9X8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | N1 | doub | 1.32Å | 1.41Å | Aromatic |
| C17 | N2 | sing | 1.32Å | 1.37Å | Aromatic |
| N1 | C3 | sing | 1.33Å | 1.33Å | Aromatic |
| N2 | C1 | doub | 1.33Å | 1.37Å | Aromatic |
| C3 | N5 | sing | 1.38Å | 1.36Å | |
| C3 | C2 | doub | 1.41Å | 1.35Å | Aromatic |
| C1 | C2 | sing | 1.40Å | 1.34Å | Aromatic |
| C1 | N3 | sing | 1.37Å | 1.31Å | Aromatic |
| C2 | N4 | sing | 1.35Å | 1.35Å | Aromatic |
| O12 | C16 | sing | 1.44Å | 1.43Å | |
| O12 | C13 | sing | 1.44Å | 1.45Å | |
| C16 | N3 | sing | 1.46Å | 1.48Å | |
| C16 | C15 | sing | 1.54Å | 1.53Å | |
| O6 | P1 | doub | 1.48Å | 1.50Å | |
| N3 | C4 | sing | 1.36Å | 1.32Å | Aromatic |
| C13 | C14 | sing | 1.54Å | 1.60Å | |
| C13 | C12 | sing | 1.53Å | 1.50Å | |
| O13 | C14 | sing | 1.43Å | 1.46Å | |
| O7 | P1 | sing | 1.61Å | 1.49Å | |
| N4 | C4 | doub | 1.30Å | 1.33Å | Aromatic |
| O14 | C15 | sing | 1.43Å | 1.40Å | |
| P1 | O5 | sing | 1.61Å | 1.51Å | |
| P1 | O8 | sing | 1.61Å | 1.57Å | |
| C14 | C15 | sing | 1.54Å | 1.53Å | |
| C12 | O11 | sing | 1.43Å | 1.47Å | |
| C11 | O5 | sing | 1.43Å | 1.41Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| O11 | P2 | sing | 1.61Å | 1.55Å | |
| O2 | C8 | sing | 1.43Å | 1.50Å | |
| O8 | P2 | sing | 1.61Å | 1.66Å | |
| C10 | C8 | sing | 1.55Å | 1.51Å | |
| C10 | O4 | sing | 1.44Å | 1.53Å | |
| P2 | O9 | doub | 1.48Å | 1.49Å | |
| P2 | O10 | sing | 1.61Å | 1.48Å | |
| C8 | C7 | sing | 1.55Å | 1.55Å | |
| C5 | C6 | sing | 1.51Å | 1.54Å | |
| O4 | C9 | sing | 1.43Å | 1.44Å | |
| C6 | S1 | doub | 1.60Å | 1.74Å | |
| C6 | O1 | sing | 1.34Å | 1.33Å | |
| O1 | C7 | sing | 1.45Å | 1.41Å | |
| C7 | C9 | sing | 1.54Å | 1.60Å | |
| C9 | O3 | sing | 1.43Å | 1.63Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| O2 | H9 | sing | 0.97Å | 0.95Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| O3 | H11 | sing | 0.97Å | 0.95Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| O7 | H15 | sing | 0.97Å | 0.95Å | |
| O10 | H16 | sing | 0.97Å | 0.95Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| O13 | H21 | sing | 0.97Å | 0.95Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| O14 | H23 | sing | 0.97Å | 0.95Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.08Å | 1.08Å | |
| N5 | H26 | sing | 0.97Å | 1.00Å | |
