | 1.41Å | Aromatic |
| C8 | C22 | sing | 1.38Å | 1.41Å | Aromatic |
| C11 | C13 | sing | 1.53Å | 1.54Å | |
| C13 | C15 | sing | 1.51Å | 1.58Å | |
| C13 | C16 | sing | 1.53Å | 1.48Å | |
| C15 | O23 | doub | 1.21Å | 1.26Å | |
| C15 | O24 | sing | 1.34Å | 1.25Å | |
| C16 | C18 | sing | 1.51Å | 1.50Å | |
| C17 | C19 | sing | 1.38Å | 1.43Å | Aromatic |
| C18 | C36 | doub | 1.38Å | 1.40Å | Aromatic |
| C18 | C40 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.42Å | Aromatic |
| C23 | N24 | sing | 1.47Å | 1.45Å | |
| C23 | C38 | sing | 1.51Å | 1.54Å | |
| C36 | C37 | sing | 1.38Å | 1.40Å | Aromatic |
| C37 | C38 | doub | 1.38Å | 1.41Å | Aromatic |
| C38 | C39 | sing | 1.38Å | 1.39Å | Aromatic |
| C39 | C40 | doub | 1.38Å | 1.40Å | Aromatic |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H31 | sing | 1.09Å | 1.10Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| N10 | H101 | sing | 1.01Å | 1.00Å | |
| N10 | H102 | sing | 1.01Å | 1.00Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| O13 | H132 | sing | 0.97Å | 0.95Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| O24 | H3 | sing | 0.97Å | 0.95Å | |
| N24 | H241 | sing | 1.01Å | 1.00Å | |
| N24 | H242 | sing | 1.01Å | 1.00Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| C39 | H391 | sing | 1.08Å | 1.08Å | |
| C40 | H401 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | P11 | C11 | 109.3° | 109.5° |
| C3 | P11 | O12 | 106.8° | 109.5° |
| C3 | P11 | O13 | 107.7° | 109.5° |
| P11 | C3 | C1 | 113.6° | 109.5° |
| P11 | C3 | N10 | 106.9° | 109.5° |
| P11 | C3 | H31 | 106.1° | 109.5° |
| C11 | P11 | O12 | 115.5° | 109.5° |
| C11 | P11 | O13 | 108.8° | 109.4° |
| P11 | C11 | C13 | 116.6° | 109.5° |
| P11 | C11 | H111 | 107.7° | 109.4° |
| P11 | C11 | H112 | 107.7° | 109.5° |
| O12 | P11 | O13 | 108.5° | 109.5° |
| P11 | O13 | H132 | 109.5° | 114.0° |
| C3 | C1 | C6 | 115.2° | 109.4° |
| C1 | C3 | N10 | 112.4° | 109.4° |
| C3 | C1 | H11 | 108.0° | 109.5° |
| C3 | C1 | H12 | 108.1° | 109.5° |
| C1 | C3 | H31 | 108.9° | 109.4° |
| C1 | C6 | C8 | 119.6° | 109.4° |
| C6 | C1 | H11 | 108.0° | 109.5° |
| C6 | C1 | H12 | 108.0° | 109.5° |
| C1 | C6 | H61 | 106.9° | 109.5° |
| C1 | C6 | H62 | 106.9° | 109.5° |
| N10 | C3 | H31 | 108.7° | 109.5° |
| C3 | N10 | H101 | 109.5° | 111.0° |
| C3 | N10 | H102 | 109.5° | 110.9° |
| C6 | C8 | C17 | 122.6° | 120.0° |
| C6 | C8 | C22 | 121.1° | 120.0° |
| C8 | C6 | H61 | 106.9° | 109.5° |
| C8 | C6 | H62 | 106.9° | 109.4° |
| C17 | C8 | C22 | 116.3° | 120.0° |
| C8 | C17 | C19 | 123.0° | 120.0° |
| C8 | C17 | H171 | 118.5° | 120.0° |
| C8 | C22 | C21 | 121.7° | 120.0° |
