DB4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C17 | sing | 1.53Å | 1.50Å | |
| C16 | C15 | sing | 1.53Å | 1.51Å | |
| C15 | C14 | sing | 1.51Å | 1.50Å | |
| C14 | O10 | doub | 1.21Å | 1.20Å | |
| C14 | O9 | sing | 1.34Å | 1.41Å | |
| O9 | C9 | sing | 1.45Å | 1.41Å | |
| C9 | C8 | sing | 1.53Å | 1.51Å | |
| O8 | C10 | doub | 1.21Å | 1.23Å | |
| C8 | O7 | sing | 1.45Å | 1.44Å | |
| C8 | C7 | sing | 1.53Å | 1.51Å | |
| C10 | O7 | sing | 1.34Å | 1.46Å | |
| C10 | C11 | sing | 1.51Å | 1.51Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C7 | O13 | sing | 1.43Å | 1.42Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| O13 | P1 | sing | 1.61Å | 1.59Å | |
| O6 | C6 | sing | 1.43Å | 1.43Å | |
| O5 | C5 | sing | 1.43Å | 1.44Å | |
| P1 | O11 | doub | 1.48Å | 1.51Å | |
| P1 | O1 | sing | 1.61Å | 1.62Å | |
| P1 | O12 | sing | 1.61Å | 1.49Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C5 | C4 | sing | 1.53Å | 1.50Å | |
| C6 | C1 | sing | 1.53Å | 1.54Å | |
| C1 | O1 | sing | 1.43Å | 1.43Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| O4 | C4 | sing | 1.43Å | 1.42Å | |
| O4 | P4 | sing | 1.61Å | 1.64Å | |
| C4 | C3 | sing | 1.53Å | 1.54Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C3 | O3 | sing | 1.43Å | 1.43Å | |
| C2 | O2 | sing | 1.43Å | 1.44Å | |
| O42 | P4 | doub | 1.48Å | 1.52Å | |
| P4 | O43 | sing | 1.61Å | 1.50Å | |
| P4 | O41 | sing | 1.61Å | 1.49Å | |
| C15 | H1 | sing | 1.09Å | 1.10Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C16 | H3 | sing | 1.09Å | 1.10Å | |
| C16 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C7 | H18 | sing | 1.09Å | 1.10Å | |
| C7 | H19 | sing | 1.09Å | 1.10Å | |
| O12 | H20 | sing | 0.97Å | 0.95Å | |
| C1 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| O2 | H23 | sing | 0.97Å | 0.95Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| O3 | H25 | sing | 0.97Å | 0.95Å | |
| C4 | H26 | sing | 1.09Å | 1.10Å | |
| O43 | H27 | sing | 0.97Å | 0.95Å | |
| O41 | H28 | sing | 0.97Å | 0.95Å | |
| C5 | H29 | sing | 1.09Å | 1.10Å | |
| O5 | H30 | sing | 0.97Å | 0.95Å | |
| C6 | H31 | sing | 1.09Å | 1.10Å | |
| O6 | H32 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | C15 | 110.8° | 109.5° |
| C17 | C16 | H3 | 109.1° | 109.5° |
| C17 | C16 | H4 | 109.1° | 109.5° |
| C16 | C17 | H5 | 109.5° | 109.5° |
