PXW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C23 | sing | 1.56Å | 1.28Å | |
| C24 | C25 | sing | 1.57Å | 1.42Å | |
| C23 | C22 | sing | 1.56Å | 1.40Å | |
| C23 | N27 | sing | 1.50Å | 1.65Å | |
| C22 | C21 | sing | 1.55Å | 1.36Å | |
| C25 | C26 | sing | 1.56Å | 1.31Å | |
| C28 | N27 | doub | 1.30Å | 1.47Å | |
| C28 | N37 | sing | 1.38Å | 1.31Å | |
| N27 | C26 | sing | 1.50Å | 1.60Å | |
| C21 | C26 | sing | 1.56Å | 1.39Å | |
| C21 | N20 | sing | 1.46Å | 1.59Å | |
| N20 | C19 | sing | 1.35Å | 1.47Å | |
| C19 | O38 | doub | 1.22Å | 1.14Å | |
| C19 | C18 | sing | 1.48Å | 1.52Å | |
| C17 | C18 | doub | 1.40Å | 1.36Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.36Å | Aromatic |
| C18 | C02 | sing | 1.40Å | 1.38Å | Aromatic |
| C16 | C04 | doub | 1.39Å | 1.36Å | Aromatic |
| C02 | CL01 | sing | 1.74Å | 1.72Å | |
| C02 | C03 | doub | 1.38Å | 1.36Å | Aromatic |
| C04 | C03 | sing | 1.39Å | 1.36Å | Aromatic |
| C04 | C05 | sing | 1.48Å | 1.38Å | |
| C06 | C05 | doub | 1.39Å | 1.36Å | Aromatic |
| C06 | C07 | sing | 1.38Å | 1.37Å | Aromatic |
| C05 | C15 | sing | 1.39Å | 1.36Å | Aromatic |
| N14 | C13 | trip | 1.14Å | 1.14Å | |
| C07 | C08 | doub | 1.38Å | 1.36Å | Aromatic |
| C15 | C09 | doub | 1.38Å | 1.36Å | Aromatic |
| C13 | C10 | sing | 1.47Å | 1.49Å | |
| C09 | C08 | sing | 1.38Å | 1.34Å | Aromatic |
| C09 | C10 | sing | 1.51Å | 1.48Å | |
| C10 | C12 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.53Å | 1.51Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C15 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.08Å | 1.08Å | |
| C21 | H3 | sing | 1.09Å | 1.10Å | |
| C22 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.09Å | 1.10Å | |
| C24 | H6 | sing | 1.09Å | 1.10Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C26 | H8 | sing | 1.09Å | 1.10Å | |
| C03 | H10 | sing | 1.08Å | 1.08Å | |
| C16 | H11 | sing | 1.08Å | 1.08Å | |
| C23 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.08Å | 1.08Å | |
| C07 | H16 | sing | 1.08Å | 1.08Å | |
| C08 | H17 | sing | 1.08Å | 1.08Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| N20 | H22 | sing | 0.97Å | 1.00Å | |
| N37 | H23 | sing | 0.97Å | 1.00Å | |
| C28 | S1 | sing | 1.76Å | 1.73Å | |
| N37 | H9 | sing | 0.97Å | 1.00Å | |
| S1 | H24 | sing | 1.41Å | 1.30Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C24 | C25 | 108.7° | 103.6° |
| C24 | C23 | C22 | 105.8° | 105.1° |
| C24 | C23 | N27 | 91.4° | 101.1° |
| C23 | C24 | H6 | 109.7° | 110.6° |
| C23 | C24 | H7 | 109.6° | 110.6° |
| C24 | C23 | H12 | 120.5° | 115.6° |
| C24 | C25 | C26 | 108.3° | 102.6° |