| C8 | C22 | H221 | 119.1° | 120.0° |
| C11 | C13 | C15 | 112.1° | 109.5° |
| C11 | C13 | C16 | 111.1° | 109.4° |
| C13 | C11 | H111 | 107.7° | 109.5° |
| C13 | C11 | H112 | 107.6° | 109.5° |
| C11 | C13 | H131 | 109.1° | 109.5° |
| C15 | C13 | C16 | 105.8° | 109.4° |
| C13 | C15 | O23 | 119.3° | 120.0° |
| C13 | C15 | O24 | 114.4° | 120.0° |
| C15 | C13 | H131 | 108.7° | 109.5° |
| C13 | C16 | C18 | 119.0° | 109.5° |
| C16 | C13 | H131 | 109.9° | 109.5° |
| C13 | C16 | H161 | 107.0° | 109.5° |
| C13 | C16 | H162 | 107.0° | 109.5° |
| O23 | C15 | O24 | 126.3° | 120.0° |
| C15 | O24 | H3 | 109.5° | 117.0° |
| C16 | C18 | C36 | 122.4° | 120.0° |
| C16 | C18 | C40 | 121.8° | 120.0° |
| C18 | C16 | H161 | 107.0° | 109.4° |
| C18 | C16 | H162 | 107.0° | 109.5° |
| C17 | C19 | C20 | 119.3° | 120.0° |
| C19 | C17 | H171 | 118.5° | 120.0° |
| C17 | C19 | H191 | 120.4° | 120.0° |
| C36 | C18 | C40 | 115.8° | 119.9° |
| C18 | C36 | C37 | 121.4° | 120.1° |
| C18 | C36 | H361 | 119.3° | 120.0° |
| C18 | C40 | C39 | 123.4° | 120.0° |
| C18 | C40 | H401 | 118.3° | 119.9° |
| C19 | C20 | C21 | 118.9° | 120.0° |
| C20 | C19 | H191 | 120.4° | 120.0° |
| C19 | C20 | H201 | 120.5° | 120.0° |
| C20 | C21 | C22 | 120.9° | 120.0° |
| C21 | C20 | H201 | 120.5° | 120.0° |
| C20 | C21 | H211 | 119.6° | 120.0° |
| C22 | C21 | H211 | 119.6° | 120.0° |
| C21 | C22 | H221 | 119.1° | 120.0° |
| N24 | C23 | C38 | 114.9° | 109.5° |
| N24 | C23 | H231 | 108.1° | 109.5° |
| N24 | C23 | H232 | 108.1° | 109.5° |
| C23 | N24 | H241 | 109.5° | 111.1° |
| C23 | N24 | H242 | 109.4° | 111.0° |
| C23 | C38 | C37 | 118.7° | 120.0° |
| C23 | C38 | C39 | 124.9° | 120.0° |
| C38 | C23 | H231 | 108.1° | 109.5° |
| C38 | C23 | H232 | 108.1° | 109.4° |
| C36 | C37 | C38 | 121.9° | 120.0° |
| C37 | C36 | H361 | 119.3° | 120.0° |
| C36 | C37 | H371 | 119.0° | 120.0° |
| C37 | C38 | C39 | 116.4° | 120.0° |
| C38 | C37 | H371 | 119.0° | 120.0° |
| C38 | C39 | C40 | 121.1° | 120.0° |
| C38 | C39 | H391 | 119.4° | 120.0° |
| C40 | C39 | H391 | 119.4° | 120.0° |
| C39 | C40 | H401 | 118.3° | 120.0° |
| H11 | C1 | H12 | 109.5° | 109.5° |
| H61 | C6 | H62 | 109.5° | 109.5° |
| H101 | N10 | H102 | 109.4° | 111.0° |
| H111 | C11 | H112 | 109.5° | 109.5° |
| H161 | C16 | H162 | 109.5° | 109.5° |
| H231 | C23 | H232 | 109.4° | 109.4° |
| H241 | N24 | H242 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | P11 | C11 | O12 | 120.4° | 120.0° |
| C3 | P11 | C11 | O13 | 117.4° | 120.0° |
| C3 | P11 | O12 | O13 | 115.8° | 120.0° |
| P11 | C3 | C1 | N10 | 121.5° | 120.0° |
| P11 | C3 | C1 | H31 | 118.0° | 120.1° |
| P11 | C3 | C1 | C6 | 177.9° | 60.0° |