| C16 | C17 | H6 | 109.5° | 109.5° |
| C16 | C17 | H7 | 109.5° | 109.5° |
| C16 | C15 | C14 | 109.4° | 109.5° |
| C16 | C15 | H1 | 109.5° | 109.5° |
| C16 | C15 | H2 | 109.5° | 109.5° |
| C15 | C16 | H3 | 109.1° | 109.5° |
| C15 | C16 | H4 | 109.1° | 109.5° |
| C15 | C14 | O10 | 122.5° | 120.0° |
| C15 | C14 | O9 | 120.0° | 120.0° |
| C14 | C15 | H1 | 109.5° | 109.5° |
| C14 | C15 | H2 | 109.5° | 109.5° |
| O10 | C14 | O9 | 117.4° | 120.0° |
| C14 | O9 | C9 | 120.2° | 116.9° |
| O9 | C9 | C8 | 107.8° | 109.4° |
| O9 | C9 | H8 | 109.9° | 109.5° |
| O9 | C9 | H9 | 109.9° | 109.5° |
| C9 | C8 | O7 | 108.9° | 109.5° |
| C9 | C8 | C7 | 108.5° | 109.5° |
| C8 | C9 | H8 | 109.9° | 109.5° |
| C8 | C9 | H9 | 109.9° | 109.5° |
| C9 | C8 | H10 | 109.7° | 109.5° |
| O8 | C10 | O7 | 121.3° | 120.0° |
| O8 | C10 | C11 | 120.2° | 120.0° |
| O7 | C8 | C7 | 109.1° | 109.5° |
| C8 | O7 | C10 | 119.3° | 117.0° |
| O7 | C8 | H10 | 110.8° | 109.5° |
| C8 | C7 | O13 | 110.0° | 109.5° |
| C7 | C8 | H10 | 109.8° | 109.5° |
| C8 | C7 | H18 | 109.3° | 109.5° |
| C8 | C7 | H19 | 109.3° | 109.5° |
| O7 | C10 | C11 | 118.5° | 120.0° |
| C10 | C11 | C12 | 109.9° | 109.5° |
| C10 | C11 | H11 | 109.4° | 109.5° |
| C10 | C11 | H12 | 109.4° | 109.5° |
| C11 | C12 | C13 | 112.3° | 109.5° |
| C12 | C11 | H11 | 109.4° | 109.4° |
| C12 | C11 | H12 | 109.4° | 109.4° |
| C11 | C12 | H13 | 108.8° | 109.5° |
| C11 | C12 | H14 | 108.8° | 109.5° |
| C7 | O13 | P1 | 123.0° | 123.1° |
| O13 | C7 | H18 | 109.3° | 109.5° |
| O13 | C7 | H19 | 109.3° | 109.5° |
| C13 | C12 | H13 | 108.8° | 109.4° |
| C13 | C12 | H14 | 108.8° | 109.5° |
| C12 | C13 | H15 | 109.5° | 109.5° |
| C12 | C13 | H16 | 109.5° | 109.5° |
| C12 | C13 | H17 | 109.5° | 109.5° |
| O13 | P1 | O11 | 112.6° | 109.5° |
| O13 | P1 | O1 | 102.4° | 109.5° |
| O13 | P1 | O12 | 108.5° | 109.4° |
| O6 | C6 | C5 | 106.4° | 109.5° |
| O6 | C6 | C1 | 111.7° | 109.5° |
| O6 | C6 | H31 | 109.6° | 109.5° |
| C6 | O6 | H32 | 109.5° | 114.0° |
| O5 | C5 | C6 | 105.8° | 109.5° |
| O5 | C5 | C4 | 111.7° | 109.5° |
| O5 | C5 | H29 | 110.3° | 109.5° |
| C5 | O5 | H30 | 109.5° | 114.0° |
| O11 | P1 | O1 | 102.3° | 109.5° |
| O11 | P1 | O12 | 120.8° | 109.5° |
| O1 | P1 | O12 | 108.5° | 109.5° |
| P1 | O1 | C1 | 119.3° | 123.0° |
| P1 | O12 | H20 | 109.5° | 114.0° |
| C6 | C5 | C4 | 110.2° | 109.4° |