| N5 | H27 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C17 | N2 | 120.8° | 122.5° |
| C17 | N1 | C3 | 119.9° | 121.2° |
| N1 | C17 | H25 | 119.6° | 118.7° |
| C17 | N2 | C1 | 116.1° | 120.6° |
| N2 | C17 | H25 | 119.6° | 118.8° |
| N1 | C3 | N5 | 118.0° | 120.7° |
| N1 | C3 | C2 | 119.5° | 118.5° |
| N2 | C1 | C2 | 122.4° | 119.1° |
| N2 | C1 | N3 | 127.2° | 134.9° |
| N5 | C3 | C2 | 122.4° | 120.8° |
| C3 | N5 | H26 | 109.5° | 120.0° |
| C3 | N5 | H27 | 109.5° | 120.0° |
| C3 | C2 | C1 | 121.2° | 118.2° |
| C3 | C2 | N4 | 133.6° | 134.7° |
| C2 | C1 | N3 | 110.3° | 106.0° |
| C1 | C2 | N4 | 105.2° | 107.2° |
| C1 | N3 | C16 | 124.0° | 126.3° |
| C1 | N3 | C4 | 107.3° | 107.4° |
| C2 | N4 | C4 | 108.5° | 109.4° |
| C16 | O12 | C13 | 111.6° | 105.3° |
| O12 | C16 | N3 | 101.2° | 110.4° |
| O12 | C16 | C15 | 103.7° | 104.8° |
| O12 | C16 | H24 | 111.5° | 110.4° |
| O12 | C13 | C14 | 104.3° | 104.8° |
| O12 | C13 | C12 | 111.0° | 110.4° |
| O12 | C13 | H19 | 110.2° | 110.4° |
| N3 | C16 | C15 | 119.1° | 110.4° |
| C16 | N3 | C4 | 128.2° | 126.3° |
| N3 | C16 | H24 | 110.8° | 110.3° |
| C16 | C15 | O14 | 106.0° | 110.6° |
| C16 | C15 | C14 | 104.4° | 104.1° |
| C16 | C15 | H22 | 110.7° | 110.6° |
| C15 | C16 | H24 | 110.0° | 110.5° |
| O6 | P1 | O7 | 116.9° | 109.5° |
| O6 | P1 | O5 | 110.6° | 109.5° |
| O6 | P1 | O8 | 110.3° | 109.5° |
| N3 | C4 | N4 | 108.6° | 110.0° |
| N3 | C4 | H1 | 125.7° | 125.0° |
| C14 | C13 | C12 | 113.4° | 110.4° |
| C13 | C14 | O13 | 108.2° | 110.5° |
| C13 | C14 | C15 | 103.7° | 104.1° |
| C14 | C13 | H19 | 108.2° | 110.4° |
| C13 | C14 | H20 | 109.5° | 110.5° |
| C13 | C12 | O11 | 109.3° | 109.5° |
| C13 | C12 | H17 | 109.5° | 109.5° |
| C13 | C12 | H18 | 109.5° | 109.5° |
| C12 | C13 | H19 | 109.5° | 110.3° |
| O13 | C14 | C15 | 113.0° | 110.6° |
| O13 | C14 | H20 | 111.6° | 110.5° |
| C14 | O13 | H21 | 109.5° | 114.0° |
| O7 | P1 | O5 | 109.6° | 109.5° |
| O7 | P1 | O8 | 108.0° | 109.5° |
| P1 | O7 | H15 | 109.5° | 114.0° |
| N4 | C4 | H1 | 125.7° | 125.0° |
| O14 | C15 | C14 | 112.1° | 110.5° |
| O14 | C15 | H22 | 112.6° | 110.4° |
| C15 | O14 | H23 | 109.5° | 114.0° |
| O5 | P1 | O8 | 100.2° | 109.5° |
| P1 | O5 | C11 | 123.9° | 123.0° |
| P1 | O8 | P2 | 128.7° | 134.0° |
