JV2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | S2 | sing | 1.81Å | 1.74Å | |
| S2 | C3 | sing | 1.76Å | 1.76Å | |
| O19 | C18 | doub | 1.22Å | 1.24Å | |
| C3 | C4 | doub | 1.39Å | 1.41Å | Aromatic |
| C3 | C8 | sing | 1.39Å | 1.42Å | Aromatic |
| C21 | N20 | sing | 1.47Å | 1.44Å | |
| C21 | C22 | sing | 1.51Å | 1.53Å | |
| C18 | N20 | sing | 1.35Å | 1.34Å | |
| C18 | N17 | sing | 1.35Å | 1.34Å | |
| C4 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.54Å | 1.54Å | |
| C10 | C11 | sing | 1.55Å | 1.53Å | |
| C9 | C8 | sing | 1.51Å | 1.54Å | |
| C9 | N13 | sing | 1.47Å | 1.46Å | |
| C16 | N17 | sing | 1.47Å | 1.44Å | |
| C16 | C14 | sing | 1.51Å | 1.53Å | |
| C23 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| N13 | C14 | sing | 1.35Å | 1.34Å | |
| N13 | C12 | sing | 1.47Å | 1.46Å | |
| C25 | C24 | sing | 1.51Å | 1.52Å | |
| C25 | C26 | sing | 1.53Å | 1.54Å | |
| C25 | O36 | sing | 1.44Å | 1.46Å | |
| C5 | C6 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | O15 | doub | 1.21Å | 1.23Å | |
| C24 | C29 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.55Å | 1.54Å | |
| C31 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.53Å | 1.53Å | |
| C7 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| O36 | C35 | sing | 1.43Å | 1.44Å | |
| C29 | C30 | sing | 1.39Å | 1.40Å | Aromatic |
| C29 | N28 | sing | 1.40Å | 1.41Å | |
| C27 | N28 | sing | 1.47Å | 1.48Å | |
| C27 | C32 | sing | 1.53Å | 1.53Å | |
| C35 | C32 | sing | 1.53Å | 1.53Å | |
| C32 | O34 | sing | 1.43Å | 1.44Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.08Å | 1.08Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C30 | H18 | sing | 1.08Å | 1.08Å | |
| C31 | H19 | sing | 1.08Å | 1.08Å | |
| C32 | H20 | sing | 1.09Å | 1.10Å | |
| C35 | H21 | sing | 1.09Å | 1.10Å | |
| C35 | H22 | sing | 1.09Å | 1.10Å | |
| C9 | H23 | sing | 1.09Å | 1.10Å | |
| C10 | H24 | sing | 1.09Å | 1.10Å | |
| C10 | H25 | sing | 1.09Å | 1.10Å | |
| N17 | H26 | sing | 0.97Å | 1.00Å | |
| N20 | H27 | sing | 0.97Å | 1.00Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| N28 | H31 | sing | 0.97Å | 1.00Å | |
| O34 | H32 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | S2 | C3 | 96.5° | 103.0° |
| S2 | C1 | H1 | 109.5° | 109.5° |
| S2 | C1 | H2 | 109.5° | 109.5° |
| S2 | C1 | H3 | 109.5° | 109.5° |
| S2 | C3 | C4 | 120.0° | 120.1° |
| S2 | C3 | C8 | 119.8° | 120.1° |
| O19 | C18 | N20 | 122.8° | 120.0° |
| O19 | C18 | N17 | 121.5° | 120.0° |
| C4 | C3 | C8 | 120.2° | 119.8° |
| C3 | C4 | C5 | 120.8° | 119.9° |
| C3 | C4 | H4 | 119.6° | 120.0° |
