63K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| S16 | C13 | sing | 1.76Å | 1.75Å | |
| S16 | C18 | sing | 1.76Å | 1.77Å | |
| N14 | C13 | doub | 1.32Å | 1.34Å | Aromatic |
| N14 | N15 | sing | 1.29Å | 1.35Å | Aromatic |
| C13 | N12 | sing | 1.36Å | 1.38Å | Aromatic |
| N15 | C11 | doub | 1.32Å | 1.37Å | Aromatic |
| C18 | C19 | doub | 1.39Å | 1.38Å | Aromatic |
| C18 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | C20 | sing | 1.36Å | 1.38Å | Aromatic |
| N12 | C11 | sing | 1.38Å | 1.31Å | Aromatic |
| N12 | N4 | sing | 1.40Å | 1.31Å | Aromatic |
| C11 | C1 | sing | 1.41Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.38Å | Aromatic |
| N4 | C3 | doub | 1.31Å | 1.34Å | Aromatic |
| C20 | C23 | doub | 1.41Å | 1.39Å | Aromatic |
| C1 | C2 | doub | 1.36Å | 1.38Å | Aromatic |
| C3 | C2 | sing | 1.41Å | 1.38Å | Aromatic |
| C3 | C5 | sing | 1.48Å | 1.45Å | |
| C22 | C23 | sing | 1.40Å | 1.39Å | Aromatic |
| C22 | S26 | sing | 1.76Å | 1.72Å | Aromatic |
| C23 | N24 | sing | 1.35Å | 1.37Å | Aromatic |
| C5 | C10 | doub | 1.39Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.38Å | Aromatic |
| S26 | C25 | sing | 1.76Å | 1.72Å | Aromatic |
| N24 | C25 | doub | 1.29Å | 1.32Å | Aromatic |
| C9 | C8 | doub | 1.39Å | 1.38Å | Aromatic |
| C7 | C8 | sing | 1.39Å | 1.38Å | Aromatic |
| C25 | N27 | sing | 1.38Å | 1.38Å | |
| C8 | F17 | sing | 1.35Å | 1.34Å | |
| N27 | C28 | sing | 1.35Å | 1.38Å | |
| O30 | C28 | doub | 1.22Å | 1.23Å | |
| C28 | N29 | sing | 1.35Å | 1.37Å | |
| N29 | C31 | sing | 1.46Å | 1.44Å | |
| C31 | C32 | sing | 1.53Å | 1.51Å | |
| C32 | N33 | sing | 1.47Å | 1.48Å | |
| N33 | C34 | sing | 1.47Å | 1.49Å | |
| N33 | C38 | sing | 1.47Å | 1.49Å | |
| C34 | C35 | sing | 1.53Å | 1.51Å | |
| C35 | O36 | sing | 1.43Å | 1.43Å | |
| C38 | C37 | sing | 1.53Å | 1.51Å | |
| C37 | O36 | sing | 1.43Å | 1.42Å | |
| C6 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.08Å | 1.08Å | |
| C20 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H5 | sing | 1.08Å | 1.08Å | |
| C19 | H6 | sing | 1.08Å | 1.08Å | |
| C2 | H7 | sing | 1.08Å | 1.08Å | |
| C1 | H8 | sing | 1.08Å | 1.08Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C34 | H10 | sing | 1.09Å | 1.10Å | |
