ZPH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.56Å | |
| C1 | N | sing | 1.47Å | 1.45Å | |
| C1 | P1 | sing | 1.82Å | 1.80Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | C3 | sing | 1.53Å | 1.56Å | |
| C2 | H | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | C5 | sing | 1.53Å | 1.50Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | 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 | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| N | H11 | sing | 1.01Å | 1.00Å | |
| P1 | O1 | doub | 1.48Å | 1.48Å | |
| P1 | O2 | sing | 1.61Å | 1.46Å | |
| P1 | O3 | sing | 1.61Å | 1.50Å | |
| O2 | H12 | sing | 0.97Å | 0.95Å | |
| C6 | C7 | sing | 1.53Å | 1.55Å | |
| C6 | C14 | sing | 1.51Å | 1.55Å | |
| C6 | O3 | sing | 1.43Å | 1.48Å | |
| C6 | H13 | sing | 1.09Å | 1.10Å | |
| C7 | C8 | sing | 1.51Å | 1.52Å | |
| C7 | H14 | sing | 1.09Å | 1.10Å | |
| C7 | H15 | sing | 1.09Å | 1.10Å | |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | H16 | sing | 1.08Å | 1.08Å | |
| C10 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | H17 | sing | 1.08Å | 1.08Å | |
| C11 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | H18 | sing | 1.08Å | 1.08Å | |
| C12 | C13 | sing | 1.38Å | 1.36Å | Aromatic |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| C13 | H20 | sing | 1.08Å | 1.08Å | |
| C14 | O4 | sing | 1.34Å | 1.40Å | |
| C14 | O5 | doub | 1.21Å | 1.24Å | |
| C15 | O4 | sing | 1.45Å | 1.41Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| N | H2 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | N | 111.8° | 109.5° |
| C2 | C1 | P1 | 111.1° | 109.5° |
| C2 | C1 | H1 | 107.7° | 109.5° |
| C1 | C2 | C3 | 120.4° | 109.5° |
| C1 | C2 | H | 106.0° | 109.5° |
| C1 | C2 | H3 | 106.0° | 109.5° |
| N | C1 | P1 | 112.2° | 109.5° |
| N | C1 | H1 | 106.5° | 109.4° |
| C1 | N | H11 | 109.5° | 111.0° |
| C1 | N | H2 | 109.4° | 111.0° |
| P1 | C1 | H1 | 107.3° | 109.5° |
| C1 | P1 | O1 | 109.2° | 109.5° |
| C1 | P1 | O2 | 106.2° | 109.4° |
| C1 | P1 | O3 | 103.0° | 109.5° |
| C3 | C2 | H | 106.0° | 109.5° |
| C3 | C2 | H3 | 106.0° | 109.5° |
| C2 | C3 | C4 | 111.3° | 109.5° |
| C2 | C3 | C5 | 113.3° | 109.5° |
| C2 | C3 | H4 | 110.8° | 109.5° |
| H | C2 | H3 | 112.7° | 109.5° |
| C4 | C3 | C5 | 120.7° | 109.4° |
| C4 | C3 | H4 | 100.7° | 109.4° |
| C3 | C4 | H5 | 109.5° | 109.4° |
| C3 | C4 | H6 | 109.5° | 109.5° |
| C3 | C4 | H7 | 109.5° | 109.5° |
| C5 | C3 | H4 | 97.9° | 109.5° |
| C3 | C5 | H8 | 109.5° | 109.5° |
| C3 | C5 | H9 | 109.5° | 109.5° |
| C3 | C5 | H10 | 109.5° | 109.5° |
| H5 | C4 | H6 | 109.5° | 109.5° |
| H5 | C4 | H7 | 109.4° | 109.5° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H8 | C5 | H9 | 109.4° | 109.4° |