| C3 | C8 | C9 | 122.0° | 120.0° |
| C3 | C8 | C7 | 117.3° | 120.0° |
| N20 | C21 | C22 | 110.8° | 109.5° |
| C21 | N20 | C18 | 123.3° | 120.0° |
| N20 | C21 | H14 | 109.1° | 109.4° |
| N20 | C21 | H15 | 109.1° | 109.5° |
| C21 | N20 | H27 | 118.4° | 120.0° |
| C21 | C22 | C23 | 120.4° | 119.9° |
| C21 | C22 | C31 | 120.7° | 119.9° |
| C22 | C21 | H14 | 109.2° | 109.5° |
| C22 | C21 | H15 | 109.1° | 109.5° |
| N20 | C18 | N17 | 115.7° | 120.0° |
| C18 | N20 | H27 | 118.3° | 120.0° |
| C18 | N17 | C16 | 119.0° | 119.9° |
| C18 | N17 | H26 | 120.5° | 120.0° |
| C4 | C5 | C6 | 119.1° | 120.1° |
| C5 | C4 | H4 | 119.6° | 120.0° |
| C4 | C5 | H5 | 120.4° | 120.0° |
| C9 | C10 | C11 | 101.4° | 102.9° |
| C10 | C9 | C8 | 110.3° | 109.8° |
| C10 | C9 | N13 | 105.3° | 107.3° |
| C10 | C9 | H23 | 108.5° | 110.0° |
| C9 | C10 | H24 | 111.4° | 110.7° |
| C9 | C10 | H25 | 111.4° | 110.7° |
| C10 | C11 | C12 | 102.9° | 101.6° |
| C10 | C11 | H8 | 111.1° | 111.0° |
| C10 | C11 | H9 | 111.1° | 111.1° |
| C11 | C10 | H24 | 111.5° | 110.7° |
| C11 | C10 | H25 | 111.5° | 110.7° |
| C8 | C9 | N13 | 114.7° | 109.9° |
| C9 | C8 | C7 | 120.5° | 120.0° |
| C8 | C9 | H23 | 108.4° | 109.9° |
| C9 | N13 | C14 | 127.2° | 125.6° |
| C9 | N13 | C12 | 110.0° | 108.7° |
| N13 | C9 | H23 | 109.4° | 109.9° |
| N17 | C16 | C14 | 106.2° | 109.5° |
| N17 | C16 | H12 | 110.3° | 109.5° |
| N17 | C16 | H13 | 110.3° | 109.5° |
| C16 | N17 | H26 | 120.5° | 120.0° |
| C16 | C14 | N13 | 117.7° | 120.0° |
| C16 | C14 | O15 | 124.0° | 120.0° |
| C14 | C16 | H12 | 110.3° | 109.4° |
| C14 | C16 | H13 | 110.3° | 109.5° |
| C22 | C23 | C24 | 120.9° | 120.1° |
| C23 | C22 | C31 | 118.8° | 120.2° |
| C22 | C23 | H16 | 119.6° | 120.0° |
| C23 | C24 | C25 | 119.5° | 119.1° |
| C23 | C24 | C29 | 120.0° | 119.8° |
| C24 | C23 | H16 | 119.6° | 119.9° |
| C8 | C7 | C6 | 122.6° | 120.1° |
| C8 | C7 | H7 | 118.7° | 120.0° |
| C22 | C31 | C30 | 121.1° | 120.0° |
| C22 | C31 | H19 | 119.5° | 120.0° |
| C14 | N13 | C12 | 122.8° | 125.6° |
| N13 | C14 | O15 | 118.3° | 120.0° |
| N13 | C12 | C11 | 104.6° | 104.8° |
| N13 | C12 | H10 | 110.7° | 110.4° |
| N13 | C12 | H11 | 110.7° | 110.4° |
| C24 | C25 | C26 | 109.1° | 109.4° |
| C24 | C25 | O36 | 111.4° | 107.7° |
| C25 | C24 | C29 | 120.4° | 121.0° |
| C24 | C25 | H28 | 110.1° | 110.3° |
| C26 | C25 | O36 | 105.2° | 107.9° |
| C25 | C26 | C27 | 108.9° | 108.0° |
| C26 | C25 | H28 | 109.9° | 110.2° |
| C25 | C26 | H29 | 109.6° | 109.7° |
| C25 | C26 | H30 | 109.6° | 109.7° |
| C25 | O36 | C35 | 117.3° | 112.6° |
| O36 | C25 | H28 | 111.0° | 111.2° |