| C34 | H11 | sing | 1.09Å | 1.10Å | |
| C38 | H12 | sing | 1.09Å | 1.10Å | |
| C38 | H13 | sing | 1.09Å | 1.10Å | |
| C35 | H14 | sing | 1.09Å | 1.10Å | |
| C35 | H15 | sing | 1.09Å | 1.10Å | |
| C37 | H16 | sing | 1.09Å | 1.10Å | |
| C37 | H17 | sing | 1.09Å | 1.10Å | |
| C31 | H18 | sing | 1.09Å | 1.10Å | |
| C31 | H19 | sing | 1.09Å | 1.10Å | |
| C32 | H20 | sing | 1.09Å | 1.10Å | |
| C32 | H21 | sing | 1.09Å | 1.10Å | |
| N27 | H22 | sing | 0.97Å | 1.00Å | |
| N29 | H23 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | S16 | C18 | 101.8° | 103.0° |
| S16 | C13 | N14 | 124.6° | 126.3° |
| S16 | C13 | N12 | 123.9° | 126.3° |
| S16 | C18 | C19 | 121.6° | 120.1° |
| S16 | C18 | C21 | 117.3° | 120.1° |
| C13 | N14 | N15 | 103.7° | 110.3° |
| N14 | C13 | N12 | 111.6° | 107.3° |
| N14 | N15 | C11 | 110.5° | 109.6° |
| C13 | N12 | C11 | 106.0° | 105.9° |
| C13 | N12 | N4 | 126.9° | 134.0° |
| N15 | C11 | N12 | 108.3° | 106.9° |
| N15 | C11 | C1 | 130.3° | 133.8° |
| C19 | C18 | C21 | 121.1° | 119.8° |
| C18 | C19 | C20 | 122.7° | 120.7° |
| C18 | C19 | H6 | 118.6° | 119.7° |
| C18 | C21 | C22 | 116.1° | 120.0° |
| C18 | C21 | H9 | 122.0° | 120.0° |
| C19 | C20 | C23 | 117.0° | 120.6° |
| C19 | C20 | H3 | 121.5° | 119.7° |
| C20 | C19 | H6 | 118.6° | 119.7° |
| C11 | N12 | N4 | 127.0° | 120.1° |
| N12 | C11 | C1 | 121.4° | 119.3° |
| N12 | N4 | C3 | 114.1° | 120.4° |
| C11 | C1 | C2 | 113.6° | 119.2° |
| C11 | C1 | H8 | 123.2° | 120.4° |
| C21 | C22 | C23 | 123.7° | 120.4° |
| C21 | C22 | S26 | 126.2° | 131.2° |
| C22 | C21 | H9 | 122.0° | 120.0° |
| N4 | C3 | C2 | 122.7° | 120.9° |
| N4 | C3 | C5 | 115.6° | 119.6° |
| C20 | C23 | C22 | 119.5° | 118.5° |
| C20 | C23 | N24 | 125.7° | 128.7° |
| C23 | C20 | H3 | 121.5° | 119.7° |
| C1 | C2 | C3 | 121.2° | 120.1° |
| C1 | C2 | H7 | 119.4° | 119.9° |
| C2 | C1 | H8 | 123.2° | 120.4° |
| C2 | C3 | C5 | 121.6° | 119.5° |
| C3 | C2 | H7 | 119.4° | 119.9° |
| C3 | C5 | C10 | 119.7° | 120.1° |
| C3 | C5 | C6 | 121.3° | 120.1° |
| C23 | C22 | S26 | 110.1° | 108.4° |
| C22 | C23 | N24 | 114.8° | 112.9° |
| C22 | S26 | C25 | 89.1° | 90.4° |
| C23 | N24 | C25 | 110.1° | 117.9° |
| C10 | C5 | C6 | 118.9° | 119.8° |
| C5 | C10 | C9 | 121.0° | 119.9° |
| C5 | C10 | H2 | 119.5° | 120.1° |