| H8 | C5 | H10 | 109.5° | 109.4° |
| H9 | C5 | H10 | 109.5° | 109.5° |
| H11 | N | H2 | 109.5° | 111.0° |
| O1 | P1 | O2 | 113.7° | 109.5° |
| O1 | P1 | O3 | 109.1° | 109.5° |
| O2 | P1 | O3 | 115.0° | 109.5° |
| P1 | O2 | H12 | 109.5° | 114.0° |
| P1 | O3 | C6 | 120.7° | 123.0° |
| C7 | C6 | C14 | 107.4° | 109.4° |
| C7 | C6 | O3 | 113.2° | 109.5° |
| C7 | C6 | H13 | 107.8° | 109.5° |
| C6 | C7 | C8 | 117.2° | 109.5° |
| C6 | C7 | H14 | 107.0° | 109.5° |
| C6 | C7 | H15 | 107.0° | 109.5° |
| C14 | C6 | O3 | 107.5° | 109.5° |
| C14 | C6 | H13 | 113.4° | 109.4° |
| C6 | C14 | O4 | 116.2° | 120.0° |
| C6 | C14 | O5 | 122.2° | 120.0° |
| O3 | C6 | H13 | 107.7° | 109.5° |
| C8 | C7 | H14 | 107.0° | 109.5° |
| C8 | C7 | H15 | 107.0° | 109.4° |
| C7 | C8 | C9 | 120.3° | 120.0° |
| C7 | C8 | C10 | 120.9° | 120.0° |
| H14 | C7 | H15 | 111.8° | 109.5° |
| C9 | C8 | C10 | 118.8° | 120.0° |
| C8 | C9 | C11 | 119.2° | 120.0° |
| C8 | C9 | H16 | 120.4° | 120.0° |
| C8 | C10 | C12 | 120.3° | 120.0° |
| C8 | C10 | H17 | 119.9° | 120.0° |
| C11 | C9 | H16 | 120.4° | 120.0° |
| C9 | C11 | C13 | 121.4° | 120.0° |
| C9 | C11 | H18 | 119.3° | 120.0° |
| C12 | C10 | H17 | 119.9° | 120.0° |
| C10 | C12 | C13 | 121.7° | 120.0° |
| C10 | C12 | H19 | 119.1° | 120.0° |
| C13 | C11 | H18 | 119.3° | 120.0° |
| C11 | C13 | C12 | 118.2° | 120.0° |
| C11 | C13 | H20 | 120.9° | 120.0° |
| C13 | C12 | H19 | 119.2° | 120.0° |
| C12 | C13 | H20 | 120.9° | 120.0° |
| O4 | C14 | O5 | 121.6° | 120.0° |
| C14 | O4 | C15 | 118.2° | 117.0° |
| O4 | C15 | H21 | 109.5° | 109.5° |
| O4 | C15 | H22 | 109.5° | 109.4° |
| O4 | C15 | H23 | 109.5° | 109.4° |
| H21 | C15 | H22 | 109.5° | 109.5° |
| H21 | C15 | H23 | 109.4° | 109.5° |
| H22 | C15 | H23 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | N | P1 | 125.5° | 120.0° |
| C2 | C1 | N | H1 | 117.4° | 120.0° |
| C2 | C1 | P1 | H1 | 117.5° | 120.0° |
| C1 | C2 | C3 | H | 120.0° | 120.0° |
| C1 | C2 | C3 | H3 | 120.0° | 120.0° |
| C1 | C2 | H | H3 | 115.5° | 120.0° |
| C1 | C2 | C3 | C4 | 158.6° | 174.5° |
| C1 | C2 | C3 | C5 | 61.5° | 65.5° |
| C1 | C2 | C3 | H4 | 47.4° | 54.5° |
| C2 | C1 | N | H11 | 180.0° | 60.0° |
| C2 | C1 | P1 | O1 | 45.4° | 55.6° |
| C2 | C1 | P1 | O2 | 77.6° | 175.6° |
| C2 | C1 | P1 | O3 | 161.2° | 64.4° |
| C2 | C1 | N | H2 | 60.0° | 64.0° |
| N | C1 | P1 | H1 | 116.6° | 120.0° |
| N | C1 | C2 | C3 | 47.6° | 62.3° |
| N | C1 | C2 | H | 72.4° | 57.6° |
| N | C1 | C2 | H3 | 167.5° | 177.7° |
| C1 | N | H11 | H2 | 120.0° | 124.0° |
| N | C1 | P1 | O1 | 171.3° | 64.4° |
| N | C1 | P1 | O2 | 48.4° | 55.6° |
| N | C1 | P1 | O3 | 72.9° | 175.6° |