| P11 | C3 | N10 | H31 | 114.2° | 120.1° |
| C3 | P11 | C11 | C13 | 146.6° | 175.0° |
| P11 | C3 | C1 | H11 | 61.3° | 180.0° |
| P11 | C3 | C1 | H12 | 57.1° | 60.0° |
| P11 | C3 | N10 | H101 | 180.0° | 60.0° |
| P11 | C3 | N10 | H102 | 60.0° | 176.1° |
| C3 | P11 | C11 | H111 | 92.4° | 55.0° |
| C3 | P11 | C11 | H112 | 25.6° | 65.0° |
| C3 | P11 | O13 | H132 | 115.2° | 60.0° |
| C11 | P11 | O12 | O13 | 122.4° | 120.0° |
| C11 | P11 | C3 | C1 | 57.8° | 180.0° |
| C11 | P11 | C3 | N10 | 177.7° | 60.0° |
| P11 | C11 | C13 | H111 | 121.0° | 119.9° |
| P11 | C11 | C13 | H112 | 121.0° | 120.0° |
| P11 | C11 | C13 | C15 | 161.4° | 75.0° |
| P11 | C11 | C13 | C16 | 80.5° | 165.0° |
| C11 | P11 | C3 | H31 | 61.8° | 60.0° |
| P11 | C11 | H111 | H112 | 116.8° | 120.0° |
| P11 | C11 | C13 | H131 | 40.9° | 45.0° |
| C11 | P11 | O13 | H132 | 126.4° | 60.0° |
| O12 | P11 | C3 | C1 | 176.6° | 60.0° |
| O12 | P11 | C3 | N10 | 52.1° | 60.0° |
| O12 | P11 | C11 | C13 | 93.0° | 55.0° |
| O12 | P11 | C3 | H31 | 63.8° | 180.0° |
| O12 | P11 | C11 | H111 | 28.0° | 65.0° |
| O12 | P11 | C11 | H112 | 146.0° | 175.0° |
| O12 | P11 | O13 | H132 | 0.0° | 180.0° |
| O13 | P11 | C3 | C1 | 60.3° | 60.0° |
| O13 | P11 | C3 | N10 | 64.2° | 180.0° |
| O13 | P11 | C11 | C13 | 29.2° | 65.0° |
| O13 | P11 | C3 | H31 | 179.9° | 60.0° |
| O13 | P11 | C11 | H111 | 150.3° | 175.0° |
| O13 | P11 | C11 | H112 | 91.8° | 55.0° |
| C3 | C1 | C6 | H11 | 120.8° | 120.0° |
| C3 | C1 | C6 | H12 | 120.9° | 120.0° |
| C1 | C3 | N10 | H31 | 120.6° | 120.0° |
| C3 | C1 | C6 | C8 | 129.0° | 180.0° |
| C3 | C1 | H11 | H12 | 117.4° | 120.0° |
| C3 | C1 | C6 | H61 | 7.5° | 60.0° |
| C3 | C1 | C6 | H62 | 109.6° | 60.1° |
| C1 | C3 | N10 | H101 | 54.7° | 60.0° |
| C1 | C3 | N10 | H102 | 174.7° | 64.0° |
| C6 | C1 | C3 | N10 | 60.6° | 180.0° |
| C1 | C6 | C8 | H61 | 121.4° | 120.0° |
| C1 | C6 | C8 | H62 | 121.4° | 120.0° |
| C1 | C6 | C8 | C17 | 58.4° | 90.0° |
| C1 | C6 | C8 | C22 | 123.7° | 90.3° |
| C6 | C1 | H11 | H12 | 117.4° | 120.0° |
| C6 | C1 | C3 | H31 | 59.9° | 60.0° |
| C1 | C6 | H61 | H62 | 115.4° | 120.0° |
| N10 | C3 | C1 | H11 | 60.3° | 60.0° |
| N10 | C3 | C1 | H12 | 178.6° | 60.0° |
| C3 | N10 | H101 | H102 | 120.0° | 123.9° |
| C6 | C8 | C17 | C22 | 178.0° | 179.7° |
| C6 | C8 | C17 | C19 | 178.3° | 180.0° |
| C6 | C8 | C22 | C21 | 178.1° | 179.8° |
| C8 | C6 | C1 | H11 | 110.2° | 60.0° |
| C8 | C6 | C1 | H12 | 8.1° | 60.0° |
| C8 | C6 | H61 | H62 | 115.4° | 120.0° |
| C6 | C8 | C17 | H171 | 1.7° | 0.0° |
| C6 | C8 | C22 | H221 | 1.9° | 0.0° |
| C8 | C17 | C19 | H171 | 180.0° | 180.0° |
| C8 | C17 | C19 | C20 | 0.0° | 0.0° |