| C5 | C6 | C7 | 120.7° | 119.9° |
| C5 | C6 | H1 | 119.7° | 120.1° |
| C10 | C9 | C8 | 119.1° | 120.1° |
| C9 | C10 | H2 | 119.5° | 120.1° |
| C10 | C9 | H5 | 120.4° | 119.9° |
| C6 | C7 | C8 | 119.4° | 120.1° |
| C7 | C6 | H1 | 119.6° | 120.0° |
| C6 | C7 | H4 | 120.3° | 119.9° |
| S26 | C25 | N24 | 115.9° | 110.4° |
| S26 | C25 | N27 | 118.2° | 124.8° |
| N24 | C25 | N27 | 125.8° | 124.8° |
| C9 | C8 | C7 | 120.9° | 120.2° |
| C9 | C8 | F17 | 119.8° | 119.9° |
| C8 | C9 | H5 | 120.5° | 119.9° |
| C7 | C8 | F17 | 119.4° | 119.9° |
| C8 | C7 | H4 | 120.3° | 120.0° |
| C25 | N27 | C28 | 122.1° | 120.0° |
| C25 | N27 | H22 | 118.9° | 120.0° |
| N27 | C28 | O30 | 126.1° | 120.0° |
| N27 | C28 | N29 | 111.6° | 120.0° |
| C28 | N27 | H22 | 119.0° | 119.9° |
| O30 | C28 | N29 | 122.4° | 119.9° |
| C28 | N29 | C31 | 119.8° | 120.0° |
| C28 | N29 | H23 | 120.1° | 120.0° |
| N29 | C31 | C32 | 110.1° | 109.5° |
| N29 | C31 | H18 | 109.3° | 109.5° |
| N29 | C31 | H19 | 109.3° | 109.5° |
| C31 | N29 | H23 | 120.1° | 120.0° |
| C31 | C32 | N33 | 107.1° | 109.5° |
| C32 | C31 | H18 | 109.3° | 109.5° |
| C32 | C31 | H19 | 109.3° | 109.5° |
| C31 | C32 | H20 | 110.1° | 109.4° |
| C31 | C32 | H21 | 110.1° | 109.4° |
| C32 | N33 | C34 | 110.4° | 111.0° |
| C32 | N33 | C38 | 112.0° | 111.0° |
| N33 | C32 | H20 | 110.0° | 109.5° |
| N33 | C32 | H21 | 110.0° | 109.5° |
| C34 | N33 | C38 | 114.9° | 110.7° |
| N33 | C34 | C35 | 109.4° | 109.3° |
| N33 | C34 | H10 | 109.5° | 109.5° |
| N33 | C34 | H11 | 109.5° | 109.5° |
| N33 | C38 | C37 | 106.0° | 109.2° |
| N33 | C38 | H12 | 110.3° | 109.5° |
| N33 | C38 | H13 | 110.3° | 109.5° |
| C34 | C35 | O36 | 108.3° | 109.3° |
| C35 | C34 | H10 | 109.5° | 109.5° |
| C35 | C34 | H11 | 109.5° | 109.5° |
| C34 | C35 | H14 | 109.8° | 109.5° |
| C34 | C35 | H15 | 109.7° | 109.5° |
| C35 | O36 | C37 | 108.7° | 113.7° |
| O36 | C35 | H14 | 109.8° | 109.5° |
| O36 | C35 | H15 | 109.8° | 109.6° |
| C38 | C37 | O36 | 106.1° | 109.3° |
| C37 | C38 | H12 | 110.3° | 109.5° |
| C37 | C38 | H13 | 110.3° | 109.5° |
| C38 | C37 | H16 | 110.3° | 109.5° |
| C38 | C37 | H17 | 110.3° | 109.5° |
| O36 | C37 | H16 | 110.3° | 109.5° |
| O36 | C37 | H17 | 110.3° | 109.5° |
| H10 | C34 | H11 | 109.5° | 109.5° |