| C15 | C14 | H20 | 110.5° | 110.5° |
| C14 | C15 | H22 | 110.6° | 110.6° |
| C12 | O11 | P2 | 121.6° | 123.0° |
| O11 | C12 | H17 | 109.5° | 109.4° |
| O11 | C12 | H18 | 109.5° | 109.4° |
| O5 | C11 | C10 | 109.9° | 109.4° |
| O5 | C11 | H13 | 109.4° | 109.5° |
| O5 | C11 | H14 | 109.4° | 109.5° |
| C11 | C10 | C8 | 118.4° | 110.3° |
| C11 | C10 | O4 | 111.0° | 110.3° |
| C11 | C10 | H12 | 106.1° | 110.4° |
| C10 | C11 | H13 | 109.4° | 109.5° |
| C10 | C11 | H14 | 109.4° | 109.5° |
| O11 | P2 | O8 | 104.9° | 109.5° |
| O11 | P2 | O9 | 110.2° | 109.4° |
| O11 | P2 | O10 | 114.9° | 109.5° |
| O2 | C8 | C10 | 110.2° | 111.2° |
| O2 | C8 | C7 | 116.0° | 111.1° |
| O2 | C8 | H8 | 110.9° | 111.0° |
| C8 | O2 | H9 | 109.5° | 114.0° |
| O8 | P2 | O9 | 104.4° | 109.5° |
| O8 | P2 | O10 | 100.1° | 109.5° |
| C8 | C10 | O4 | 108.0° | 105.1° |
| C10 | C8 | C7 | 98.1° | 101.0° |
| C10 | C8 | H8 | 110.8° | 111.1° |
| C8 | C10 | H12 | 106.4° | 110.3° |
| C10 | O4 | C9 | 110.5° | 110.0° |
| O4 | C10 | H12 | 106.2° | 110.3° |
| O9 | P2 | O10 | 120.1° | 109.5° |
| P2 | O10 | H16 | 109.5° | 114.0° |
| C8 | C7 | O1 | 111.7° | 110.9° |
| C8 | C7 | C9 | 106.1° | 102.2° |
| C8 | C7 | H7 | 111.7° | 111.0° |
| C7 | C8 | H8 | 110.2° | 111.1° |
| C5 | C6 | S1 | 123.4° | 120.0° |
| C5 | C6 | O1 | 112.0° | 120.0° |
| C6 | C5 | H2 | 109.5° | 109.5° |
| C6 | C5 | H3 | 109.5° | 109.4° |
| C6 | C5 | H4 | 109.5° | 109.5° |
| O4 | C9 | C7 | 100.9° | 107.6° |
| O4 | C9 | O3 | 113.9° | 109.8° |
| O4 | C9 | H10 | 109.6° | 109.9° |
| S1 | C6 | O1 | 124.1° | 120.0° |
| C6 | O1 | C7 | 116.4° | 117.0° |
| O1 | C7 | C9 | 101.6° | 110.8° |
| O1 | C7 | H7 | 114.0° | 110.7° |
| C7 | C9 | O3 | 117.3° | 109.8° |
| C9 | C7 | H7 | 111.0° | 110.9° |
| C7 | C9 | H10 | 107.6° | 109.9° |
| O3 | C9 | H10 | 107.3° | 109.8° |
| C9 | O3 | H11 | 109.5° | 114.0° |
| H2 | C5 | H3 | 109.5° | 109.5° |
| H2 | C5 | H4 | 109.5° | 109.5° |
| H3 | C5 | H4 | 109.4° | 109.4° |
| H13 | C11 | H14 | 109.5° | 109.5° |
| H17 | C12 | H18 | 109.5° | 109.5° |
| H26 | N5 | H27 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C17 | N2 | H25 | 180.0° | 179.7° |
| N1 | C17 | N2 | C1 | 2.2° | 0.5° |
| C17 | N1 | C3 | N5 | 178.2° | 180.0° |
| C17 | N1 | C3 | C2 | 0.5° | 0.0° |
| N2 | C17 | N1 | C3 | 0.9° | 0.3° |
| C17 | N2 | C1 | C2 | 3.3° | 0.5° |