| C17 | C8 | C22 | C21 | 0.1° | 0.5° |
| C17 | C8 | C6 | H61 | 63.0° | 30.0° |
| C17 | C8 | C6 | H62 | 179.9° | 150.0° |
| C8 | C17 | C19 | H191 | 180.0° | 180.0° |
| C17 | C8 | C22 | H221 | 179.9° | 179.7° |
| C22 | C8 | C17 | C19 | 0.3° | 0.3° |
| C8 | C22 | C21 | C20 | 0.4° | 0.5° |
| C8 | C22 | C21 | H221 | 180.0° | 179.8° |
| C22 | C8 | C6 | H61 | 114.9° | 149.7° |
| C22 | C8 | C6 | H62 | 2.2° | 29.7° |
| C22 | C8 | C17 | H171 | 179.7° | 179.8° |
| C8 | C22 | C21 | H211 | 179.6° | 179.8° |
| C11 | C13 | C15 | C16 | 121.3° | 119.9° |
| C11 | C13 | C15 | H131 | 120.7° | 120.0° |
| C11 | C13 | C16 | H131 | 121.0° | 120.0° |
| C11 | C13 | C15 | O23 | 131.6° | 0.0° |
| C11 | C13 | C15 | O24 | 47.3° | 180.0° |
| C11 | C13 | C16 | C18 | 159.8° | 175.0° |
| C13 | C11 | H111 | H112 | 116.7° | 120.0° |
| C11 | C13 | C16 | H161 | 38.4° | 55.1° |
| C11 | C13 | C16 | H162 | 78.9° | 65.0° |
| C15 | C13 | C16 | H131 | 117.2° | 120.0° |
| C13 | C15 | O23 | O24 | 178.7° | 179.9° |
| C15 | C13 | C16 | C18 | 78.4° | 65.0° |
| C15 | C13 | C11 | H111 | 77.6° | 165.0° |
| C15 | C13 | C11 | H112 | 40.4° | 45.0° |
| C15 | C13 | C16 | H161 | 160.3° | 175.0° |
| C15 | C13 | C16 | H162 | 43.0° | 55.0° |
| C13 | C15 | O24 | H3 | 178.8° | 180.0° |
| C16 | C13 | C15 | O23 | 10.3° | 120.0° |
| C16 | C13 | C15 | O24 | 168.5° | 60.1° |
| C13 | C16 | C18 | H161 | 121.4° | 120.0° |
| C13 | C16 | C18 | H162 | 121.3° | 120.0° |
| C13 | C16 | C18 | C36 | 19.0° | 90.0° |
| C13 | C16 | C18 | C40 | 162.4° | 90.3° |
| C16 | C13 | C11 | H111 | 40.5° | 45.1° |
| C16 | C13 | C11 | H112 | 158.5° | 75.0° |
| C13 | C16 | H161 | H162 | 115.7° | 120.1° |
| O23 | C15 | C13 | H131 | 107.7° | 120.0° |
| O23 | C15 | O24 | H3 | 0.0° | 0.1° |
| O24 | C15 | C13 | H131 | 73.4° | 60.0° |
| C16 | C18 | C36 | C40 | 178.7° | 179.7° |
| C16 | C18 | C36 | C37 | 178.6° | 180.0° |
| C16 | C18 | C40 | C39 | 178.6° | 179.8° |
| C18 | C16 | C13 | H131 | 38.8° | 55.0° |
| C18 | C16 | H161 | H162 | 115.6° | 120.0° |
| C16 | C18 | C36 | H361 | 1.4° | 0.0° |
| C16 | C18 | C40 | H401 | 1.4° | 0.0° |
| C17 | C19 | C20 | H191 | 180.0° | 180.0° |
| C17 | C19 | C20 | C21 | 0.5° | 0.0° |
| C17 | C19 | C20 | H201 | 179.5° | 180.0° |
| C18 | C36 | C37 | H361 | 180.0° | 180.0° |
| C18 | C36 | C37 | C38 | 0.1° | 0.0° |
| C36 | C18 | C40 | C39 | 0.1° | 0.5° |
| C36 | C18 | C16 | H161 | 102.4° | 30.0° |
| C36 | C18 | C16 | H162 | 140.3° | 150.0° |
| C18 | C36 | C37 | H371 | 179.9° | 179.9° |
| C36 | C18 | C40 | H401 | 179.9° | 179.7° |
| C40 | C18 | C36 | C37 | 0.1° | 0.2° |
| C18 | C40 | C39 | C38 | 0.0° | 0.5° |
| C18 | C40 | C39 | H401 | 180.0° | 179.8° |