| H12 | C38 | H13 | 109.5° | 109.6° |
| H14 | C35 | H15 | 109.5° | 109.5° |
| H16 | C37 | H17 | 109.5° | 109.6° |
| H18 | C31 | H19 | 109.5° | 109.4° |
| H20 | C32 | H21 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| S16 | C13 | N14 | N12 | 179.9° | 180.0° |
| S16 | C13 | N14 | N15 | 179.8° | 180.0° |
| C13 | S16 | C18 | C19 | 75.4° | 85.2° |
| C13 | S16 | C18 | C21 | 104.8° | 95.4° |
| S16 | C13 | N12 | C11 | 179.7° | 180.0° |
| S16 | C13 | N12 | N4 | 0.1° | 0.3° |
| C18 | S16 | C13 | N14 | 104.9° | 5.1° |
| C18 | S16 | C13 | N12 | 75.3° | 174.9° |
| S16 | C18 | C19 | C21 | 179.9° | 179.4° |
| S16 | C18 | C19 | C20 | 179.9° | 180.0° |
| S16 | C18 | C21 | C22 | 180.0° | 179.8° |
| S16 | C18 | C19 | H6 | 0.1° | 0.0° |
| S16 | C18 | C21 | H9 | 0.1° | 0.4° |
| C13 | N14 | N15 | C11 | 0.0° | 0.0° |
| N14 | C13 | N12 | C11 | 0.2° | 0.0° |
| N14 | C13 | N12 | N4 | 180.0° | 179.7° |
| N15 | N14 | C13 | N12 | 0.1° | 0.0° |
| N14 | N15 | C11 | N12 | 0.2° | 0.0° |
| N14 | N15 | C11 | C1 | 179.7° | 180.0° |
| C13 | N12 | C11 | N15 | 0.2° | 0.0° |
| C13 | N12 | C11 | N4 | 179.8° | 179.7° |
| C13 | N12 | C11 | C1 | 179.6° | 180.0° |
| C13 | N12 | N4 | C3 | 179.8° | 179.9° |
| N15 | C11 | N12 | C1 | 179.8° | 180.0° |
| N15 | C11 | N12 | N4 | 180.0° | 179.7° |
| N15 | C11 | C1 | C2 | 179.5° | 180.0° |
| N15 | C11 | C1 | H8 | 0.5° | 0.0° |
| C18 | C19 | C20 | H6 | 180.0° | 180.0° |
| C19 | C18 | C21 | C22 | 0.1° | 0.9° |
| C18 | C19 | C20 | C23 | 0.0° | 0.0° |
| C18 | C19 | C20 | H3 | 180.0° | 179.7° |
| C19 | C18 | C21 | H9 | 179.9° | 179.8° |
| C21 | C18 | C19 | C20 | 0.1° | 0.6° |
| C18 | C21 | C22 | H9 | 180.0° | 179.4° |
| C18 | C21 | C22 | C23 | 0.1° | 0.6° |
| C18 | C21 | C22 | S26 | 180.0° | 180.0° |
| C21 | C18 | C19 | H6 | 180.0° | 179.4° |
| C19 | C20 | C23 | H3 | 180.0° | 179.8° |
| C19 | C20 | C23 | C22 | 0.0° | 0.3° |
| C19 | C20 | C23 | N24 | 180.0° | 179.7° |
| C11 | N12 | N4 | C3 | 0.5° | 0.3° |
| N12 | C11 | C1 | C2 | 0.7° | 0.0° |
| N12 | C11 | C1 | H8 | 179.3° | 179.9° |
| N4 | N12 | C11 | C1 | 0.1° | 0.3° |
| N12 | N4 | C3 | C2 | 0.6° | 0.0° |
| N12 | N4 | C3 | C5 | 177.4° | 180.0° |
| C11 | C1 | C2 | H8 | 180.0° | 180.0° |
| C11 | C1 | C2 | C3 | 0.6° | 0.3° |
