9LD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O15 | S4 | doub | 1.42Å | 1.43Å | |
| S12 | C22 | sing | 1.76Å | 1.70Å | Aromatic |
| S12 | C9 | sing | 1.76Å | 1.72Å | Aromatic |
| C22 | C24 | doub | 1.33Å | 1.34Å | Aromatic |
| C24 | C21 | sing | 1.38Å | 1.42Å | Aromatic |
| C9 | S4 | sing | 1.76Å | 1.73Å | |
| C9 | C21 | doub | 1.33Å | 1.37Å | Aromatic |
| S4 | O14 | doub | 1.42Å | 1.43Å | |
| S4 | N6 | sing | 1.66Å | 1.62Å | |
| N6 | C18 | sing | 1.47Å | 1.49Å | |
| N6 | C10 | sing | 1.47Å | 1.49Å | |
| C18 | C16 | sing | 1.53Å | 1.52Å | |
| C16 | C8 | sing | 1.51Å | 1.49Å | |
| C10 | C2 | sing | 1.51Å | 1.50Å | |
| C8 | C2 | sing | 1.40Å | 1.41Å | Aromatic |
| C8 | N5 | doub | 1.31Å | 1.31Å | Aromatic |
| C2 | C1 | doub | 1.37Å | 1.40Å | Aromatic |
| N5 | N3 | sing | 1.40Å | 1.39Å | Aromatic |
| C1 | C7 | sing | 1.47Å | 1.47Å | |
| C1 | N3 | sing | 1.37Å | 1.40Å | Aromatic |
| O19 | C7 | doub | 1.22Å | 1.23Å | |
| C7 | N11 | sing | 1.35Å | 1.36Å | |
| N3 | C17 | sing | 1.40Å | 1.49Å | |
| N11 | C25 | sing | 1.39Å | 1.48Å | |
| C17 | C32 | doub | 1.39Å | 1.40Å | Aromatic |
| C17 | C31 | sing | 1.39Å | 1.39Å | Aromatic |
| C30 | C25 | doub | 1.39Å | 1.39Å | Aromatic |
| C30 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C32 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | C29 | sing | 1.39Å | 1.39Å | Aromatic |
| C31 | C36 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C20 | doub | 1.40Å | 1.39Å | Aromatic |
| C29 | C26 | doub | 1.38Å | 1.38Å | Aromatic |
| C35 | C37 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C26 | sing | 1.40Å | 1.40Å | Aromatic |
| C20 | C13 | sing | 1.48Å | 1.49Å | |
| C36 | C37 | sing | 1.38Å | 1.38Å | Aromatic |
| O23 | C13 | doub | 1.22Å | 1.21Å | |
| C13 | O28 | sing | 1.35Å | 1.35Å | |
| O28 | C33 | sing | 1.45Å | 1.51Å | |
| C33 | C34 | sing | 1.53Å | 1.48Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C21 | H3 | sing | 1.08Å | 1.08Å | |
| C22 | H4 | sing | 1.08Å | 1.08Å | |
| C24 | H5 | sing | 1.08Å | 1.08Å | |
| C26 | H6 | sing | 1.08Å | 1.08Å | |
| C34 | H7 | sing | 1.09Å | 1.10Å | |
| C34 | H8 | sing | 1.09Å | 1.10Å | |
| C34 | H9 | sing | 1.09Å | 1.10Å | |
| C33 | H10 | sing | 1.09Å | 1.10Å | |
| C33 | H11 | sing | 1.09Å | 1.10Å | |
| C29 | H12 | sing | 1.08Å | 1.08Å | |
| N11 | H13 | sing | 0.97Å | 1.00Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C31 | H18 | sing | 1.08Å | 1.08Å | |
| C36 | H19 | sing | 1.08Å | 1.08Å | |
| C37 | H20 | sing | 1.08Å | 1.08Å | |
| C35 | H21 | sing | 1.08Å | 1.08Å | |
| C32 | H22 | sing | 1.08Å | 1.08Å | |