| C5 | C6 | C1 | 112.5° | 109.5° |
| C6 | C5 | H29 | 109.3° | 109.4° |
| C5 | C6 | H31 | 108.4° | 109.5° |
| C5 | C4 | O4 | 110.7° | 109.4° |
| C5 | C4 | C3 | 111.0° | 109.5° |
| C5 | C4 | H26 | 108.0° | 109.5° |
| C4 | C5 | H29 | 109.5° | 109.5° |
| C6 | C1 | O1 | 109.2° | 109.5° |
| C6 | C1 | C2 | 110.0° | 109.4° |
| C6 | C1 | H21 | 107.8° | 109.4° |
| C1 | C6 | H31 | 108.1° | 109.5° |
| O1 | C1 | C2 | 112.4° | 109.5° |
| O1 | C1 | H21 | 109.3° | 109.5° |
| C1 | C2 | C3 | 109.3° | 109.5° |
| C1 | C2 | O2 | 109.2° | 109.5° |
| C2 | C1 | H21 | 108.0° | 109.5° |
| C1 | C2 | H22 | 108.2° | 109.4° |
| C4 | O4 | P4 | 118.5° | 123.0° |
| O4 | C4 | C3 | 110.3° | 109.5° |
| O4 | C4 | H26 | 109.1° | 109.5° |
| O4 | P4 | O42 | 101.9° | 109.5° |
| O4 | P4 | O43 | 106.6° | 109.5° |
| O4 | P4 | O41 | 106.5° | 109.5° |
| C4 | C3 | C2 | 109.7° | 109.5° |
| C4 | C3 | O3 | 111.4° | 109.5° |
| C4 | C3 | H24 | 108.4° | 109.4° |
| C3 | C4 | H26 | 107.6° | 109.5° |
| C2 | C3 | O3 | 108.9° | 109.5° |
| C3 | C2 | O2 | 112.7° | 109.5° |
| C3 | C2 | H22 | 108.1° | 109.5° |
| C2 | C3 | H24 | 108.5° | 109.5° |
| O3 | C3 | H24 | 109.8° | 109.5° |
| C3 | O3 | H25 | 109.5° | 114.0° |
| O2 | C2 | H22 | 109.3° | 109.5° |
| C2 | O2 | H23 | 109.5° | 114.0° |
| O42 | P4 | O43 | 114.3° | 109.5° |
| O42 | P4 | O41 | 113.8° | 109.4° |
| O43 | P4 | O41 | 112.6° | 109.5° |
| P4 | O43 | H27 | 109.5° | 114.0° |
| P4 | O41 | H28 | 109.5° | 113.9° |
| H1 | C15 | H2 | 109.4° | 109.5° |
| H3 | C16 | H4 | 109.5° | 109.5° |
| H5 | C17 | H6 | 109.5° | 109.5° |
| H5 | C17 | H7 | 109.5° | 109.4° |
| H6 | C17 | H7 | 109.4° | 109.5° |
| H8 | C9 | H9 | 109.5° | 109.5° |
| H11 | C11 | H12 | 109.4° | 109.5° |
| H13 | C12 | H14 | 109.4° | 109.5° |
| H15 | C13 | H16 | 109.5° | 109.5° |
| H15 | C13 | H17 | 109.5° | 109.5° |
| H16 | C13 | H17 | 109.5° | 109.4° |
| H18 | C7 | H19 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | C15 | H3 | 120.2° | 120.0° |
| C17 | C16 | C15 | H4 | 120.2° | 120.0° |
| C17 | C16 | C15 | C14 | 71.7° | 180.0° |
| C17 | C16 | C15 | H1 | 168.3° | 60.0° |
| C17 | C16 | C15 | H2 | 48.3° | 60.0° |
| C17 | C16 | H3 | H4 | 119.4° | 120.0° |
| C16 | C17 | H5 | H6 | 120.0° | 120.0° |
| C16 | C17 | H5 | H7 | 120.0° | 120.0° |
| C16 | C17 | H6 | H7 | 120.0° | 120.0° |
| C16 | C15 | C14 | H1 | 120.0° | 120.0° |