| C11 | C1 | C2 | H7 | 179.4° | 180.0° |
| C21 | C22 | C23 | C20 | 0.0° | 0.0° |
| C21 | C22 | C23 | S26 | 179.9° | 179.6° |
| C21 | C22 | C23 | N24 | 179.9° | 180.0° |
| C21 | C22 | S26 | C25 | 180.0° | 180.0° |
| N4 | C3 | C2 | C1 | 0.0° | 0.3° |
| N4 | C3 | C2 | C5 | 177.9° | 180.0° |
| N4 | C3 | C5 | C10 | 32.6° | 0.0° |
| N4 | C3 | C5 | C6 | 148.4° | 179.9° |
| N4 | C3 | C2 | H7 | 180.0° | 180.0° |
| C20 | C23 | C22 | N24 | 179.9° | 180.0° |
| C20 | C23 | C22 | S26 | 179.9° | 179.6° |
| C20 | C23 | N24 | C25 | 179.9° | 180.0° |
| C23 | C20 | C19 | H6 | 180.0° | 180.0° |
| C1 | C2 | C3 | H7 | 180.0° | 179.7° |
| C1 | C2 | C3 | C5 | 177.8° | 179.7° |
| C2 | C3 | C5 | C10 | 145.4° | 180.0° |
| C2 | C3 | C5 | C6 | 33.7° | 0.0° |
| C3 | C2 | C1 | H8 | 179.4° | 179.8° |
| C3 | C5 | C10 | C6 | 179.0° | 179.9° |
| C3 | C5 | C10 | C9 | 179.4° | 179.5° |
| C3 | C5 | C6 | C7 | 179.1° | 179.9° |
| C3 | C5 | C6 | H1 | 0.9° | 0.2° |
| C3 | C5 | C10 | H2 | 0.6° | 0.3° |
| C5 | C3 | C2 | H7 | 2.2° | 0.0° |
| C23 | C22 | S26 | C25 | 0.1° | 0.5° |
| C22 | C23 | N24 | C25 | 0.2° | 0.1° |
| C22 | C23 | C20 | H3 | 180.0° | 180.0° |
| C23 | C22 | C21 | H9 | 179.9° | 179.9° |
| S26 | C22 | C23 | N24 | 0.0° | 0.4° |
| C22 | S26 | C25 | N24 | 0.3° | 0.5° |
| C22 | S26 | C25 | N27 | 179.9° | 179.8° |
| S26 | C22 | C21 | H9 | 0.0° | 0.6° |
| C23 | N24 | C25 | S26 | 0.3° | 0.3° |
| C23 | N24 | C25 | N27 | 179.9° | 180.0° |
| N24 | C23 | C20 | H3 | 0.1° | 0.1° |
| C5 | C10 | C9 | H2 | 180.0° | 179.1° |
| C10 | C5 | C6 | C7 | 0.1° | 0.0° |
| C5 | C10 | C9 | C8 | 0.4° | 0.9° |
| C10 | C5 | C6 | H1 | 179.9° | 179.7° |
| C5 | C10 | C9 | H5 | 179.6° | 179.1° |
| C6 | C5 | C10 | C9 | 0.4° | 0.6° |
| C5 | C6 | C7 | H1 | 180.0° | 179.7° |
| C5 | C6 | C7 | C8 | 0.2° | 0.3° |
| C6 | C5 | C10 | H2 | 179.6° | 179.7° |
| C5 | C6 | C7 | H4 | 179.8° | 179.8° |
| C10 | C9 | C8 | H5 | 180.0° | 180.0° |
| C10 | C9 | C8 | C7 | 0.0° | 0.6° |
| C10 | C9 | C8 | F17 | 179.9° | 179.5° |
| C6 | C7 | C8 | C9 | 0.2° | 0.0° |
| C6 | C7 | C8 | H4 | 180.0° | 179.9° |
| C6 | C7 | C8 | F17 | 179.6° | 179.9° |
| S26 | C25 | N24 | N27 | 179.8° | 179.7° |
| S26 | C25 | N27 | C28 | 6.9° | 179.5° |
| S26 | C25 | N27 | H22 | 173.1° | 0.4° |
| N24 | C25 | N27 | C28 | 173.3° | 0.1° |