| C30 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H24 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O15 | S4 | C9 | 108.0° | 106.4° |
| O15 | S4 | O14 | 119.3° | 123.2° |
| O15 | S4 | N6 | 107.1° | 106.4° |
| C22 | S12 | C9 | 90.9° | 90.9° |
| S12 | C22 | C24 | 112.3° | 109.6° |
| S12 | C22 | H4 | 123.8° | 125.2° |
| S12 | C9 | S4 | 122.8° | 125.2° |
| S12 | C9 | C21 | 112.8° | 109.6° |
| C22 | C24 | C21 | 113.6° | 115.0° |
| C24 | C22 | H4 | 123.8° | 125.2° |
| C22 | C24 | H5 | 123.2° | 122.5° |
| C24 | C21 | C9 | 110.4° | 114.9° |
| C24 | C21 | H3 | 124.8° | 122.6° |
| C21 | C24 | H5 | 123.2° | 122.5° |
| S4 | C9 | C21 | 124.5° | 125.2° |
| C9 | S4 | O14 | 108.3° | 106.4° |
| C9 | S4 | N6 | 106.0° | 107.2° |
| C9 | C21 | H3 | 124.8° | 122.5° |
| O14 | S4 | N6 | 107.4° | 106.4° |
| S4 | N6 | C18 | 116.6° | 120.7° |
| S4 | N6 | C10 | 116.6° | 120.7° |
| C18 | N6 | C10 | 113.0° | 118.6° |
| N6 | C18 | C16 | 110.5° | 109.5° |
| N6 | C18 | H14 | 109.2° | 109.5° |
| N6 | C18 | H15 | 109.2° | 109.5° |
| N6 | C10 | C2 | 110.2° | 107.1° |
| N6 | C10 | H1 | 109.3° | 109.9° |
| N6 | C10 | H2 | 109.3° | 110.0° |
| C18 | C16 | C8 | 109.3° | 108.7° |
| C16 | C18 | H14 | 109.2° | 109.5° |
| C16 | C18 | H15 | 109.2° | 109.4° |
| C18 | C16 | H16 | 109.5° | 109.6° |
| C18 | C16 | H17 | 109.5° | 109.6° |
| C16 | C8 | C2 | 122.4° | 123.8° |
| C16 | C8 | N5 | 124.1° | 127.7° |
| C8 | C16 | H16 | 109.5° | 109.6° |
| C8 | C16 | H17 | 109.5° | 109.6° |
| C10 | C2 | C8 | 123.0° | 123.6° |
| C10 | C2 | C1 | 132.5° | 128.4° |
| C2 | C10 | H1 | 109.3° | 109.9° |
| C2 | C10 | H2 | 109.3° | 110.0° |
| C2 | C8 | N5 | 113.5° | 108.6° |
| C8 | C2 | C1 | 104.5° | 108.0° |
| C8 | N5 | N3 | 105.4° | 108.9° |
| C2 | C1 | C7 | 126.2° | 126.6° |
| C2 | C1 | N3 | 106.5° | 106.9° |
| N5 | N3 | C1 | 110.1° | 107.7° |
| N5 | N3 | C17 | 117.5° | 126.2° |
| C7 | C1 | N3 | 127.3° | 126.6° |
| C1 | C7 | O19 | 120.5° | 120.0° |
| C1 | C7 | N11 | 115.6° | 120.0° |
| C1 | N3 | C17 | 132.4° | 126.1° |
| O19 | C7 | N11 | 123.9° | 120.0° |
| C7 | N11 | C25 | 130.0° | 120.0° |
| C7 | N11 | H13 | 115.0° | 119.9° |
| N3 | C17 | C32 | 119.8° | 120.1° |
| N3 | C17 | C31 | 120.6° | 120.1° |
| N11 | C25 | C30 | 121.7° | 119.9° |
| N11 | C25 | C29 | 119.1° | 119.9° |
| C25 | N11 | H13 | 115.0° | 120.1° |
| C32 | C17 | C31 | 119.6° | 119.8° |
| C17 | C32 | C35 | 119.8° | 119.9° |
| C17 | C32 | H22 | 120.1° | 120.0° |
| C17 | C31 | C36 | 119.7° | 120.0° |
| C17 | C31 | H18 | 120.1° | 120.0° |
| C25 | C30 | C27 | 120.4° | 120.1° |
| C30 | C25 | C29 | 119.2° | 120.2° |