| C25 | C24 | H6 | 109.7° | 110.3° |
| C25 | C24 | H7 | 109.7° | 110.7° |
| C24 | C25 | H13 | 109.7° | 110.7° |
| C24 | C25 | H14 | 109.8° | 110.6° |
| C22 | C23 | N27 | 104.5° | 101.0° |
| C23 | C22 | C21 | 107.6° | 103.4° |
| C23 | C22 | H4 | 109.9° | 110.7° |
| C23 | C22 | H5 | 109.9° | 110.8° |
| C22 | C23 | H12 | 117.6° | 115.7° |
| C23 | N27 | C28 | 133.0° | 130.8° |
| C23 | N27 | C26 | 87.1° | 98.3° |
| N27 | C23 | H12 | 113.1° | 116.2° |
| C22 | C21 | C26 | 108.5° | 103.4° |
| C22 | C21 | N20 | 118.3° | 110.6° |
| C22 | C21 | H3 | 110.9° | 110.7° |
| C21 | C22 | H4 | 110.0° | 110.6° |
| C21 | C22 | H5 | 109.9° | 110.6° |
| C25 | C26 | N27 | 88.8° | 101.8° |
| C25 | C26 | C21 | 114.5° | 105.0° |
| C25 | C26 | H8 | 117.9° | 115.6° |
| C26 | C25 | H13 | 109.8° | 111.4° |
| C26 | C25 | H14 | 109.7° | 110.7° |
| N27 | C28 | N37 | 123.9° | 119.9° |
| C28 | N27 | C26 | 115.0° | 130.9° |
| N27 | C28 | S1 | 111.9° | 120.0° |
| C28 | N37 | H23 | 120.0° | 120.0° |
| N37 | C28 | S1 | 122.5° | 120.0° |
| C28 | N37 | H9 | 120.0° | 120.0° |
| N27 | C26 | C21 | 102.2° | 101.1° |
| N27 | C26 | H8 | 112.5° | 115.8° |
| C26 | C21 | N20 | 100.5° | 110.7° |
| C26 | C21 | H3 | 110.5° | 110.6° |
| C21 | C26 | H8 | 116.2° | 115.6° |
| C21 | N20 | C19 | 117.1° | 120.0° |
| N20 | C21 | H3 | 107.7° | 110.6° |
| C21 | N20 | H22 | 121.4° | 120.0° |
| N20 | C19 | O38 | 119.8° | 120.0° |
| N20 | C19 | C18 | 129.2° | 120.0° |
| C19 | N20 | H22 | 121.5° | 119.9° |
| O38 | C19 | C18 | 110.9° | 120.0° |
| C19 | C18 | C17 | 117.3° | 120.0° |
| C19 | C18 | C02 | 124.3° | 120.0° |
| C18 | C17 | C16 | 119.9° | 120.0° |
| C17 | C18 | C02 | 118.1° | 119.9° |
| C18 | C17 | H2 | 120.0° | 120.0° |
| C17 | C16 | C04 | 121.1° | 120.1° |
| C16 | C17 | H2 | 120.1° | 120.0° |
| C17 | C16 | H11 | 119.5° | 119.9° |
| C18 | C02 | CL01 | 122.6° | 120.0° |
| C18 | C02 | C03 | 122.4° | 119.9° |
| C16 | C04 | C03 | 120.1° | 120.1° |
| C16 | C04 | C05 | 119.6° | 120.0° |
| C04 | C16 | H11 | 119.5° | 120.0° |
| CL01 | C02 | C03 | 114.9° | 120.1° |
| C02 | C03 | C04 | 118.2° | 120.0° |
| C02 | C03 | H10 | 120.9° | 120.0° |
| C03 | C04 | C05 | 120.2° | 120.0° |
| C04 | C03 | H10 | 120.9° | 120.0° |
| C04 | C05 | C06 | 119.1° | 120.1° |
| C04 | C05 | C15 | 122.9° | 120.1° |
| C05 | C06 | C07 | 122.0° | 119.9° |
| C06 | C05 | C15 | 117.9° | 119.7° |
| C05 | C06 | H15 | 119.0° | 120.1° |
| C06 | C07 | C08 | 119.8° | 120.1° |
| C07 | C06 | H15 | 119.0° | 120.1° |
| C06 | C07 | H16 | 120.1° | 119.9° |
| C05 | C15 | C09 | 119.4° | 119.9° |
| C05 | C15 | H1 | 120.3° | 120.0° |
| N14 | C13 | C10 | 179.5° | 180.0° |