| C16 | C15 | C14 | H2 | 120.0° | 120.0° |
| C16 | C15 | C14 | O10 | 43.4° | 0.0° |
| C16 | C15 | C14 | O9 | 137.3° | 179.7° |
| C16 | C15 | H1 | H2 | 120.0° | 120.0° |
| C15 | C16 | H3 | H4 | 119.4° | 120.0° |
| C15 | C16 | C17 | H5 | 180.0° | 180.0° |
| C15 | C16 | C17 | H6 | 60.0° | 60.0° |
| C15 | C16 | C17 | H7 | 60.0° | 60.0° |
| C15 | C14 | O10 | O9 | 179.3° | 179.7° |
| C15 | C14 | O9 | C9 | 172.9° | 179.7° |
| C14 | C15 | H1 | H2 | 120.0° | 120.0° |
| C14 | C15 | C16 | H3 | 48.5° | 60.0° |
| C14 | C15 | C16 | H4 | 168.1° | 60.0° |
| O10 | C14 | O9 | C9 | 6.4° | 0.0° |
| O10 | C14 | C15 | H1 | 76.6° | 120.0° |
| O10 | C14 | C15 | H2 | 163.4° | 120.0° |
| C14 | O9 | C9 | C8 | 134.9° | 180.0° |
| O9 | C14 | C15 | H1 | 102.7° | 59.7° |
| O9 | C14 | C15 | H2 | 17.3° | 60.3° |
| C14 | O9 | C9 | H8 | 105.4° | 60.0° |
| C14 | O9 | C9 | H9 | 15.1° | 60.0° |
| O9 | C9 | C8 | H8 | 119.8° | 120.0° |
| O9 | C9 | C8 | H9 | 119.8° | 120.0° |
| O9 | C9 | C8 | O7 | 56.2° | 65.0° |
| O9 | C9 | C8 | C7 | 174.9° | 175.0° |
| O9 | C9 | H8 | H9 | 120.8° | 120.1° |
| O9 | C9 | C8 | H10 | 65.2° | 55.0° |
| C9 | C8 | O7 | C7 | 118.3° | 120.0° |
| C9 | C8 | O7 | H10 | 120.8° | 120.0° |
| C9 | C8 | C7 | H10 | 119.9° | 120.0° |
| C9 | C8 | O7 | C10 | 146.4° | 90.1° |
| C9 | C8 | C7 | O13 | 57.9° | 175.0° |
| C8 | C9 | H8 | H9 | 120.7° | 120.0° |
| C9 | C8 | C7 | H18 | 62.2° | 65.0° |
| C9 | C8 | C7 | H19 | 177.9° | 55.0° |
| O8 | C10 | O7 | C8 | 5.1° | 0.0° |
| O8 | C10 | O7 | C11 | 179.7° | 180.0° |
| O8 | C10 | C11 | C12 | 46.5° | 0.0° |
| O8 | C10 | C11 | H11 | 73.6° | 120.0° |
| O8 | C10 | C11 | H12 | 166.6° | 119.9° |
| O7 | C8 | C7 | H10 | 121.6° | 120.0° |
| C8 | O7 | C10 | C11 | 175.2° | 180.0° |
| O7 | C8 | C7 | O13 | 60.7° | 65.0° |
| O7 | C8 | C9 | H8 | 63.5° | 55.0° |
| O7 | C8 | C9 | H9 | 176.0° | 175.0° |
| O7 | C8 | C7 | H18 | 179.3° | 55.0° |
| O7 | C8 | C7 | H19 | 59.4° | 175.0° |
| C7 | C8 | O7 | C10 | 95.3° | 150.0° |
| C8 | C7 | O13 | H18 | 120.1° | 120.0° |
| C8 | C7 | O13 | H19 | 120.1° | 120.1° |
| C8 | C7 | O13 | P1 | 137.2° | 180.0° |
| C7 | C8 | C9 | H8 | 55.1° | 65.0° |
| C7 | C8 | C9 | H9 | 65.4° | 55.0° |
| C8 | C7 | H18 | H19 | 119.7° | 120.0° |
| O7 | C10 | C11 | C12 | 133.2° | 180.0° |
| C10 | O7 | C8 | H10 | 25.6° | 30.0° |
| O7 | C10 | C11 | H11 | 106.7° | 60.0° |