| C25 | C30 | H23 | 119.8° | 120.0° |
| C30 | C27 | C20 | 120.8° | 119.9° |
| C27 | C30 | H23 | 119.8° | 119.9° |
| C30 | C27 | H24 | 119.6° | 120.1° |
| C32 | C35 | C37 | 120.4° | 120.0° |
| C32 | C35 | H21 | 119.8° | 120.0° |
| C35 | C32 | H22 | 120.1° | 120.0° |
| C25 | C29 | C26 | 120.2° | 120.0° |
| C25 | C29 | H12 | 119.9° | 119.9° |
| C31 | C36 | C37 | 120.6° | 120.1° |
| C36 | C31 | H18 | 120.2° | 120.0° |
| C31 | C36 | H19 | 119.7° | 119.9° |
| C27 | C20 | C26 | 118.4° | 119.8° |
| C27 | C20 | C13 | 119.8° | 120.1° |
| C20 | C27 | H24 | 119.6° | 120.0° |
| C29 | C26 | C20 | 120.9° | 120.0° |
| C29 | C26 | H6 | 119.5° | 120.0° |
| C26 | C29 | H12 | 119.9° | 120.0° |
| C35 | C37 | C36 | 119.9° | 120.2° |
| C35 | C37 | H20 | 120.1° | 119.9° |
| C37 | C35 | H21 | 119.8° | 120.0° |
| C26 | C20 | C13 | 121.8° | 120.1° |
| C20 | C26 | H6 | 119.5° | 120.0° |
| C20 | C13 | O23 | 124.3° | 120.0° |
| C20 | C13 | O28 | 112.3° | 120.0° |
| C37 | C36 | H19 | 119.7° | 120.0° |
| C36 | C37 | H20 | 120.0° | 119.9° |
| O23 | C13 | O28 | 123.4° | 120.0° |
| C13 | O28 | C33 | 117.0° | 117.0° |
| O28 | C33 | C34 | 108.6° | 109.5° |
| O28 | C33 | H10 | 109.7° | 109.5° |
| O28 | C33 | H11 | 109.7° | 109.5° |
| C33 | C34 | H7 | 109.5° | 109.5° |
| C33 | C34 | H8 | 109.5° | 109.5° |
| C33 | C34 | H9 | 109.5° | 109.5° |
| C34 | C33 | H10 | 109.7° | 109.5° |
| C34 | C33 | H11 | 109.7° | 109.5° |
| H1 | C10 | H2 | 109.5° | 109.9° |
| H7 | C34 | H8 | 109.4° | 109.5° |
| H7 | C34 | H9 | 109.4° | 109.4° |
| H8 | C34 | H9 | 109.5° | 109.4° |
| H10 | C33 | H11 | 109.5° | 109.4° |
| H14 | C18 | H15 | 109.5° | 109.5° |
| H16 | C16 | H17 | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O15 | S4 | C9 | S12 | 33.2° | 23.6° |
| O15 | S4 | C9 | O14 | 130.6° | 132.9° |
| O15 | S4 | C9 | N6 | 114.5° | 113.6° |
| O15 | S4 | C9 | C21 | 147.1° | 156.4° |
| O15 | S4 | O14 | N6 | 122.0° | 123.0° |
| O15 | S4 | N6 | C18 | 47.2° | 23.5° |
| O15 | S4 | N6 | C10 | 175.0° | 156.4° |
| S12 | C22 | C24 | H4 | 180.0° | 179.9° |
| S12 | C22 | C24 | C21 | 0.1° | 0.1° |
| C22 | S12 | C9 | S4 | 179.8° | 179.9° |
| C22 | S12 | C9 | C21 | 0.1° | 0.1° |
| S12 | C22 | C24 | H5 | 179.9° | 179.9° |
| C9 | S12 | C22 | C24 | 0.0° | 0.0° |
| S12 | C9 | C21 | C24 | 0.1° | 0.2° |
| S12 | C9 | S4 | C21 | 179.7° | 180.0° |
| S12 | C9 | S4 | O14 | 163.8° | 156.5° |
| S12 | C9 | S4 | N6 | 81.3° | 90.0° |
| S12 | C9 | C21 | H3 | 179.9° | 180.0° |
| C9 | S12 | C22 | H4 | 180.0° | 179.8° |
| C22 | C24 | C21 | H5 | 180.0° | 180.0° |
| C22 | C24 | C21 | C9 | 0.1° | 0.2° |