| C17 | N2 | C1 | N3 | 179.8° | 179.8° |
| N1 | C3 | N5 | C2 | 178.6° | 180.0° |
| N1 | C3 | C2 | C1 | 1.5° | 0.0° |
| N1 | C3 | C2 | N4 | 179.8° | 180.0° |
| C3 | N1 | C17 | H25 | 179.1° | 180.0° |
| N1 | C3 | N5 | H26 | 0.0° | 179.9° |
| N1 | C3 | N5 | H27 | 120.0° | 0.0° |
| N2 | C1 | C2 | C3 | 3.0° | 0.2° |
| N2 | C1 | C2 | N3 | 177.0° | 179.8° |
| N2 | C1 | C2 | N4 | 178.0° | 179.8° |
| N2 | C1 | N3 | C16 | 7.9° | 0.2° |
| N2 | C1 | N3 | C4 | 179.6° | 179.7° |
| C1 | N2 | C17 | H25 | 177.8° | 179.8° |
| N5 | C3 | C2 | C1 | 177.1° | 180.0° |
| N5 | C3 | C2 | N4 | 1.6° | 0.0° |
| C3 | N5 | H26 | H27 | 120.0° | 180.0° |
| C3 | C2 | C1 | N4 | 179.0° | 180.0° |
| C3 | C2 | C1 | N3 | 180.0° | 180.0° |
| C3 | C2 | N4 | C4 | 177.7° | 180.0° |
| C2 | C3 | N5 | H26 | 178.6° | 0.0° |
| C2 | C3 | N5 | H27 | 58.6° | 180.0° |
| C2 | C1 | N3 | C16 | 175.3° | 180.0° |
| C2 | C1 | N3 | C4 | 2.7° | 0.1° |
| C1 | C2 | N4 | C4 | 1.2° | 0.0° |
| N3 | C1 | C2 | N4 | 0.9° | 0.0° |
| C1 | N3 | C16 | O12 | 100.5° | 156.4° |
| C1 | N3 | C16 | C4 | 171.0° | 179.9° |
| C1 | N3 | C16 | C15 | 146.9° | 88.2° |
| C1 | N3 | C4 | N4 | 3.4° | 0.1° |
| C1 | N3 | C4 | H1 | 176.6° | 180.0° |
| C1 | N3 | C16 | H24 | 17.9° | 34.2° |
| C2 | N4 | C4 | N3 | 2.9° | 0.0° |
| C2 | N4 | C4 | H1 | 177.1° | 180.0° |
| O12 | C16 | N3 | C15 | 112.7° | 115.4° |
| O12 | C16 | N3 | H24 | 118.3° | 122.2° |
| O12 | C16 | C15 | H24 | 119.3° | 118.9° |
| O12 | C16 | N3 | C4 | 70.5° | 23.5° |
| C16 | O12 | C13 | C14 | 17.6° | 40.4° |
| C16 | O12 | C13 | C12 | 140.0° | 159.3° |
| O12 | C16 | C15 | O14 | 153.5° | 142.7° |
| O12 | C16 | C15 | C14 | 34.9° | 24.0° |
| C16 | O12 | C13 | H19 | 98.4° | 78.4° |
| O12 | C16 | C15 | H22 | 84.0° | 94.7° |
| C13 | O12 | C16 | N3 | 157.3° | 159.3° |
| C13 | O12 | C16 | C15 | 33.4° | 40.5° |
| O12 | C13 | C14 | C12 | 120.9° | 118.9° |
| O12 | C13 | C14 | H19 | 117.4° | 118.9° |
| O12 | C13 | C12 | H19 | 122.0° | 122.3° |
| O12 | C13 | C14 | O13 | 114.9° | 142.6° |
| O12 | C13 | C14 | C15 | 5.3° | 23.9° |
| O12 | C13 | C12 | O11 | 179.9° | 69.6° |
| O12 | C13 | C12 | H17 | 59.9° | 50.4° |
| O12 | C13 | C12 | H18 | 60.2° | 170.4° |
| O12 | C13 | C14 | H20 | 123.3° | 94.7° |
| C13 | O12 | C16 | H24 | 84.9° | 78.5° |
| N3 | C16 | C15 | H24 | 129.4° | 122.3° |