| C5 | C6 | C7 | 120.0° | 120.1° |
| C6 | C5 | H5 | 120.5° | 120.0° |
| C5 | C6 | H6 | 120.0° | 119.9° |
| C24 | C29 | C30 | 119.6° | 119.8° |
| C24 | C29 | N28 | 120.7° | 121.0° |
| C12 | C11 | H8 | 111.1° | 111.0° |
| C12 | C11 | H9 | 111.1° | 111.0° |
| C11 | C12 | H10 | 110.7° | 110.4° |
| C11 | C12 | H11 | 110.7° | 110.4° |
| C31 | C30 | C29 | 119.6° | 120.0° |
| C31 | C30 | H18 | 120.2° | 120.0° |
| C30 | C31 | H19 | 119.4° | 120.0° |
| C26 | C27 | N28 | 108.6° | 108.3° |
| C26 | C27 | C32 | 110.1° | 109.5° |
| C26 | C27 | H17 | 109.1° | 109.6° |
| C27 | C26 | H29 | 109.6° | 109.7° |
| C27 | C26 | H30 | 109.6° | 109.8° |
| C7 | C6 | H6 | 120.0° | 120.0° |
| C6 | C7 | H7 | 118.7° | 119.9° |
| O36 | C35 | C32 | 111.3° | 109.6° |
| O36 | C35 | H21 | 109.0° | 109.4° |
| O36 | C35 | H22 | 109.0° | 109.5° |
| C30 | C29 | N28 | 119.6° | 119.2° |
| C29 | C30 | H18 | 120.2° | 120.0° |
| C29 | N28 | C27 | 121.1° | 119.7° |
| C29 | N28 | H31 | 106.5° | 120.2° |
| N28 | C27 | C32 | 110.0° | 110.5° |
| N28 | C27 | H17 | 109.9° | 109.5° |
| C27 | N28 | H31 | 106.5° | 120.2° |
| C27 | C32 | C35 | 111.3° | 110.1° |
| C27 | C32 | O34 | 108.7° | 109.4° |
| C32 | C27 | H17 | 109.1° | 109.5° |
| C27 | C32 | H20 | 108.6° | 109.4° |
| C35 | C32 | O34 | 109.7° | 109.3° |
| C35 | C32 | H20 | 108.7° | 109.2° |
| C32 | C35 | H21 | 109.0° | 109.4° |
| C32 | C35 | H22 | 109.0° | 109.5° |
| O34 | C32 | H20 | 109.9° | 109.4° |
| C32 | O34 | H32 | 109.5° | 114.0° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.4° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H8 | C11 | H9 | 109.4° | 110.8° |
| H10 | C12 | H11 | 109.5° | 110.3° |
| H12 | C16 | H13 | 109.5° | 109.5° |
| H14 | C21 | H15 | 109.5° | 109.5° |
| H21 | C35 | H22 | 109.5° | 109.4° |
| H24 | C10 | H25 | 109.5° | 110.8° |
| H29 | C26 | H30 | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | S2 | C3 | C4 | 109.8° | 0.0° |
| C1 | S2 | C3 | C8 | 70.6° | 179.8° |
| S2 | C1 | H1 | H2 | 120.0° | 120.1° |
| S2 | C1 | H1 | H3 | 120.0° | 120.0° |
| S2 | C1 | H2 | H3 | 120.0° | 120.0° |
| S2 | C3 | C4 | C8 | 179.6° | 179.8° |
| S2 | C3 | C4 | C5 | 179.2° | 179.7° |
| S2 | C3 | C8 | C9 | 1.6° | 0.2° |
| S2 | C3 | C8 | C7 | 177.0° | 179.7° |
| C3 | S2 | C1 | H1 | 180.0° | 59.9° |
| C3 | S2 | C1 | H2 | 60.0° | 180.0° |
| C3 | S2 | C1 | H3 | 60.0° | 60.0° |
| S2 | C3 | C4 | H4 | 0.8° | 0.2° |
| O19 | C18 | N20 | C21 | 0.0° | 0.0° |
| O19 | C18 | N20 | N17 | 179.5° | 180.0° |
| O19 | C18 | N17 | C16 | 6.1° | 0.0° |
| O19 | C18 | N17 | H26 | 173.9° | 180.0° |