| C22 | C24 | C21 | H3 | 179.9° | 180.0° |
| C24 | C21 | C9 | S4 | 179.8° | 179.8° |
| C24 | C21 | C9 | H3 | 180.0° | 179.7° |
| C21 | C24 | C22 | H4 | 179.9° | 180.0° |
| C9 | S4 | O14 | N6 | 114.0° | 114.1° |
| C9 | S4 | N6 | C18 | 67.9° | 90.0° |
| C9 | S4 | N6 | C10 | 69.9° | 90.0° |
| S4 | C9 | C21 | H3 | 0.2° | 0.1° |
| C21 | C9 | S4 | O14 | 16.5° | 23.5° |
| C21 | C9 | S4 | N6 | 98.4° | 90.0° |
| C9 | C21 | C24 | H5 | 179.9° | 179.8° |
| O14 | S4 | N6 | C18 | 176.5° | 156.5° |
| O14 | S4 | N6 | C10 | 45.7° | 23.5° |
| S4 | N6 | C18 | C10 | 139.3° | 180.0° |
| S4 | N6 | C18 | C16 | 153.9° | 114.2° |
| S4 | N6 | C10 | C2 | 175.9° | 135.1° |
| S4 | N6 | C10 | H1 | 55.8° | 105.5° |
| S4 | N6 | C10 | H2 | 64.0° | 15.7° |
| S4 | N6 | C18 | H14 | 85.9° | 125.8° |
| S4 | N6 | C18 | H15 | 33.8° | 5.8° |
| N6 | C18 | C16 | H14 | 120.1° | 120.0° |
| N6 | C18 | C16 | H15 | 120.2° | 120.1° |
| N6 | C18 | C16 | C8 | 50.0° | 46.0° |
| C18 | N6 | C10 | C2 | 44.8° | 44.8° |
| C18 | N6 | C10 | H1 | 164.9° | 74.5° |
| C18 | N6 | C10 | H2 | 75.3° | 164.3° |
| N6 | C18 | H14 | H15 | 119.5° | 120.1° |
| N6 | C18 | C16 | H16 | 170.0° | 73.7° |
| N6 | C18 | C16 | H17 | 69.9° | 165.8° |
| C10 | N6 | C18 | C16 | 66.8° | 65.8° |
| N6 | C10 | C2 | H1 | 120.1° | 119.3° |
| N6 | C10 | C2 | H2 | 120.1° | 119.5° |
| N6 | C10 | C2 | C8 | 12.2° | 11.2° |
| N6 | C10 | C2 | C1 | 167.6° | 169.1° |
| N6 | C10 | H1 | H2 | 119.7° | 121.2° |
| C10 | N6 | C18 | H14 | 53.3° | 54.2° |
| C10 | N6 | C18 | H15 | 173.0° | 174.2° |
| C18 | C16 | C8 | H16 | 120.0° | 119.7° |
| C18 | C16 | C8 | H17 | 120.0° | 119.7° |
| C18 | C16 | C8 | C2 | 18.9° | 18.0° |
| C18 | C16 | C8 | N5 | 161.3° | 162.2° |
| C16 | C18 | H14 | H15 | 119.5° | 119.9° |
| C18 | C16 | H16 | H17 | 120.1° | 120.4° |
| C16 | C8 | C2 | C10 | 0.1° | 0.3° |
| C16 | C8 | C2 | N5 | 179.8° | 179.9° |
| C16 | C8 | C2 | C1 | 179.7° | 180.0° |
| C16 | C8 | N5 | N3 | 179.9° | 179.8° |
| C8 | C16 | C18 | H14 | 70.1° | 74.0° |
| C8 | C16 | C18 | H15 | 170.2° | 166.1° |
| C8 | C16 | H16 | H17 | 120.1° | 120.4° |
| C10 | C2 | C8 | C1 | 179.9° | 179.7° |
| C10 | C2 | C8 | N5 | 180.0° | 179.8° |
| C10 | C2 | C1 | C7 | 0.4° | 0.4° |
| C10 | C2 | C1 | N3 | 179.9° | 179.6° |
| C2 | C10 | H1 | H2 | 119.7° | 121.2° |
| C2 | C8 | N5 | N3 | 0.1° | 0.3° |
| C8 | C2 | C1 | C7 | 179.8° | 179.9° |
| C8 | C2 | C1 | N3 | 0.2° | 0.1° |
| C8 | C2 | C10 | H1 | 132.3° | 108.1° |
| C8 | C2 | C10 | H2 | 107.9° | 130.7° |
| C2 | C8 | C16 | H16 | 138.9° | 101.8° |
| C2 | C8 | C16 | H17 | 101.1° | 137.7° |
| N5 | C8 | C2 | C1 | 0.1° | 0.1° |