| P1 | C1 | C2 | C3 | 173.7° | 177.7° |
| P1 | C1 | C2 | H | 53.7° | 62.3° |
| P1 | C1 | C2 | H3 | 66.3° | 57.7° |
| P1 | C1 | N | H11 | 54.4° | 60.0° |
| C1 | P1 | O1 | O2 | 118.3° | 120.0° |
| C1 | P1 | O1 | O3 | 111.8° | 120.0° |
| C1 | P1 | O2 | O3 | 113.1° | 120.0° |
| C1 | P1 | O2 | H12 | 120.0° | 60.0° |
| C1 | P1 | O3 | C6 | 146.7° | 177.5° |
| P1 | C1 | N | H2 | 65.6° | 176.1° |
| H1 | C1 | C2 | C3 | 69.1° | 57.7° |
| H1 | C1 | C2 | H | 170.9° | 177.6° |
| H1 | C1 | C2 | H3 | 50.9° | 62.3° |
| H1 | C1 | N | H11 | 62.6° | 180.0° |
| H1 | C1 | P1 | O1 | 72.1° | 175.6° |
| H1 | C1 | P1 | O2 | 165.0° | 64.4° |
| H1 | C1 | P1 | O3 | 43.7° | 55.6° |
| H1 | C1 | N | H2 | 177.4° | 56.1° |
| C3 | C2 | H | H3 | 115.5° | 120.0° |
| C2 | C3 | C4 | C5 | 136.6° | 120.0° |
| C2 | C3 | C4 | H4 | 117.5° | 120.0° |
| C2 | C3 | C5 | H4 | 116.7° | 120.1° |
| C2 | C3 | C4 | H5 | 180.0° | 60.0° |
| C2 | C3 | C4 | H6 | 60.0° | 180.0° |
| C2 | C3 | C4 | H7 | 60.0° | 60.0° |
| C2 | C3 | C5 | H8 | 180.0° | 56.2° |
| C2 | C3 | C5 | H9 | 60.0° | 176.2° |
| C2 | C3 | C5 | H10 | 60.0° | 63.7° |
| H | C2 | C3 | C4 | 38.6° | 54.5° |
| H | C2 | C3 | C5 | 178.5° | 174.5° |
| H | C2 | C3 | H4 | 72.6° | 65.5° |
| H3 | C2 | C3 | C4 | 81.5° | 65.5° |
| H3 | C2 | C3 | C5 | 58.5° | 54.5° |
| H3 | C2 | C3 | H4 | 167.4° | 174.5° |
| C4 | C3 | C5 | H4 | 107.5° | 119.9° |
| C3 | C4 | H5 | H6 | 120.0° | 120.0° |
| C3 | C4 | H5 | H7 | 120.0° | 119.9° |
| C3 | C4 | H6 | H7 | 120.0° | 120.0° |
| C4 | C3 | C5 | H8 | 44.2° | 176.2° |
| C4 | C3 | C5 | H9 | 75.8° | 63.8° |
| C4 | C3 | C5 | H10 | 164.2° | 56.3° |
| C5 | C3 | C4 | H5 | 43.4° | 60.0° |
| C5 | C3 | C4 | H6 | 163.4° | 60.0° |
| C5 | C3 | C4 | H7 | 76.6° | 180.0° |
| C3 | C5 | H8 | H9 | 120.0° | 120.0° |
| C3 | C5 | H8 | H10 | 120.0° | 120.0° |
| C3 | C5 | H9 | H10 | 120.0° | 120.0° |
| H4 | C3 | C4 | H5 | 62.5° | 180.0° |
| H4 | C3 | C4 | H6 | 57.5° | 60.0° |
| H4 | C3 | C4 | H7 | 177.5° | 60.1° |
| H4 | C3 | C5 | H8 | 63.3° | 63.9° |
| H4 | C3 | C5 | H9 | 176.8° | 56.1° |
| H4 | C3 | C5 | H10 | 56.8° | 176.2° |
| H5 | C4 | H6 | H7 | 120.0° | 120.1° |
| H8 | C5 | H9 | H10 | 120.0° | 120.0° |
| O1 | P1 | O2 | O3 | 126.8° | 120.0° |
| O1 | P1 | O2 | H12 | 0.0° | 180.0° |
| O1 | P1 | O3 | C6 | 30.8° | 57.5° |
| O2 | P1 | O3 | C6 | 98.3° | 62.5° |
| O3 | P1 | O2 | H12 | 126.8° | 60.0° |
| P1 | O3 | C6 | C7 | 128.4° | 127.2° |
| P1 | O3 | C6 | C14 | 113.2° | 112.8° |
| P1 | O3 | C6 | H13 | 9.3° | 7.2° |
| C7 | C6 | C14 | O3 | 122.1° | 120.0° |
| C7 | C6 | C14 | H13 | 119.0° | 120.0° |
| C7 | C6 | O3 | H13 | 119.0° | 120.0° |
| C6 | C7 | C8 | H14 | 120.0° | 120.0° |