| O7 | C10 | C11 | H12 | 13.1° | 60.1° |
| C10 | C11 | C12 | H11 | 120.1° | 120.0° |
| C10 | C11 | C12 | H12 | 120.1° | 120.0° |
| C10 | C11 | C12 | C13 | 174.3° | 180.0° |
| C10 | C11 | H11 | H12 | 119.8° | 120.1° |
| C10 | C11 | C12 | H13 | 53.9° | 60.0° |
| C10 | C11 | C12 | H14 | 65.2° | 60.0° |
| C11 | C12 | C13 | H13 | 120.4° | 120.0° |
| C11 | C12 | C13 | H14 | 120.4° | 120.0° |
| C12 | C11 | H11 | H12 | 119.8° | 120.0° |
| C11 | C12 | H13 | H14 | 118.7° | 120.0° |
| C11 | C12 | C13 | H15 | 180.0° | 60.0° |
| C11 | C12 | C13 | H16 | 60.0° | 60.0° |
| C11 | C12 | C13 | H17 | 60.0° | 180.0° |
| C7 | O13 | P1 | O11 | 49.3° | 55.0° |
| C7 | O13 | P1 | O1 | 59.8° | 175.0° |
| C7 | O13 | P1 | O12 | 174.4° | 65.0° |
| O13 | C7 | C8 | H10 | 177.8° | 55.0° |
| O13 | C7 | H18 | H19 | 119.7° | 119.9° |
| C13 | C12 | C11 | H11 | 65.6° | 60.0° |
| C13 | C12 | C11 | H12 | 54.3° | 60.0° |
| C13 | C12 | H13 | H14 | 118.7° | 120.0° |
| C12 | C13 | H15 | H16 | 120.0° | 120.0° |
| C12 | C13 | H15 | H17 | 120.0° | 120.0° |
| C12 | C13 | H16 | H17 | 120.0° | 120.0° |
| O13 | P1 | O11 | O1 | 109.2° | 120.0° |
| O13 | P1 | O11 | O12 | 130.3° | 119.9° |
| O13 | P1 | O1 | O12 | 114.6° | 120.0° |
| O13 | P1 | O1 | C1 | 64.4° | 175.0° |
| P1 | O13 | C7 | H18 | 102.8° | 59.9° |
| P1 | O13 | C7 | H19 | 17.1° | 60.0° |
| O13 | P1 | O12 | H20 | 132.1° | 60.1° |
| O6 | C6 | C5 | O5 | 61.3° | 60.0° |
| O6 | C6 | C5 | C1 | 122.7° | 120.0° |
| O6 | C6 | C5 | H31 | 117.8° | 120.0° |
| O6 | C6 | C5 | C4 | 177.8° | 180.0° |
| O6 | C6 | C1 | H31 | 120.6° | 120.0° |
| O6 | C6 | C1 | O1 | 60.5° | 60.0° |
| O6 | C6 | C1 | C2 | 175.7° | 180.0° |
| O6 | C6 | C1 | H21 | 58.1° | 60.0° |
| O6 | C6 | C5 | H29 | 57.5° | 60.0° |
| O5 | C5 | C6 | C4 | 120.9° | 120.0° |
| O5 | C5 | C6 | H29 | 118.8° | 120.0° |
| O5 | C5 | C4 | H29 | 122.5° | 120.1° |
| O5 | C5 | C6 | C1 | 176.0° | 180.0° |
| O5 | C5 | C4 | O4 | 63.4° | 60.0° |
| O5 | C5 | C4 | C3 | 173.8° | 180.0° |
| O5 | C5 | C4 | H26 | 56.1° | 60.0° |
| O5 | C5 | C6 | H31 | 56.5° | 60.0° |
| O11 | P1 | O1 | O12 | 128.7° | 120.0° |
| O11 | P1 | O1 | C1 | 178.9° | 55.0° |
| O11 | P1 | O12 | H20 | 0.0° | 180.0° |
| P1 | O1 | C1 | C6 | 145.1° | 120.0° |
| P1 | O1 | C1 | C2 | 92.5° | 120.0° |
| O1 | P1 | O12 | H20 | 117.4° | 59.9° |
| P1 | O1 | C1 | H21 | 27.4° | 0.0° |
| O12 | P1 | O1 | C1 | 50.2° | 65.0° |