| C40 | C18 | C16 | H161 | 76.2° | 149.7° |
| C40 | C18 | C16 | H162 | 41.1° | 29.7° |
| C40 | C18 | C36 | H361 | 179.9° | 179.8° |
| C18 | C40 | C39 | H391 | 180.0° | 179.8° |
| C19 | C20 | C21 | H201 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.7° | 0.2° |
| C20 | C19 | C17 | H171 | 180.0° | 180.0° |
| C19 | C20 | C21 | H211 | 179.3° | 180.0° |
| C20 | C21 | C22 | H211 | 180.0° | 179.7° |
| C21 | C20 | C19 | H191 | 179.5° | 180.0° |
| C20 | C21 | C22 | H221 | 179.6° | 179.8° |
| C22 | C21 | C20 | H201 | 179.3° | 179.8° |
| N24 | C23 | C38 | H231 | 120.8° | 120.1° |
| N24 | C23 | C38 | H232 | 120.8° | 120.0° |
| N24 | C23 | C38 | C37 | 177.3° | 90.0° |
| N24 | C23 | C38 | C39 | 2.8° | 90.0° |
| N24 | C23 | H231 | H232 | 117.5° | 120.0° |
| C23 | N24 | H241 | H242 | 120.0° | 123.9° |
| C23 | C38 | C37 | C36 | 179.9° | 180.0° |
| C23 | C38 | C37 | C39 | 179.9° | 180.0° |
| C23 | C38 | C39 | C40 | 179.9° | 179.8° |
| C38 | C23 | H231 | H232 | 117.5° | 120.0° |
| C38 | C23 | N24 | H241 | 180.0° | 56.0° |
| C38 | C23 | N24 | H242 | 60.0° | 180.0° |
| C23 | C38 | C37 | H371 | 0.2° | 0.1° |
| C23 | C38 | C39 | H391 | 0.1° | 0.0° |
| C36 | C37 | C38 | H371 | 180.0° | 179.9° |
| C36 | C37 | C38 | C39 | 0.0° | 0.0° |
| C37 | C38 | C39 | C40 | 0.0° | 0.2° |
| C37 | C38 | C23 | H231 | 56.5° | 30.1° |
| C37 | C38 | C23 | H232 | 61.9° | 150.0° |
| C38 | C37 | C36 | H361 | 179.9° | 180.0° |
| C37 | C38 | C39 | H391 | 180.0° | 180.0° |
| C38 | C39 | C40 | H391 | 180.0° | 179.7° |
| C39 | C38 | C23 | H231 | 123.6° | 149.9° |
| C39 | C38 | C23 | H232 | 118.0° | 30.0° |
| C39 | C38 | C37 | H371 | 179.9° | 179.9° |
| C38 | C39 | C40 | H401 | 180.0° | 179.7° |
| H11 | C1 | C3 | H31 | 179.3° | 60.0° |
| H11 | C1 | C6 | H61 | 128.4° | 180.0° |
| H11 | C1 | C6 | H62 | 11.2° | 59.9° |
| H12 | C1 | C3 | H31 | 60.9° | 180.0° |
| H12 | C1 | C6 | H61 | 113.3° | 60.0° |
| H12 | C1 | C6 | H62 | 129.6° | 179.9° |
| H31 | C3 | N10 | H101 | 65.8° | 179.9° |
| H31 | C3 | N10 | H102 | 54.1° | 56.0° |
| H111 | C11 | C13 | H131 | 162.0° | 75.0° |
| H112 | C11 | C13 | H131 | 80.1° | 165.0° |
| H131 | C13 | C16 | H161 | 82.5° | 65.0° |
| H131 | C13 | C16 | H162 | 160.2° | 175.0° |
| H171 | C17 | C19 | H191 | 0.0° | 0.0° |
| H191 | C19 | C20 | H201 | 0.5° | 0.0° |
| H201 | C20 | C21 | H211 | 0.7° | 0.0° |
| H211 | C21 | C22 | H221 | 0.4° | 0.0° |
| H231 | C23 | N24 | H241 | 59.2° | 176.1° |
| H231 | C23 | N24 | H242 | 60.8° | 60.0° |
| H232 | C23 | N24 | H241 | 59.2° | 63.9° |
| H232 | C23 | N24 | H242 | 179.2° | 60.0° |
| H361 | C36 | C37 | H371 | 0.1° | 0.1° |
| H391 | C39 | C40 | H401 | 0.0° | 0.0° |