| C6 | C7 | C8 | H15 | 120.0° | 120.0° |
| C6 | C7 | H14 | H15 | 116.8° | 120.0° |
| C6 | C7 | C8 | C9 | 96.0° | 90.0° |
| C6 | C7 | C8 | C10 | 82.6° | 90.3° |
| C7 | C6 | C14 | O4 | 63.5° | 64.7° |
| C7 | C6 | C14 | O5 | 114.8° | 115.4° |
| C14 | C6 | O3 | H13 | 122.5° | 120.0° |
| C14 | C6 | C7 | C8 | 55.8° | 175.0° |
| C14 | C6 | C7 | H14 | 64.2° | 65.0° |
| C14 | C6 | C7 | H15 | 175.8° | 55.0° |
| C6 | C14 | O4 | O5 | 178.3° | 179.9° |
| C6 | C14 | O4 | C15 | 178.1° | 180.0° |
| O3 | C6 | C7 | C8 | 62.7° | 65.0° |
| O3 | C6 | C7 | H14 | 177.3° | 55.0° |
| O3 | C6 | C7 | H15 | 57.3° | 175.0° |
| O3 | C6 | C14 | O4 | 174.4° | 175.3° |
| O3 | C6 | C14 | O5 | 7.3° | 4.7° |
| H13 | C6 | C7 | C8 | 178.3° | 55.0° |
| H13 | C6 | C7 | H14 | 58.3° | 175.0° |
| H13 | C6 | C7 | H15 | 61.7° | 65.0° |
| H13 | C6 | C14 | O4 | 55.5° | 55.3° |
| H13 | C6 | C14 | O5 | 126.2° | 124.6° |
| C8 | C7 | H14 | H15 | 116.8° | 120.0° |
| C7 | C8 | C9 | C10 | 178.7° | 179.7° |
| C7 | C8 | C9 | C11 | 177.8° | 180.0° |
| C7 | C8 | C9 | H16 | 2.2° | 0.1° |
| C7 | C8 | C10 | C12 | 173.4° | 180.0° |
| C7 | C8 | C10 | H17 | 6.6° | 0.0° |
| H14 | C7 | C8 | C9 | 24.0° | 30.0° |
| H14 | C7 | C8 | C10 | 157.4° | 149.7° |
| H15 | C7 | C8 | C9 | 144.0° | 150.0° |
| H15 | C7 | C8 | C10 | 37.4° | 29.7° |
| C8 | C9 | C11 | H16 | 180.0° | 180.0° |
| C9 | C8 | C10 | C12 | 5.3° | 0.3° |
| C9 | C8 | C10 | H17 | 174.8° | 179.8° |
| C8 | C9 | C11 | C13 | 0.9° | 0.0° |
| C8 | C9 | C11 | H18 | 179.1° | 180.0° |
| C10 | C8 | C9 | C11 | 0.9° | 0.3° |
| C10 | C8 | C9 | H16 | 179.1° | 179.7° |
| C8 | C10 | C12 | H17 | 180.0° | 179.9° |
| C8 | C10 | C12 | C13 | 8.1° | 0.0° |
| C8 | C10 | C12 | H19 | 171.9° | 180.0° |
| C9 | C11 | C13 | H18 | 180.0° | 180.0° |
| C9 | C11 | C13 | C12 | 1.6° | 0.3° |
| C9 | C11 | C13 | H20 | 178.4° | 180.0° |
| H16 | C9 | C11 | C13 | 179.1° | 180.0° |
| H16 | C9 | C11 | H18 | 0.9° | 0.1° |
| C10 | C12 | C13 | C11 | 6.1° | 0.3° |
| C10 | C12 | C13 | H19 | 180.0° | 180.0° |
| C10 | C12 | C13 | H20 | 173.9° | 180.0° |
| H17 | C10 | C12 | C13 | 171.9° | 179.9° |
| H17 | C10 | C12 | H19 | 8.1° | 0.0° |
| C11 | C13 | C12 | H20 | 180.0° | 179.7° |
| C11 | C13 | C12 | H19 | 173.9° | 179.7° |
| H18 | C11 | C13 | C12 | 178.4° | 179.7° |
| H18 | C11 | C13 | H20 | 1.6° | 0.0° |
| H19 | C12 | C13 | H20 | 6.1° | 0.0° |
| C14 | O4 | C15 | H21 | 180.0° | 179.9° |
| C14 | O4 | C15 | H22 | 60.0° | 59.9° |
| C14 | O4 | C15 | H23 | 60.0° | 60.0° |
| O5 | C14 | O4 | C15 | 3.6° | 0.1° |
| O4 | C15 | H21 | H22 | 120.0° | 120.0° |
| O4 | C15 | H21 | H23 | 120.0° | 120.0° |
| O4 | C15 | H22 | H23 | 120.0° | 119.9° |
| H21 | C15 | H22 | H23 | 120.0° | 120.1° |