| N24 | C25 | N27 | H22 | 6.7° | 180.0° |
| C9 | C8 | C7 | F17 | 179.8° | 180.0° |
| C8 | C9 | C10 | H2 | 179.6° | 180.0° |
| C9 | C8 | C7 | H4 | 179.8° | 179.9° |
| C8 | C7 | C6 | H1 | 179.8° | 180.0° |
| C7 | C8 | C9 | H5 | 179.9° | 179.4° |
| C25 | N27 | C28 | H22 | 180.0° | 179.9° |
| C25 | N27 | C28 | O30 | 17.4° | 0.1° |
| C25 | N27 | C28 | N29 | 163.0° | 180.0° |
| F17 | C8 | C7 | H4 | 0.4° | 0.0° |
| F17 | C8 | C9 | H5 | 0.1° | 0.6° |
| N27 | C28 | O30 | N29 | 179.5° | 180.0° |
| N27 | C28 | N29 | C31 | 162.5° | 180.0° |
| N27 | C28 | N29 | H23 | 17.5° | 0.1° |
| O30 | C28 | N29 | C31 | 17.1° | 0.0° |
| O30 | C28 | N27 | H22 | 162.6° | 179.9° |
| O30 | C28 | N29 | H23 | 162.9° | 180.0° |
| C28 | N29 | C31 | H23 | 180.0° | 179.9° |
| C28 | N29 | C31 | C32 | 79.7° | 180.0° |
| C28 | N29 | C31 | H18 | 40.4° | 60.0° |
| C28 | N29 | C31 | H19 | 160.2° | 60.0° |
| N29 | C28 | N27 | H22 | 17.0° | 0.1° |
| N29 | C31 | C32 | H18 | 120.1° | 120.0° |
| N29 | C31 | C32 | H19 | 120.1° | 120.0° |
| N29 | C31 | C32 | N33 | 159.3° | 180.0° |
| N29 | C31 | H18 | H19 | 119.8° | 120.0° |
| N29 | C31 | C32 | H20 | 39.7° | 60.0° |
| N29 | C31 | C32 | H21 | 81.0° | 59.9° |
| C31 | C32 | N33 | H20 | 119.6° | 119.9° |
| C31 | C32 | N33 | H21 | 119.6° | 120.0° |
| C31 | C32 | N33 | C34 | 147.7° | 170.0° |
| C31 | C32 | N33 | C38 | 82.9° | 66.3° |
| C32 | C31 | H18 | H19 | 119.7° | 120.0° |
| C31 | C32 | H20 | H21 | 121.1° | 119.9° |
| C32 | C31 | N29 | H23 | 100.3° | 0.1° |
| C32 | N33 | C34 | C38 | 127.8° | 123.8° |
| C32 | N33 | C34 | C35 | 176.1° | 177.6° |
| C32 | N33 | C38 | C37 | 179.6° | 177.6° |
| C32 | N33 | C34 | H10 | 56.2° | 57.6° |
| C32 | N33 | C34 | H11 | 63.9° | 62.4° |
| C32 | N33 | C38 | H12 | 60.2° | 62.5° |
| C32 | N33 | C38 | H13 | 60.9° | 57.7° |
| N33 | C32 | C31 | H18 | 80.5° | 60.0° |
| N33 | C32 | C31 | H19 | 39.2° | 60.0° |
| N33 | C32 | H20 | H21 | 121.1° | 120.1° |
| N33 | C34 | C35 | H10 | 120.0° | 120.0° |
| N33 | C34 | C35 | H11 | 120.0° | 120.0° |
| N33 | C34 | C35 | O36 | 52.8° | 56.9° |
| C34 | N33 | C38 | C37 | 53.3° | 58.6° |
| N33 | C34 | H10 | H11 | 120.0° | 120.1° |
| C34 | N33 | C38 | H12 | 172.8° | 61.3° |
| C34 | N33 | C38 | H13 | 66.1° | 178.5° |