| O19 | C18 | N20 | H27 | 180.0° | 180.0° |
| C3 | C4 | C5 | H4 | 180.0° | 179.9° |
| C4 | C3 | C8 | C9 | 178.0° | 180.0° |
| C4 | C3 | C8 | C7 | 2.6° | 0.1° |
| C3 | C4 | C5 | C6 | 1.6° | 0.1° |
| C3 | C4 | C5 | H5 | 178.5° | 180.0° |
| C8 | C3 | C4 | C5 | 0.4° | 0.1° |
| C3 | C8 | C9 | C10 | 74.0° | 87.2° |
| C3 | C8 | C9 | C7 | 175.3° | 180.0° |
| C3 | C8 | C9 | N13 | 167.3° | 155.0° |
| C3 | C8 | C7 | C6 | 2.9° | 0.0° |
| C8 | C3 | C4 | H4 | 179.6° | 180.0° |
| C3 | C8 | C7 | H7 | 177.1° | 179.9° |
| C3 | C8 | C9 | H23 | 44.7° | 33.9° |
| N20 | C21 | C22 | H14 | 120.2° | 120.0° |
| N20 | C21 | C22 | H15 | 120.2° | 120.0° |
| C21 | N20 | C18 | H27 | 180.0° | 180.0° |
| C21 | N20 | C18 | N17 | 179.4° | 180.0° |
| N20 | C21 | C22 | C23 | 134.8° | 90.0° |
| N20 | C21 | C22 | C31 | 48.2° | 90.0° |
| N20 | C21 | H14 | H15 | 119.4° | 120.0° |
| C22 | C21 | N20 | C18 | 131.2° | 180.0° |
| C21 | C22 | C23 | C31 | 177.0° | 180.0° |
| C21 | C22 | C23 | C24 | 176.5° | 180.0° |
| C21 | C22 | C31 | C30 | 177.3° | 179.8° |
| C22 | C21 | H14 | H15 | 119.4° | 120.0° |
| C21 | C22 | C23 | H16 | 3.5° | 0.3° |
| C21 | C22 | C31 | H19 | 2.7° | 0.2° |
| C22 | C21 | N20 | H27 | 48.8° | 0.0° |
| N20 | C18 | N17 | C16 | 174.4° | 180.0° |
| C18 | N20 | C21 | H14 | 108.6° | 60.0° |
| C18 | N20 | C21 | H15 | 11.0° | 60.0° |
| N20 | C18 | N17 | H26 | 5.6° | 0.0° |
| C18 | N17 | C16 | H26 | 180.0° | 180.0° |
| C18 | N17 | C16 | C14 | 83.8° | 180.0° |
| C18 | N17 | C16 | H12 | 35.7° | 60.0° |
| C18 | N17 | C16 | H13 | 156.7° | 60.0° |
| N17 | C18 | N20 | H27 | 0.6° | 0.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 1.3° | 0.0° |
| C4 | C5 | C6 | H6 | 178.7° | 179.9° |
| C9 | C10 | C11 | H24 | 118.7° | 118.4° |
| C9 | C10 | C11 | H25 | 118.7° | 118.3° |
| C10 | C9 | C8 | N13 | 118.7° | 117.8° |
| C10 | C9 | C8 | H23 | 118.6° | 121.1° |
| C10 | C9 | N13 | H23 | 116.5° | 119.6° |
| C10 | C9 | C8 | C7 | 101.3° | 92.8° |
| C10 | C9 | N13 | C14 | 164.0° | 178.9° |
| C10 | C9 | N13 | C12 | 15.2° | 1.0° |
| C9 | C10 | C11 | C12 | 39.2° | 35.5° |
| C9 | C10 | C11 | H8 | 158.2° | 153.6° |
| C9 | C10 | C11 | H9 | 79.7° | 82.6° |
| C9 | C10 | H24 | H25 | 123.7° | 123.3° |
| C11 | C10 | C9 | C8 | 90.4° | 141.6° |
| C11 | C10 | C9 | N13 | 33.9° | 22.2° |
| C10 | C11 | C12 | N13 | 31.0° | 37.0° |
| C10 | C11 | C12 | H8 | 119.0° | 118.1° |
| C10 | C11 | C12 | H9 | 119.0° | 118.2° |
| C10 | C11 | H8 | H9 | 123.1° | 123.9° |
| C10 | C11 | C12 | H10 | 150.2° | 155.9° |
| C10 | C11 | C12 | H11 | 88.3° | 81.9° |
| C11 | C10 | C9 | H23 | 151.0° | 97.3° |
| C11 | C10 | H24 | H25 | 123.8° | 123.3° |