| C07 | C08 | C09 | 117.5° | 120.3° |
| C08 | C07 | H16 | 120.1° | 120.0° |
| C07 | C08 | H17 | 121.3° | 119.9° |
| C15 | C09 | C08 | 123.4° | 120.1° |
| C15 | C09 | C10 | 116.1° | 120.0° |
| C09 | C15 | H1 | 120.3° | 120.1° |
| C13 | C10 | C09 | 109.4° | 115.5° |
| C13 | C10 | C12 | 113.9° | 117.5° |
| C13 | C10 | C11 | 112.3° | 117.5° |
| C08 | C09 | C10 | 120.5° | 119.9° |
| C09 | C08 | H17 | 121.2° | 119.9° |
| C09 | C10 | C12 | 116.5° | 117.5° |
| C09 | C10 | C11 | 134.6° | 117.5° |
| C12 | C10 | C11 | 60.1° | 60.0° |
| C10 | C12 | C11 | 59.9° | 60.0° |
| C10 | C12 | H18 | 120.0° | 117.5° |
| C10 | C12 | H19 | 120.0° | 117.5° |
| C10 | C11 | C12 | 60.0° | 60.0° |
| C10 | C11 | H20 | 120.0° | 117.5° |
| C10 | C11 | H21 | 120.0° | 117.5° |
| C11 | C12 | H18 | 120.0° | 117.5° |
| C11 | C12 | H19 | 120.0° | 117.5° |
| C12 | C11 | H20 | 120.0° | 117.5° |
| C12 | C11 | H21 | 120.0° | 117.5° |
| H4 | C22 | H5 | 109.5° | 110.6° |
| H6 | C24 | H7 | 109.5° | 110.7° |
| H13 | C25 | H14 | 109.5° | 110.7° |
| H18 | C12 | H19 | 109.5° | 115.6° |
| H20 | C11 | H21 | 109.5° | 115.6° |
| H23 | N37 | H9 | 120.0° | 120.0° |
| C28 | S1 | H24 | 102.0° | 100.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C24 | C25 | H6 | 119.9° | 118.4° |
| C23 | C24 | C25 | H7 | 119.9° | 118.6° |
| C24 | C23 | C22 | N27 | 95.7° | 104.8° |
| C24 | C23 | C22 | H12 | 137.9° | 128.8° |
| C24 | C23 | N27 | H12 | 124.2° | 126.0° |
| C24 | C23 | C22 | C21 | 71.5° | 71.8° |
| C23 | C24 | C25 | C26 | 6.3° | 0.4° |
| C24 | C23 | N27 | C28 | 59.4° | 126.0° |
| C24 | C23 | N27 | C26 | 62.8° | 54.0° |
| C24 | C23 | C22 | H4 | 168.8° | 46.6° |
| C24 | C23 | C22 | H5 | 48.2° | 169.6° |
| C23 | C24 | H6 | H7 | 120.3° | 123.0° |
| C23 | C24 | C25 | H13 | 126.1° | 118.5° |
| C23 | C24 | C25 | H14 | 113.5° | 118.5° |
| C25 | C24 | C23 | C22 | 67.4° | 71.6° |
| C25 | C24 | C23 | N27 | 38.1° | 33.2° |
| C24 | C25 | C26 | H13 | 119.8° | 118.4° |
| C24 | C25 | C26 | H14 | 119.8° | 118.0° |
| C24 | C25 | C26 | N27 | 48.4° | 32.7° |
| C24 | C25 | C26 | C21 | 54.5° | 72.3° |
| C25 | C24 | H6 | H7 | 120.4° | 123.0° |
| C24 | C25 | C26 | H8 | 163.4° | 159.1° |
| C25 | C24 | C23 | H12 | 156.1° | 159.6° |
| C24 | C25 | H13 | H14 | 120.6° | 123.0° |
| C22 | C23 | N27 | H12 | 129.1° | 126.1° |
| C23 | C22 | C21 | H4 | 119.7° | 118.5° |
| C23 | C22 | C21 | H5 | 119.7° | 118.7° |
| C22 | C23 | N27 | C28 | 166.1° | 126.1° |
| C22 | C23 | N27 | C26 | 43.9° | 54.0° |
| C23 | C22 | C21 | C26 | 11.8° | 0.0° |
| C23 | C22 | C21 | N20 | 125.3° | 118.5° |
| C23 | C22 | C21 | H3 | 109.6° | 118.6° |