| C16 | N3 | C4 | N4 | 175.6° | 180.0° |
| N3 | C16 | C15 | O14 | 95.2° | 98.5° |
| N3 | C16 | C15 | C14 | 146.3° | 142.8° |
| C16 | N3 | C4 | H1 | 4.4° | 0.1° |
| N3 | C16 | C15 | H22 | 27.3° | 24.1° |
| C15 | C16 | N3 | C4 | 42.2° | 91.9° |
| C16 | C15 | C14 | C13 | 24.2° | 0.1° |
| C16 | C15 | C14 | O13 | 92.8° | 118.6° |
| C16 | C15 | O14 | C14 | 113.3° | 114.7° |
| C16 | C15 | O14 | H22 | 121.2° | 122.7° |
| C16 | C15 | C14 | H22 | 119.0° | 118.7° |
| C16 | C15 | C14 | H20 | 141.4° | 118.7° |
| C16 | C15 | O14 | H23 | 180.0° | 176.1° |
| O6 | P1 | O7 | O5 | 126.8° | 120.0° |
| O6 | P1 | O7 | O8 | 125.0° | 120.0° |
| O6 | P1 | O5 | O8 | 116.3° | 120.0° |
| O6 | P1 | O5 | C11 | 63.3° | 55.0° |
| O6 | P1 | O8 | P2 | 24.9° | 45.0° |
| O6 | P1 | O7 | H15 | 0.0° | 180.0° |
| N3 | C4 | N4 | H1 | 180.0° | 179.9° |
| C4 | N3 | C16 | H24 | 171.2° | 145.7° |
| C14 | C13 | C12 | H19 | 121.0° | 122.3° |
| C13 | C14 | O13 | C15 | 114.2° | 114.7° |
| C13 | C14 | O13 | H20 | 120.6° | 122.7° |
| C13 | C14 | C15 | O14 | 138.5° | 118.8° |
| C13 | C14 | C15 | H20 | 117.3° | 118.6° |
| C14 | C13 | C12 | O11 | 62.8° | 175.0° |
| C14 | C13 | C12 | H17 | 57.1° | 65.0° |
| C14 | C13 | C12 | H18 | 177.2° | 55.0° |
| C13 | C14 | O13 | H21 | 180.0° | 180.0° |
| C13 | C14 | C15 | H22 | 94.9° | 118.7° |
| C12 | C13 | C14 | O13 | 124.2° | 98.5° |
| C12 | C13 | C14 | C15 | 115.6° | 142.8° |
| C13 | C12 | O11 | H17 | 120.0° | 120.0° |
| C13 | C12 | O11 | H18 | 120.0° | 120.0° |
| C13 | C12 | O11 | P2 | 162.4° | 180.0° |
| C13 | C12 | H17 | H18 | 120.1° | 120.0° |
| C12 | C13 | C14 | H20 | 2.4° | 24.2° |
| O13 | C14 | C15 | O14 | 21.5° | 0.1° |
| O13 | C14 | C15 | H20 | 125.8° | 122.7° |
| O13 | C14 | C13 | H19 | 2.5° | 23.7° |
| O13 | C14 | C15 | H22 | 148.2° | 122.6° |
| O7 | P1 | O5 | O8 | 113.4° | 120.0° |
| O7 | P1 | O5 | C11 | 67.0° | 65.0° |
| O7 | P1 | O8 | P2 | 153.7° | 75.0° |
| O14 | C15 | C14 | H22 | 126.6° | 122.5° |
| O14 | C15 | C14 | H20 | 104.2° | 122.6° |
| O14 | C15 | C16 | H24 | 34.2° | 23.8° |
| P1 | O5 | C11 | C10 | 142.6° | 180.0° |
| O5 | P1 | O8 | P2 | 91.7° | 165.0° |
| P1 | O5 | C11 | H13 | 22.6° | 60.0° |
| P1 | O5 | C11 | H14 | 97.3° | 60.0° |
| O5 | P1 | O7 | H15 | 126.8° | 60.0° |
| O8 | P1 | O5 | C11 | 179.7° | 175.0° |