| N33 | C34 | C35 | H14 | 172.6° | 176.8° |
| N33 | C34 | C35 | H15 | 67.0° | 63.1° |
| C34 | N33 | C32 | H20 | 92.6° | 70.1° |
| C34 | N33 | C32 | H21 | 28.1° | 50.0° |
| C38 | N33 | C34 | C35 | 48.3° | 58.6° |
| N33 | C38 | C37 | H12 | 119.4° | 119.9° |
| N33 | C38 | C37 | H13 | 119.4° | 120.0° |
| N33 | C38 | C37 | O36 | 63.8° | 56.8° |
| C38 | N33 | C34 | H10 | 71.6° | 178.6° |
| C38 | N33 | C34 | H11 | 168.3° | 61.4° |
| N33 | C38 | H12 | H13 | 121.6° | 120.2° |
| N33 | C38 | C37 | H16 | 55.7° | 63.1° |
| N33 | C38 | C37 | H17 | 176.7° | 176.8° |
| C38 | N33 | C32 | H20 | 36.7° | 53.6° |
| C38 | N33 | C32 | H21 | 157.5° | 173.6° |
| C34 | C35 | O36 | H14 | 119.8° | 119.9° |
| C34 | C35 | O36 | H15 | 119.8° | 119.9° |
| C34 | C35 | O36 | C37 | 68.3° | 58.7° |
| C35 | C34 | H10 | H11 | 120.0° | 120.1° |
| C34 | C35 | H14 | H15 | 120.5° | 120.0° |
| C35 | O36 | C37 | C38 | 74.6° | 58.7° |
| O36 | C35 | C34 | H10 | 67.2° | 176.8° |
| O36 | C35 | C34 | H11 | 172.8° | 63.1° |
| O36 | C35 | H14 | H15 | 120.5° | 120.2° |
| C35 | O36 | C37 | H16 | 44.8° | 61.2° |
| C35 | O36 | C37 | H17 | 165.9° | 178.6° |
| C38 | C37 | O36 | H16 | 119.5° | 119.9° |
| C38 | C37 | O36 | H17 | 119.5° | 119.9° |
| C37 | C38 | H12 | H13 | 121.6° | 120.1° |
| C38 | C37 | H16 | H17 | 121.5° | 120.1° |
| O36 | C37 | C38 | H12 | 176.8° | 63.1° |
| O36 | C37 | C38 | H13 | 55.6° | 176.8° |
| C37 | O36 | C35 | H14 | 171.9° | 178.6° |
| C37 | O36 | C35 | H15 | 51.5° | 61.3° |
| O36 | C37 | H16 | H17 | 121.5° | 120.1° |
| H1 | C6 | C7 | H4 | 0.2° | 0.1° |
| H2 | C10 | C9 | H5 | 0.4° | 0.1° |
| H3 | C20 | C19 | H6 | 0.0° | 0.3° |
| H7 | C2 | C1 | H8 | 0.6° | 0.1° |
| H10 | C34 | C35 | H14 | 52.6° | 63.3° |
| H10 | C34 | C35 | H15 | 173.0° | 56.8° |
| H11 | C34 | C35 | H14 | 67.4° | 56.8° |
| H11 | C34 | C35 | H15 | 53.0° | 176.9° |
| H12 | C38 | C37 | H16 | 63.8° | 177.0° |
| H12 | C38 | C37 | H17 | 57.3° | 56.8° |
| H13 | C38 | C37 | H16 | 175.1° | 56.9° |
| H13 | C38 | C37 | H17 | 63.9° | 63.3° |
| H18 | C31 | C32 | H20 | 159.8° | 60.0° |
| H18 | C31 | C32 | H21 | 39.1° | 179.9° |
| H18 | C31 | N29 | H23 | 139.7° | 120.0° |
| H19 | C31 | C32 | H20 | 80.4° | 180.0° |
| H19 | C31 | C32 | H21 | 158.9° | 60.1° |
| H19 | C31 | N29 | H23 | 19.9° | 120.1° |