| C23 | C22 | H4 | H5 | 120.9° | 123.1° |
| C22 | C23 | C24 | H6 | 52.5° | 46.6° |
| C22 | C23 | C24 | H7 | 172.7° | 169.7° |
| N27 | C23 | C22 | C21 | 24.2° | 33.0° |
| C23 | N27 | C26 | C25 | 64.6° | 54.1° |
| C23 | N27 | C28 | C26 | 111.1° | 179.9° |
| C23 | N27 | C28 | N37 | 137.9° | 179.9° |
| C23 | N27 | C26 | C21 | 50.2° | 54.0° |
| N27 | C23 | C22 | H4 | 95.6° | 151.4° |
| N27 | C23 | C22 | H5 | 143.9° | 85.6° |
| N27 | C23 | C24 | H6 | 158.0° | 151.4° |
| N27 | C23 | C24 | H7 | 81.8° | 85.5° |
| C23 | N27 | C26 | H8 | 175.5° | 179.7° |
| C23 | N27 | C28 | S1 | 56.5° | 0.1° |
| C22 | C21 | C26 | C25 | 50.2° | 72.6° |
| C22 | C21 | C26 | N27 | 44.0° | 32.9° |
| C22 | C21 | C26 | N20 | 124.8° | 118.5° |
| C22 | C21 | C26 | H3 | 121.7° | 118.6° |
| C22 | C21 | N20 | H3 | 126.6° | 123.1° |
| C22 | C21 | N20 | C19 | 159.0° | 160.1° |
| C21 | C22 | H4 | H5 | 120.9° | 122.8° |
| C22 | C21 | C26 | H8 | 167.0° | 158.8° |
| C21 | C22 | C23 | H12 | 150.5° | 159.4° |
| C22 | C21 | N20 | H22 | 21.0° | 20.0° |
| C25 | C26 | N27 | C28 | 72.3° | 125.8° |
| C25 | C26 | N27 | C21 | 114.8° | 108.1° |
| C25 | C26 | N27 | H8 | 119.8° | 126.2° |
| C25 | C26 | C21 | H8 | 142.8° | 128.6° |
| C25 | C26 | C21 | N20 | 74.6° | 45.9° |
| C25 | C26 | C21 | H3 | 171.9° | 168.8° |
| C26 | C25 | C24 | H6 | 113.6° | 118.8° |
| C26 | C25 | C24 | H7 | 126.1° | 118.3° |
| C26 | C25 | H13 | H14 | 120.5° | 123.6° |
| N27 | C28 | N37 | S1 | 164.1° | 180.0° |
| C28 | N27 | C26 | C21 | 172.9° | 126.1° |
| C28 | N27 | C26 | H8 | 47.5° | 0.4° |
| C28 | N27 | C23 | H12 | 64.8° | 0.0° |
| N27 | C28 | N37 | H23 | 164.2° | 0.0° |
| N27 | C28 | N37 | H9 | 15.8° | 180.0° |
| N27 | C28 | S1 | H24 | 180.0° | 180.0° |
| N37 | C28 | N27 | C26 | 26.8° | 0.1° |
| C28 | N37 | H23 | H9 | 180.0° | 180.0° |
| N37 | C28 | S1 | H24 | 14.2° | 0.0° |
| N27 | C26 | C21 | H8 | 122.9° | 125.9° |
| N27 | C26 | C21 | N20 | 168.8° | 151.4° |
| N27 | C26 | C21 | H3 | 77.6° | 85.7° |
| C26 | N27 | C23 | H12 | 173.1° | 179.9° |
| N27 | C26 | C25 | H13 | 168.2° | 151.1° |
| N27 | C26 | C25 | H14 | 71.4° | 85.4° |
| C26 | N27 | C28 | S1 | 167.6° | 180.0° |
| C26 | C21 | N20 | H3 | 115.6° | 122.9° |
| C26 | C21 | N20 | C19 | 83.3° | 85.9° |
| C26 | C21 | C22 | H4 | 131.5° | 118.5° |
| C26 | C21 | C22 | H5 | 107.9° | 118.7° |
| C21 | C26 | C25 | H13 | 65.3° | 46.1° |
| C21 | C26 | C25 | H14 | 174.3° | 169.6° |
| C26 | C21 | N20 | H22 | 96.7° | 94.0° |
| C21 | N20 | C19 | H22 | 180.0° | 179.9° |
| C21 | N20 | C19 | O38 | 0.5° | 0.1° |
| C21 | N20 | C19 | C18 | 175.7° | 180.0° |
| N20 | C21 | C22 | H4 | 115.0° | 0.0° |