| P1 | O8 | P2 | O11 | 76.3° | 165.0° |
| P1 | O8 | P2 | O9 | 39.6° | 45.0° |
| P1 | O8 | P2 | O10 | 164.4° | 75.0° |
| O8 | P1 | O7 | H15 | 125.0° | 60.0° |
| C15 | C14 | C13 | H19 | 122.7° | 95.0° |
| C15 | C14 | O13 | H21 | 65.8° | 65.3° |
| C14 | C15 | O14 | H23 | 66.7° | 61.4° |
| C14 | C15 | C16 | H24 | 84.4° | 94.9° |
| C12 | O11 | P2 | O8 | 65.7° | 175.0° |
| C12 | O11 | P2 | O9 | 177.5° | 55.0° |
| C12 | O11 | P2 | O10 | 43.1° | 65.0° |
| O11 | C12 | H17 | H18 | 120.1° | 119.9° |
| O11 | C12 | C13 | H19 | 58.2° | 52.7° |
| O5 | C11 | C10 | H13 | 120.1° | 120.0° |
| O5 | C11 | C10 | H14 | 120.1° | 120.0° |
| O5 | C11 | C10 | C8 | 60.1° | 175.0° |
| O5 | C11 | C10 | O4 | 65.6° | 69.3° |
| O5 | C11 | C10 | H12 | 179.4° | 52.9° |
| O5 | C11 | H13 | H14 | 119.9° | 120.0° |
| C11 | C10 | C8 | O2 | 79.4° | 86.7° |
| C11 | C10 | C8 | O4 | 127.2° | 118.9° |
| C11 | C10 | C8 | H12 | 119.2° | 122.2° |
| C11 | C10 | O4 | H12 | 114.9° | 122.2° |
| C11 | C10 | C8 | C7 | 159.1° | 155.4° |
| C11 | C10 | O4 | C9 | 143.7° | 143.3° |
| C11 | C10 | C8 | H8 | 43.8° | 37.4° |
| C10 | C11 | H13 | H14 | 119.8° | 120.0° |
| O11 | P2 | O8 | O9 | 115.9° | 120.0° |
| O11 | P2 | O8 | O10 | 119.3° | 120.1° |
| O11 | P2 | O9 | O10 | 137.0° | 120.0° |
| O11 | P2 | O10 | H16 | 135.1° | 60.0° |
| P2 | O11 | C12 | H17 | 42.4° | 60.0° |
| P2 | O11 | C12 | H18 | 77.7° | 60.0° |
| O2 | C8 | C10 | C7 | 121.6° | 118.0° |
| O2 | C8 | C10 | H8 | 123.1° | 124.1° |
| O2 | C8 | C10 | O4 | 153.4° | 154.4° |
| O2 | C8 | C7 | H8 | 127.1° | 124.1° |
| O2 | C8 | C7 | O1 | 47.5° | 33.9° |
| O2 | C8 | C7 | C9 | 157.3° | 152.1° |
| O2 | C8 | C7 | H7 | 81.6° | 89.6° |
| O2 | C8 | C10 | H12 | 39.8° | 35.5° |
| O8 | P2 | O9 | O10 | 110.9° | 120.0° |
| O8 | P2 | O10 | H16 | 113.2° | 60.1° |
| C8 | C10 | O4 | H12 | 113.8° | 118.9° |
| C10 | C8 | C7 | H8 | 115.8° | 117.9° |
| C8 | C10 | O4 | C9 | 12.4° | 24.4° |
| C10 | C8 | C7 | O1 | 69.7° | 84.1° |
| C10 | C8 | C7 | C9 | 40.2° | 34.1° |
| C10 | C8 | C7 | H7 | 161.3° | 152.4° |
| C10 | C8 | O2 | H9 | 180.0° | 173.0° |
| C8 | C10 | C11 | H13 | 60.0° | 55.0° |
| C8 | C10 | C11 | H14 | 179.8° | 65.0° |
| O4 | C10 | C8 | C7 | 31.9° | 36.4° |
| C10 | O4 | C9 | C7 | 13.0° | 1.7° |
| C10 | O4 | C9 | O3 | 139.6° | 117.8° |
| O4 | C10 | C8 | H8 | 83.4° | 81.5° |