| C8 | C9 | N13 | H23 | 122.1° | 121.1° |
| C8 | C9 | N13 | C14 | 74.6° | 61.7° |
| C8 | C9 | N13 | C12 | 106.3° | 118.4° |
| C9 | C8 | C7 | C6 | 178.4° | 180.0° |
| C9 | C8 | C7 | H7 | 1.6° | 0.0° |
| C8 | C9 | C10 | H24 | 150.9° | 23.3° |
| C8 | C9 | C10 | H25 | 28.3° | 100.0° |
| C9 | N13 | C14 | C16 | 1.3° | 180.0° |
| N13 | C9 | C8 | C7 | 17.4° | 25.0° |
| C9 | N13 | C14 | C12 | 179.0° | 179.9° |
| C9 | N13 | C14 | O15 | 179.9° | 0.1° |
| C9 | N13 | C12 | C11 | 9.9° | 24.1° |
| C9 | N13 | C12 | H10 | 129.1° | 143.0° |
| C9 | N13 | C12 | H11 | 109.4° | 94.8° |
| N13 | C9 | C10 | H24 | 84.8° | 96.1° |
| N13 | C9 | C10 | H25 | 152.6° | 140.5° |
| N17 | C16 | C14 | H12 | 119.5° | 120.0° |
| N17 | C16 | C14 | H13 | 119.5° | 120.0° |
| N17 | C16 | C14 | N13 | 169.2° | 180.0° |
| N17 | C16 | C14 | O15 | 12.3° | 0.0° |
| N17 | C16 | H12 | H13 | 121.5° | 120.0° |
| C16 | C14 | N13 | O15 | 178.6° | 180.0° |
| C16 | C14 | N13 | C12 | 179.6° | 0.1° |
| C14 | C16 | H12 | H13 | 121.5° | 120.0° |
| C14 | C16 | N17 | H26 | 96.2° | 0.0° |
| C22 | C23 | C24 | H16 | 180.0° | 179.7° |
| C22 | C23 | C24 | C25 | 177.9° | 179.0° |
| C22 | C23 | C24 | C29 | 1.4° | 0.4° |
| C23 | C22 | C31 | C30 | 0.3° | 0.2° |
| C23 | C22 | C21 | H14 | 14.6° | 30.0° |
| C23 | C22 | C21 | H15 | 105.0° | 150.0° |
| C23 | C22 | C31 | H19 | 179.7° | 179.8° |
| C24 | C23 | C22 | C31 | 0.5° | 0.0° |
| C23 | C24 | C25 | C29 | 176.5° | 179.4° |
| C23 | C24 | C25 | C26 | 153.7° | 154.9° |
| C23 | C24 | C25 | O36 | 90.6° | 88.0° |
| C23 | C24 | C29 | C30 | 1.6° | 0.6° |
| C23 | C24 | C29 | N28 | 179.3° | 178.8° |
| C23 | C24 | C25 | H28 | 33.0° | 33.5° |
| C8 | C7 | C6 | C5 | 1.0° | 0.0° |
| C8 | C7 | C6 | H7 | 180.0° | 180.0° |
| C8 | C7 | C6 | H6 | 179.0° | 179.9° |
| C7 | C8 | C9 | H23 | 140.1° | 146.0° |
| C22 | C31 | C30 | H19 | 180.0° | 180.0° |
| C22 | C31 | C30 | C29 | 0.1° | 0.0° |
| C31 | C22 | C21 | H14 | 168.4° | 150.0° |
| C31 | C22 | C21 | H15 | 72.0° | 30.0° |
| C31 | C22 | C23 | H16 | 179.5° | 179.7° |
| C22 | C31 | C30 | H18 | 179.9° | 180.0° |
| C14 | N13 | C12 | C11 | 170.9° | 155.8° |
| C14 | N13 | C12 | H10 | 51.7° | 36.9° |
| C14 | N13 | C12 | H11 | 69.8° | 85.3° |
| N13 | C14 | C16 | H12 | 49.7° | 60.0° |
| N13 | C14 | C16 | H13 | 71.3° | 60.0° |
| C14 | N13 | C9 | H23 | 47.5° | 59.3° |
| C12 | N13 | C14 | O15 | 1.0° | 179.9° |
| N13 | C12 | C11 | H10 | 119.2° | 118.9° |
| N13 | C12 | C11 | H11 | 119.3° | 118.9° |
| N13 | C12 | C11 | H8 | 149.9° | 155.1° |
| N13 | C12 | C11 | H9 | 88.0° | 81.2° |
| N13 | C12 | H10 | H11 | 122.3° | 122.3° |