| C6 | C5 | C4 | H29 | 120.2° | 119.9° |
| C5 | C6 | C1 | H31 | 119.7° | 120.0° |
| C5 | C6 | C1 | O1 | 179.9° | 180.0° |
| C5 | C6 | C1 | C2 | 56.1° | 60.0° |
| C6 | C5 | C4 | O4 | 179.4° | 180.0° |
| C6 | C5 | C4 | C3 | 56.5° | 60.0° |
| C5 | C6 | C1 | H21 | 61.5° | 60.0° |
| C6 | C5 | C4 | H26 | 61.2° | 60.0° |
| C6 | C5 | O5 | H30 | 180.0° | 60.0° |
| C5 | C6 | O6 | H32 | 180.0° | 60.0° |
| C4 | C5 | C6 | C1 | 55.1° | 60.0° |
| C5 | C4 | O4 | C3 | 123.3° | 120.0° |
| C5 | C4 | O4 | H26 | 118.8° | 120.0° |
| C5 | C4 | O4 | P4 | 135.2° | 120.0° |
| C5 | C4 | C3 | H26 | 118.0° | 120.0° |
| C5 | C4 | C3 | C2 | 59.6° | 60.0° |
| C5 | C4 | C3 | O3 | 179.6° | 180.0° |
| C5 | C4 | C3 | H24 | 58.7° | 60.0° |
| C4 | C5 | O5 | H30 | 60.1° | 180.0° |
| C4 | C5 | C6 | H31 | 64.4° | 60.0° |
| C6 | C1 | O1 | C2 | 122.4° | 120.0° |
| C6 | C1 | O1 | H21 | 117.7° | 120.0° |
| C6 | C1 | C2 | H21 | 117.5° | 120.0° |
| C6 | C1 | C2 | C3 | 57.6° | 60.0° |
| C6 | C1 | C2 | O2 | 66.1° | 60.0° |
| C6 | C1 | C2 | H22 | 175.1° | 180.0° |
| C1 | C6 | C5 | H29 | 65.2° | 60.0° |
| C1 | C6 | O6 | H32 | 56.8° | 180.0° |
| O1 | C1 | C2 | H21 | 120.7° | 120.1° |
| O1 | C1 | C2 | C3 | 179.5° | 180.0° |
| O1 | C1 | C2 | O2 | 55.8° | 60.0° |
| O1 | C1 | C2 | H22 | 63.1° | 60.0° |
| O1 | C1 | C6 | H31 | 60.2° | 60.0° |
| C1 | C2 | C3 | C4 | 59.6° | 60.0° |
| C1 | C2 | C3 | O2 | 121.5° | 120.0° |
| C1 | C2 | C3 | H22 | 117.6° | 119.9° |
| C1 | C2 | C3 | O3 | 178.2° | 179.9° |
| C1 | C2 | O2 | H22 | 118.2° | 119.9° |
| C1 | C2 | O2 | H23 | 180.0° | 179.9° |
| C1 | C2 | C3 | H24 | 58.7° | 59.9° |
| C2 | C1 | C6 | H31 | 63.6° | 60.0° |
| O4 | C4 | C3 | H26 | 118.9° | 120.0° |
| O4 | C4 | C3 | C2 | 177.3° | 180.0° |
| O4 | C4 | C3 | O3 | 56.6° | 60.0° |
| C4 | O4 | P4 | O42 | 169.1° | 55.0° |
| C4 | O4 | P4 | O43 | 70.9° | 175.0° |
| C4 | O4 | P4 | O41 | 49.6° | 65.0° |
| O4 | C4 | C3 | H24 | 64.4° | 60.0° |
| O4 | C4 | C5 | H29 | 59.1° | 60.0° |
| P4 | O4 | C4 | C3 | 101.5° | 120.0° |
| O4 | P4 | O42 | O43 | 114.5° | 120.0° |
| O4 | P4 | O42 | O41 | 114.2° | 120.0° |
| O4 | P4 | O43 | O41 | 116.5° | 120.0° |
| P4 | O4 | C4 | H26 | 16.5° | 0.0° |
| O4 | P4 | O43 | H27 | 111.7° | 180.0° |
| O4 | P4 | O41 | H28 | 111.4° | 60.0° |
| C4 | C3 | C2 | O3 | 122.2° | 120.0° |
| C4 | C3 | C2 | H24 | 118.3° | 120.0° |