| C8 | N5 | N3 | C1 | 0.2° | 0.4° |
| C8 | N5 | N3 | C17 | 179.9° | 179.9° |
| N5 | C8 | C16 | H16 | 41.3° | 78.1° |
| N5 | C8 | C16 | H17 | 78.7° | 42.4° |
| C2 | C1 | N3 | N5 | 0.3° | 0.3° |
| C2 | C1 | C7 | N3 | 179.4° | 180.0° |
| C2 | C1 | C7 | O19 | 34.3° | 80.7° |
| C2 | C1 | C7 | N11 | 145.4° | 99.2° |
| C2 | C1 | N3 | C17 | 179.9° | 180.0° |
| C1 | C2 | C10 | H1 | 47.5° | 71.5° |
| C1 | C2 | C10 | H2 | 72.3° | 49.6° |
| N5 | N3 | C1 | C7 | 179.8° | 179.7° |
| N5 | N3 | C1 | C17 | 179.8° | 179.7° |
| N5 | N3 | C17 | C32 | 30.8° | 43.3° |
| N5 | N3 | C17 | C31 | 148.7° | 136.3° |
| C1 | C7 | O19 | N11 | 179.7° | 179.9° |
| C7 | C1 | N3 | C17 | 0.4° | 0.0° |
| C1 | C7 | N11 | C25 | 179.4° | 175.4° |
| C1 | C7 | N11 | H13 | 0.6° | 4.6° |
| N3 | C1 | C7 | O19 | 145.1° | 99.2° |
| N3 | C1 | C7 | N11 | 35.1° | 80.8° |
| C1 | N3 | C17 | C32 | 149.0° | 136.3° |
| C1 | N3 | C17 | C31 | 31.4° | 44.0° |
| O19 | C7 | N11 | C25 | 0.8° | 4.7° |
| O19 | C7 | N11 | H13 | 179.2° | 175.3° |
| C7 | N11 | C25 | H13 | 180.0° | 180.0° |
| C7 | N11 | C25 | C30 | 11.1° | 34.6° |
| C7 | N11 | C25 | C29 | 170.0° | 145.3° |
| N3 | C17 | C32 | C31 | 179.5° | 179.7° |
| N3 | C17 | C32 | C35 | 179.8° | 179.7° |
| N3 | C17 | C31 | C36 | 179.9° | 180.0° |
| N3 | C17 | C31 | H18 | 0.1° | 0.1° |
| N3 | C17 | C32 | H22 | 0.2° | 0.1° |
| N11 | C25 | C30 | C29 | 178.9° | 179.9° |
| N11 | C25 | C30 | C27 | 179.5° | 179.7° |
| N11 | C25 | C29 | C26 | 179.6° | 180.0° |
| N11 | C25 | C29 | H12 | 0.4° | 0.0° |
| N11 | C25 | C30 | H23 | 0.5° | 0.1° |
| C17 | C32 | C35 | H22 | 180.0° | 179.7° |
| C32 | C17 | C31 | C36 | 0.4° | 0.3° |
| C17 | C32 | C35 | C37 | 0.1° | 0.6° |
| C32 | C17 | C31 | H18 | 179.6° | 179.8° |
| C17 | C32 | C35 | H21 | 180.0° | 179.7° |
| C31 | C17 | C32 | C35 | 0.3° | 0.6° |
| C17 | C31 | C36 | H18 | 180.0° | 179.9° |
| C17 | C31 | C36 | C37 | 0.3° | 0.0° |
| C17 | C31 | C36 | H19 | 179.7° | 179.9° |
| C31 | C17 | C32 | H22 | 179.7° | 179.7° |
| C25 | C30 | C27 | H23 | 180.0° | 179.8° |
| C25 | C30 | C27 | C20 | 0.3° | 0.5° |
| C30 | C25 | C29 | C26 | 0.6° | 0.0° |
| C30 | C25 | C29 | H12 | 179.4° | 180.0° |
| C30 | C25 | N11 | H13 | 168.9° | 145.4° |
| C25 | C30 | C27 | H24 | 179.7° | 180.0° |
| C27 | C30 | C25 | C29 | 0.6° | 0.2° |
| C30 | C27 | C20 | H24 | 180.0° | 179.5° |
| C30 | C27 | C20 | C26 | 0.1° | 0.5° |
| C30 | C27 | C20 | C13 | 179.9° | 179.8° |
| C32 | C35 | C37 | H21 | 180.0° | 179.7° |
| C32 | C35 | C37 | C36 | 0.1° | 0.3° |
| C32 | C35 | C37 | H20 | 179.9° | 179.7° |
| C25 | C29 | C26 | H12 | 180.0° | 180.0° |