| C12 | N13 | C9 | H23 | 131.6° | 120.6° |
| C24 | C25 | C26 | O36 | 119.7° | 116.9° |
| C24 | C25 | C26 | H28 | 120.8° | 121.5° |
| C24 | C25 | O36 | H28 | 123.0° | 120.9° |
| C24 | C25 | C26 | C27 | 57.3° | 55.4° |
| C24 | C25 | O36 | C35 | 56.0° | 52.4° |
| C25 | C24 | C29 | C30 | 178.0° | 178.8° |
| C25 | C24 | C29 | N28 | 4.3° | 1.9° |
| C25 | C24 | C23 | H16 | 2.1° | 1.3° |
| C24 | C25 | C26 | H29 | 177.2° | 64.3° |
| C24 | C25 | C26 | H30 | 62.6° | 175.0° |
| C26 | C25 | O36 | H28 | 118.8° | 121.0° |
| C26 | C25 | C24 | C29 | 29.9° | 25.7° |
| C25 | C26 | C27 | H29 | 119.9° | 119.6° |
| C25 | C26 | C27 | H30 | 119.9° | 119.6° |
| C26 | C25 | O36 | C35 | 62.2° | 65.6° |
| C25 | C26 | C27 | N28 | 60.1° | 63.1° |
| C25 | C26 | C27 | C32 | 60.4° | 57.4° |
| C25 | C26 | C27 | H17 | 179.9° | 177.5° |
| C25 | C26 | H29 | H30 | 120.2° | 120.7° |
| O36 | C25 | C24 | C29 | 85.9° | 91.4° |
| O36 | C25 | C26 | C27 | 62.4° | 61.6° |
| C25 | O36 | C35 | C32 | 55.1° | 62.3° |
| C25 | O36 | C35 | H21 | 65.2° | 177.7° |
| C25 | O36 | C35 | H22 | 175.4° | 57.8° |
| O36 | C25 | C26 | H29 | 57.5° | 178.8° |
| O36 | C25 | C26 | H30 | 177.7° | 58.1° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C6 | C5 | C4 | H4 | 178.4° | 180.0° |
| C5 | C6 | C7 | H7 | 179.0° | 180.0° |
| O15 | C14 | C16 | H12 | 131.8° | 120.0° |
| O15 | C14 | C16 | H13 | 107.2° | 120.0° |
| C24 | C29 | C30 | C31 | 0.8° | 0.4° |
| C24 | C29 | C30 | N28 | 177.7° | 179.3° |
| C24 | C29 | N28 | C27 | 7.4° | 10.0° |
| C29 | C24 | C23 | H16 | 178.6° | 179.3° |
| C24 | C29 | C30 | H18 | 179.1° | 179.6° |
| C29 | C24 | C25 | H28 | 150.5° | 147.1° |
| C24 | C29 | N28 | H31 | 114.2° | 170.1° |
| C12 | C11 | H8 | H9 | 123.1° | 123.9° |
| C11 | C12 | H10 | H11 | 122.2° | 122.3° |
| C12 | C11 | C10 | H24 | 79.4° | 82.9° |
| C12 | C11 | C10 | H25 | 157.9° | 153.8° |
| C31 | C30 | C29 | H18 | 180.0° | 179.9° |
| C31 | C30 | C29 | N28 | 178.6° | 179.0° |
| C26 | C27 | N28 | C29 | 35.5° | 40.8° |
| C26 | C27 | N28 | C32 | 120.5° | 119.9° |
| C26 | C27 | N28 | H17 | 119.3° | 119.4° |
| C26 | C27 | C32 | H17 | 119.7° | 120.2° |
| C26 | C27 | C32 | C35 | 51.4° | 54.4° |
| C26 | C27 | C32 | O34 | 69.5° | 65.8° |
| C26 | C27 | C32 | H20 | 171.0° | 174.5° |
| C27 | C26 | C25 | H28 | 178.1° | 176.9° |
| C27 | C26 | H29 | H30 | 120.3° | 120.7° |
| C26 | C27 | N28 | H31 | 86.1° | 139.3° |
| C7 | C6 | C5 | H5 | 178.7° | 179.9° |
| O36 | C35 | C32 | C27 | 46.8° | 55.3° |
| O36 | C35 | C32 | H21 | 120.3° | 120.0° |
| O36 | C35 | C32 | H22 | 120.3° | 120.1° |