| C4 | C3 | O3 | H24 | 120.1° | 120.0° |
| C4 | C3 | C2 | O2 | 61.9° | 60.0° |
| C4 | C3 | C2 | H22 | 177.2° | 180.0° |
| C4 | C3 | O3 | H25 | 180.0° | 180.0° |
| C3 | C4 | C5 | H29 | 63.7° | 59.9° |
| C2 | C3 | O3 | H24 | 118.7° | 120.0° |
| C3 | C2 | O2 | H22 | 120.2° | 120.0° |
| C3 | C2 | C1 | H21 | 59.9° | 59.9° |
| C3 | C2 | O2 | H23 | 58.4° | 60.0° |
| C2 | C3 | O3 | H25 | 58.8° | 60.0° |
| C2 | C3 | C4 | H26 | 58.4° | 60.0° |
| O3 | C3 | C2 | O2 | 60.3° | 60.0° |
| O3 | C3 | C2 | H22 | 60.6° | 60.0° |
| O3 | C3 | C4 | H26 | 62.4° | 60.0° |
| O2 | C2 | C1 | H21 | 176.5° | 180.0° |
| O2 | C2 | C3 | H24 | 179.8° | 180.0° |
| O42 | P4 | O43 | O41 | 131.8° | 120.0° |
| O42 | P4 | O43 | H27 | 0.0° | 60.0° |
| O42 | P4 | O41 | H28 | 0.0° | 180.0° |
| O43 | P4 | O41 | H28 | 132.1° | 60.0° |
| O41 | P4 | O43 | H27 | 131.8° | 60.0° |
| H1 | C15 | C16 | H3 | 71.5° | 180.0° |
| H1 | C15 | C16 | H4 | 48.1° | 60.0° |
| H2 | C15 | C16 | H3 | 168.5° | 60.0° |
| H2 | C15 | C16 | H4 | 71.9° | 180.0° |
| H3 | C16 | C17 | H5 | 59.8° | 60.0° |
| H3 | C16 | C17 | H6 | 60.2° | 180.0° |
| H3 | C16 | C17 | H7 | 179.8° | 60.0° |
| H4 | C16 | C17 | H5 | 59.8° | 60.0° |
| H4 | C16 | C17 | H6 | 179.8° | 60.0° |
| H4 | C16 | C17 | H7 | 60.2° | NaN° |
| H5 | C17 | H6 | H7 | 120.0° | 120.0° |
| H8 | C9 | C8 | H10 | 175.0° | 175.0° |
| H9 | C9 | C8 | H10 | 54.6° | 65.0° |
| H10 | C8 | C7 | H18 | 57.7° | 175.0° |
| H10 | C8 | C7 | H19 | 62.2° | 65.0° |
| H11 | C11 | C12 | H13 | 174.0° | 180.0° |
| H11 | C11 | C12 | H14 | 54.9° | 60.0° |
| H12 | C11 | C12 | H13 | 66.2° | 59.9° |
| H12 | C11 | C12 | H14 | 174.7° | 180.0° |
| H13 | C12 | C13 | H15 | 59.6° | 180.0° |
| H13 | C12 | C13 | H16 | 179.6° | 60.0° |
| H13 | C12 | C13 | H17 | 60.4° | 60.0° |
| H14 | C12 | C13 | H15 | 59.6° | 60.0° |
| H14 | C12 | C13 | H16 | 60.4° | NaN° |
| H14 | C12 | C13 | H17 | 179.6° | 60.0° |
| H15 | C13 | H16 | H17 | 120.0° | 120.0° |
| H21 | C1 | C2 | H22 | 57.6° | 60.0° |
| H21 | C1 | C6 | H31 | 178.8° | 180.0° |
| H22 | C2 | O2 | H23 | 61.8° | 60.0° |
| H22 | C2 | C3 | H24 | 58.9° | 60.0° |
| H24 | C3 | O3 | H25 | 59.9° | 60.0° |
| H24 | C3 | C4 | H26 | 176.7° | 180.0° |
| H26 | C4 | C5 | H29 | 178.6° | 180.0° |
| H29 | C5 | O5 | H30 | 61.9° | 60.0° |
| H29 | C5 | C6 | H31 | 175.3° | 180.0° |
| H31 | C6 | O6 | H32 | 62.9° | 60.0° |