| C10 | O4 | C9 | H10 | 100.3° | 121.3° |
| O4 | C10 | C11 | H13 | 174.3° | 170.7° |
| O4 | C10 | C11 | H14 | 54.5° | 50.7° |
| O9 | P2 | O10 | H16 | 0.0° | 179.9° |
| C8 | C7 | C9 | O4 | 33.9° | 21.4° |
| C8 | C7 | O1 | C6 | 94.7° | 155.7° |
| C8 | C7 | O1 | C9 | 112.8° | 112.8° |
| C8 | C7 | O1 | H7 | 127.8° | 123.7° |
| C8 | C7 | C9 | H7 | 121.5° | 118.4° |
| C8 | C7 | C9 | O3 | 158.1° | 140.9° |
| C7 | C8 | O2 | H9 | 69.8° | 61.4° |
| C8 | C7 | C9 | H10 | 80.9° | 98.3° |
| C7 | C8 | C10 | H12 | 81.7° | 82.5° |
| C5 | C6 | S1 | O1 | 171.8° | 179.9° |
| C5 | C6 | O1 | C7 | 175.1° | 180.0° |
| C6 | C5 | H2 | H3 | 120.0° | 120.0° |
| C6 | C5 | H2 | H4 | 120.0° | 120.1° |
| C6 | C5 | H3 | H4 | 120.0° | 120.0° |
| O4 | C9 | C7 | O1 | 83.1° | 96.8° |
| O4 | C9 | C7 | O3 | 124.3° | 119.5° |
| O4 | C9 | C7 | H10 | 114.8° | 119.6° |
| O4 | C9 | O3 | H10 | 121.4° | 121.0° |
| O4 | C9 | C7 | H7 | 155.4° | 139.8° |
| O4 | C9 | O3 | H11 | 180.0° | 61.8° |
| C9 | O4 | C10 | H12 | 101.3° | 94.5° |
| S1 | C6 | O1 | C7 | 2.4° | 0.0° |
| S1 | C6 | C5 | H2 | 0.0° | 0.0° |
| S1 | C6 | C5 | H3 | 120.0° | 120.1° |
| S1 | C6 | C5 | H4 | 120.0° | 120.0° |
| C6 | O1 | C7 | C9 | 152.5° | 91.5° |
| O1 | C6 | C5 | H2 | 172.7° | 180.0° |
| O1 | C6 | C5 | H3 | 52.7° | 60.0° |
| O1 | C6 | C5 | H4 | 67.3° | 59.9° |
| C6 | O1 | C7 | H7 | 33.1° | 32.0° |
| O1 | C7 | C9 | H7 | 121.5° | 123.4° |
| O1 | C7 | C9 | O3 | 41.2° | 22.7° |
| O1 | C7 | C8 | H8 | 174.5° | 158.0° |
| O1 | C7 | C9 | H10 | 162.2° | 143.5° |
| C7 | C9 | O3 | H10 | 121.1° | 120.9° |
| C9 | C7 | C8 | H8 | 75.6° | 83.8° |
| C7 | C9 | O3 | H11 | 62.5° | 180.0° |
| O3 | C9 | C7 | H7 | 80.3° | 100.8° |
| H2 | C5 | H3 | H4 | 120.0° | 120.0° |
| H7 | C7 | C8 | H8 | 45.5° | 34.5° |
| H7 | C7 | C9 | H10 | 40.6° | 20.1° |
| H8 | C8 | O2 | H9 | 56.9° | 62.8° |
| H8 | C8 | C10 | H12 | 163.0° | 159.6° |
| H10 | C9 | O3 | H11 | 58.6° | 59.1° |
| H12 | C10 | C11 | H13 | 59.4° | 67.1° |
| H12 | C10 | C11 | H14 | 60.5° | 172.9° |
| H17 | C12 | C13 | H19 | 178.1° | 172.7° |
| H18 | C12 | C13 | H19 | 61.8° | 67.3° |
| H19 | C13 | C14 | H20 | 119.4° | 146.4° |
| H20 | C14 | O13 | H21 | 59.4° | 57.3° |
| H20 | C14 | C15 | H22 | 22.4° | 0.0° |
| H22 | C15 | O14 | H23 | 58.8° | 61.2° |
| H22 | C15 | C16 | H24 | 156.6° | 146.4° |