| O36 | C35 | C32 | O34 | 73.6° | 64.8° |
| O36 | C35 | C32 | H20 | 166.3° | 175.5° |
| O36 | C35 | H21 | H22 | 119.2° | 119.9° |
| C35 | O36 | C25 | H28 | 179.0° | 173.4° |
| C30 | C29 | N28 | C27 | 174.9° | 170.7° |
| C29 | C30 | C31 | H19 | 179.9° | 180.0° |
| C30 | C29 | N28 | H31 | 63.5° | 9.3° |
| C29 | N28 | C27 | H31 | 121.6° | 179.9° |
| C29 | N28 | C27 | C32 | 85.0° | 79.1° |
| C29 | N28 | C27 | H17 | 154.8° | 160.2° |
| N28 | C29 | C30 | H18 | 1.4° | 1.1° |
| N28 | C27 | C32 | H17 | 120.7° | 120.7° |
| N28 | C27 | C32 | C35 | 68.2° | 64.7° |
| N28 | C27 | C32 | O34 | 170.9° | 175.1° |
| N28 | C27 | C32 | H20 | 51.4° | 55.3° |
| N28 | C27 | C26 | H29 | 180.0° | 56.5° |
| N28 | C27 | C26 | H30 | 59.8° | 177.2° |
| C27 | C32 | C35 | O34 | 120.4° | 120.2° |
| C27 | C32 | C35 | H20 | 119.5° | 120.1° |
| C27 | C32 | O34 | H20 | 118.7° | 119.7° |
| C27 | C32 | C35 | H21 | 73.5° | 175.4° |
| C27 | C32 | C35 | H22 | 167.0° | 64.7° |
| C32 | C27 | C26 | H29 | 59.5° | 177.0° |
| C32 | C27 | C26 | H30 | 179.7° | 62.3° |
| C32 | C27 | N28 | H31 | 153.4° | 100.8° |
| C27 | C32 | O34 | H32 | 180.0° | 180.0° |
| C35 | C32 | O34 | H20 | 119.4° | 119.6° |
| C35 | C32 | C27 | H17 | 171.2° | 174.6° |
| C32 | C35 | H21 | H22 | 119.2° | 119.9° |
| C35 | C32 | O34 | H32 | 58.1° | 59.4° |
| O34 | C32 | C27 | H17 | 50.2° | 54.4° |
| O34 | C32 | C35 | H21 | 166.2° | 55.2° |
| O34 | C32 | C35 | H22 | 46.7° | 175.1° |
| H1 | C1 | H2 | H3 | 120.0° | 119.9° |
| H4 | C4 | C5 | H5 | 1.6° | 0.1° |
| H5 | C5 | C6 | H6 | 1.3° | 0.0° |
| H6 | C6 | C7 | H7 | 1.0° | 0.1° |
| H8 | C11 | C12 | H10 | 90.8° | 86.1° |
| H8 | C11 | C12 | H11 | 30.7° | 36.1° |
| H8 | C11 | C10 | H24 | 39.5° | 35.3° |
| H8 | C11 | C10 | H25 | 83.2° | 88.0° |
| H9 | C11 | C12 | H10 | 31.2° | 37.7° |
| H9 | C11 | C12 | H11 | 152.8° | 159.9° |
| H9 | C11 | C10 | H24 | 161.6° | 159.0° |
| H9 | C11 | C10 | H25 | 38.9° | 35.7° |
| H12 | C16 | N17 | H26 | 144.3° | 120.0° |
| H13 | C16 | N17 | H26 | 23.3° | 120.0° |
| H14 | C21 | N20 | H27 | 71.4° | 120.0° |
| H15 | C21 | N20 | H27 | 169.0° | 120.0° |
| H17 | C27 | C32 | H20 | 69.3° | 65.3° |
| H17 | C27 | C26 | H29 | 60.2° | 62.9° |
| H17 | C27 | C26 | H30 | 59.9° | 57.9° |
| H17 | C27 | N28 | H31 | 33.2° | 19.9° |
| H18 | C30 | C31 | H19 | 0.1° | 0.0° |
| H20 | C32 | C35 | H21 | 46.0° | 64.5° |
| H20 | C32 | C35 | H22 | 73.4° | 55.4° |
| H20 | C32 | O34 | H32 | 61.3° | 60.2° |
| H23 | C9 | C10 | H24 | 32.3° | 144.3° |
| H23 | C9 | C10 | H25 | 90.3° | 21.0° |
| H28 | C25 | C26 | H29 | 62.0° | 57.2° |
| H28 | C25 | C26 | H30 | 58.2° | 63.5° |