| N20 | C21 | C22 | H5 | 5.6° | 122.8° |
| N20 | C21 | C26 | H8 | 68.2° | 82.7° |
| N20 | C19 | O38 | C18 | 176.1° | 180.0° |
| N20 | C19 | C18 | C17 | 47.6° | 0.0° |
| N20 | C19 | C18 | C02 | 138.8° | 180.0° |
| C19 | N20 | C21 | H3 | 32.3° | 37.0° |
| O38 | C19 | C18 | C17 | 128.0° | 180.0° |
| O38 | C19 | C18 | C02 | 45.6° | 0.0° |
| O38 | C19 | N20 | H22 | 179.5° | 180.0° |
| C19 | C18 | C17 | C02 | 174.0° | 180.0° |
| C19 | C18 | C17 | C16 | 177.2° | 180.0° |
| C19 | C18 | C02 | CL01 | 6.1° | 0.0° |
| C19 | C18 | C02 | C03 | 177.7° | 180.0° |
| C19 | C18 | C17 | H2 | 2.8° | 0.2° |
| C18 | C19 | N20 | H22 | 4.3° | 0.1° |
| C18 | C17 | C16 | H2 | 180.0° | 179.8° |
| C18 | C17 | C16 | C04 | 0.4° | 0.0° |
| C17 | C18 | C02 | CL01 | 179.6° | 179.9° |
| C17 | C18 | C02 | C03 | 4.2° | 0.0° |
| C18 | C17 | C16 | H11 | 179.5° | 180.0° |
| C16 | C17 | C18 | C02 | 3.2° | 0.0° |
| C17 | C16 | C04 | H11 | 180.0° | 180.0° |
| C17 | C16 | C04 | C03 | 1.6° | 0.0° |
| C17 | C16 | C04 | C05 | 178.9° | 180.0° |
| C18 | C02 | CL01 | C03 | 176.5° | 180.0° |
| C18 | C02 | C03 | C04 | 2.2° | 0.0° |
| C02 | C18 | C17 | H2 | 176.8° | 179.8° |
| C18 | C02 | C03 | H10 | 177.8° | 180.0° |
| C16 | C04 | C03 | C02 | 0.8° | 0.0° |
| C16 | C04 | C03 | C05 | 177.3° | 180.0° |
| C16 | C04 | C05 | C06 | 29.9° | 179.9° |
| C16 | C04 | C05 | C15 | 153.4° | 0.0° |
| C04 | C16 | C17 | H2 | 179.6° | 179.8° |
| C16 | C04 | C03 | H10 | 179.2° | 179.9° |
| CL01 | C02 | C03 | C04 | 178.6° | 180.0° |
| CL01 | C02 | C03 | H10 | 1.4° | 0.0° |
| C02 | C03 | C04 | H10 | 180.0° | 180.0° |
| C02 | C03 | C04 | C05 | 178.1° | 180.0° |
| C03 | C04 | C05 | C06 | 147.4° | 0.0° |
| C03 | C04 | C05 | C15 | 29.3° | 180.0° |
| C03 | C04 | C16 | H11 | 178.4° | 180.0° |
| C04 | C05 | C06 | C15 | 176.8° | 180.0° |
| C04 | C05 | C06 | C07 | 178.6° | 180.0° |
| C04 | C05 | C15 | C09 | 179.3° | 180.0° |
| C04 | C05 | C15 | H1 | 0.7° | 0.3° |
| C05 | C04 | C03 | H10 | 1.9° | 0.0° |
| C05 | C04 | C16 | H11 | 1.1° | 0.0° |
| C04 | C05 | C06 | H15 | 1.4° | 0.0° |
| C05 | C06 | C07 | H15 | 180.0° | 180.0° |
| C05 | C06 | C07 | C08 | 0.8° | 0.0° |
| C06 | C05 | C15 | C09 | 2.6° | 0.0° |
| C06 | C05 | C15 | H1 | 177.4° | 179.7° |
| C05 | C06 | C07 | H16 | 179.2° | 180.0° |
| C07 | C06 | C05 | C15 | 1.7° | 0.0° |
| C06 | C07 | C08 | H16 | 180.0° | 180.0° |
| C06 | C07 | C08 | C09 | 0.7° | 0.0° |
| C06 | C07 | C08 | H17 | 179.3° | 180.0° |
| C05 | C15 | C09 | H1 | 180.0° | 179.7° |
| C05 | C15 | C09 | C08 | 2.8° | 0.0° |
| C05 | C15 | C09 | C10 | 178.7° | 179.7° |
| C15 | C05 | C06 | H15 | 178.3° | 180.0° |
| N14 | C13 | C10 | C09 | 155.3° | 135.8° |