| C25 | C29 | C26 | C20 | 0.4° | 0.0° |
| C25 | C29 | C26 | H6 | 179.6° | 180.0° |
| C29 | C25 | N11 | H13 | 10.1° | 34.7° |
| C29 | C25 | C30 | H23 | 179.4° | 180.0° |
| C31 | C36 | C37 | C35 | 0.0° | 0.0° |
| C31 | C36 | C37 | H19 | 180.0° | 179.9° |
| C31 | C36 | C37 | H20 | 180.0° | 180.0° |
| C27 | C20 | C26 | C29 | 0.1° | 0.2° |
| C27 | C20 | C26 | C13 | 180.0° | 179.8° |
| C27 | C20 | C13 | O23 | 15.2° | 179.7° |
| C27 | C20 | C13 | O28 | 164.7° | 0.3° |
| C27 | C20 | C26 | H6 | 179.9° | 179.7° |
| C20 | C27 | C30 | H23 | 179.6° | 179.7° |
| C29 | C26 | C20 | H6 | 180.0° | 180.0° |
| C29 | C26 | C20 | C13 | 179.9° | 180.0° |
| C35 | C37 | C36 | H20 | 180.0° | 180.0° |
| C35 | C37 | C36 | H19 | 180.0° | 179.9° |
| C37 | C35 | C32 | H22 | 180.0° | 179.7° |
| C26 | C20 | C13 | O23 | 164.8° | 0.0° |
| C26 | C20 | C13 | O28 | 15.3° | 180.0° |
| C20 | C26 | C29 | H12 | 179.6° | 180.0° |
| C26 | C20 | C27 | H24 | 179.9° | 180.0° |
| C20 | C13 | O23 | O28 | 179.9° | 180.0° |
| C20 | C13 | O28 | C33 | 134.1° | 180.0° |
| C13 | C20 | C26 | H6 | 0.1° | 0.0° |
| C13 | C20 | C27 | H24 | 0.1° | 0.2° |
| C37 | C36 | C31 | H18 | 179.7° | 179.9° |
| C36 | C37 | C35 | H21 | 179.9° | 180.0° |
| O23 | C13 | O28 | C33 | 45.9° | 0.0° |
| C13 | O28 | C33 | C34 | 175.5° | 180.0° |
| C13 | O28 | C33 | H10 | 55.7° | 60.0° |
| C13 | O28 | C33 | H11 | 64.6° | 59.9° |
| O28 | C33 | C34 | H10 | 119.9° | 120.0° |
| O28 | C33 | C34 | H11 | 119.8° | 120.1° |
| O28 | C33 | C34 | H7 | 180.0° | 180.0° |
| O28 | C33 | C34 | H8 | 60.0° | 59.9° |
| O28 | C33 | C34 | H9 | 60.0° | 60.0° |
| O28 | C33 | H10 | H11 | 120.4° | 120.0° |
| C33 | C34 | H7 | H8 | 120.0° | 120.1° |
| C33 | C34 | H7 | H9 | 120.0° | 120.0° |
| C33 | C34 | H8 | H9 | 120.0° | 120.0° |
| C34 | C33 | H10 | H11 | 120.4° | 120.0° |
| H3 | C21 | C24 | H5 | 0.1° | 0.0° |
| H4 | C22 | C24 | H5 | 0.1° | 0.0° |
| H6 | C26 | C29 | H12 | 0.4° | 0.0° |
| H7 | C34 | H8 | H9 | 120.0° | 120.0° |
| H7 | C34 | C33 | H10 | 60.2° | 60.0° |
| H7 | C34 | C33 | H11 | 60.1° | 59.9° |
| H8 | C34 | C33 | H10 | 179.8° | 60.1° |
| H8 | C34 | C33 | H11 | 59.9° | 180.0° |
| H9 | C34 | C33 | H10 | 59.8° | 179.9° |
| H9 | C34 | C33 | H11 | 179.9° | 60.0° |
| H14 | C18 | C16 | H16 | 49.9° | 166.3° |
| H14 | C18 | C16 | H17 | 169.9° | 45.8° |
| H15 | C18 | C16 | H16 | 69.8° | 46.3° |
| H15 | C18 | C16 | H17 | 50.2° | 74.2° |
| H18 | C31 | C36 | H19 | 0.3° | 0.0° |
| H19 | C36 | C37 | H20 | 0.0° | 0.0° |
| H20 | C37 | C35 | H21 | 0.1° | 0.0° |
| H21 | C35 | C32 | H22 | 0.0° | 0.0° |
| H23 | C30 | C27 | H24 | 0.4° | 0.2° |