| N14 | C13 | C10 | C12 | 72.3° | 78.6° |
| N14 | C13 | C10 | C11 | 6.4° | 9.9° |
| C07 | C08 | C09 | C15 | 1.8° | 0.0° |
| C07 | C08 | C09 | H17 | 180.0° | 180.0° |
| C07 | C08 | C09 | C10 | 179.7° | 179.7° |
| C08 | C07 | C06 | H15 | 179.2° | 180.0° |
| C15 | C09 | C10 | C13 | 78.0° | 34.3° |
| C15 | C09 | C08 | C10 | 178.5° | 179.8° |
| C15 | C09 | C10 | C12 | 53.0° | 180.0° |
| C15 | C09 | C10 | C11 | 126.1° | 111.3° |
| C15 | C09 | C08 | H17 | 178.2° | 180.0° |
| C13 | C10 | C09 | C08 | 103.4° | 145.4° |
| C13 | C10 | C09 | C12 | 131.0° | 145.7° |
| C13 | C10 | C09 | C11 | 155.8° | 145.7° |
| C13 | C10 | C12 | C11 | 103.0° | 107.5° |
| C13 | C10 | C12 | H18 | 147.6° | 145.0° |
| C13 | C10 | C12 | H19 | 6.4° | 0.1° |
| C13 | C10 | C11 | H20 | 3.8° | 0.0° |
| C13 | C10 | C11 | H21 | 144.9° | 145.0° |
| C08 | C09 | C10 | C12 | 125.7° | 0.2° |
| C08 | C09 | C10 | C11 | 52.5° | 68.9° |
| C08 | C09 | C15 | H1 | 177.2° | 179.7° |
| C09 | C08 | C07 | H16 | 179.3° | 180.0° |
| C09 | C10 | C12 | C11 | 128.2° | 107.5° |
| C10 | C09 | C15 | H1 | 1.3° | 0.1° |
| C10 | C09 | C08 | H17 | 0.3° | 0.3° |
| C09 | C10 | C12 | H18 | 18.8° | 0.0° |
| C09 | C10 | C12 | H19 | 122.4° | 145.0° |
| C09 | C10 | C11 | H20 | 151.5° | 145.0° |
| C09 | C10 | C11 | H21 | 10.4° | 0.0° |
| C10 | C12 | C11 | H18 | 109.4° | 107.5° |
| C10 | C12 | C11 | H19 | 109.4° | 107.5° |
| C10 | C12 | H18 | H19 | 144.8° | 145.7° |
| C12 | C10 | C11 | H20 | 109.5° | 107.5° |
| C12 | C10 | C11 | H21 | 109.5° | 107.5° |
| C10 | C11 | H20 | H21 | 144.7° | 145.7° |
| C11 | C12 | H18 | H19 | 144.8° | 145.6° |
| C12 | C11 | H20 | H21 | 144.7° | 145.7° |
| H2 | C17 | C16 | H11 | 0.5° | 0.2° |
| H3 | C21 | C22 | H4 | 10.1° | 122.9° |
| H3 | C21 | C22 | H5 | 130.7° | 0.1° |
| H3 | C21 | C26 | H8 | 45.3° | 40.2° |
| H3 | C21 | N20 | H22 | 147.7° | 143.1° |
| H4 | C22 | C23 | H12 | 30.8° | 82.2° |
| H5 | C22 | C23 | H12 | 89.7° | 40.8° |
| H6 | C24 | C23 | H12 | 84.0° | 82.2° |
| H6 | C24 | C25 | H13 | 6.2° | 0.1° |
| H6 | C24 | C25 | H14 | 126.6° | 123.1° |
| H7 | C24 | C23 | H12 | 36.2° | 40.9° |
| H7 | C24 | C25 | H13 | 114.1° | 122.8° |
| H7 | C24 | C25 | H14 | 6.3° | 0.2° |
| H8 | C26 | C25 | H13 | 76.8° | 82.5° |
| H8 | C26 | C25 | H14 | 43.6° | 41.0° |
| H15 | C06 | C07 | H16 | 0.8° | 0.0° |
| H16 | C07 | C08 | H17 | 0.7° | 0.0° |
| H18 | C12 | C11 | H20 | 141.1° | 145.1° |
| H18 | C12 | C11 | H21 | 0.1° | 0.0° |
| H19 | C12 | C11 | H20 | 0.0° | 0.1° |
| H19 | C12 | C11 | H21 | 141.1° | 145.0° |
| H23 | N37 | C28 | S1 | 0.0° | 180.0° |
| S1 | C28 | N37 | H9 | 180.0° | 0.0° |
