VYR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C34 | C35 | sing | 1.38Å | 1.34Å | Aromatic |
| C34 | C33 | doub | 1.36Å | 1.34Å | Aromatic |
| C35 | C36 | doub | 1.34Å | 1.33Å | Aromatic |
| C36 | CL | sing | 1.74Å | 1.73Å | |
| C36 | S37 | sing | 1.76Å | 1.68Å | Aromatic |
| S37 | C33 | sing | 1.76Å | 1.69Å | Aromatic |
| C33 | C31 | sing | 1.47Å | 1.39Å | |
| C31 | C32 | doub | 1.37Å | 1.33Å | Aromatic |
| C31 | O30 | sing | 1.35Å | 1.36Å | Aromatic |
| C32 | C28 | sing | 1.41Å | 1.34Å | Aromatic |
| O30 | N29 | sing | 1.21Å | 1.40Å | Aromatic |
| N29 | C28 | doub | 1.30Å | 1.33Å | Aromatic |
| C28 | C27 | sing | 1.51Å | 1.53Å | |
| C27 | C17 | sing | 1.53Å | 1.54Å | |
| C17 | C18 | sing | 1.51Å | 1.55Å | |
| C17 | N16 | sing | 1.46Å | 1.48Å | |
| C18 | O43 | doub | 1.21Å | 1.23Å | |
| C18 | N19 | sing | 1.35Å | 1.36Å | |
| N19 | C20 | sing | 1.47Å | 1.50Å | |
| N19 | C24 | sing | 1.47Å | 1.50Å | |
| C20 | C21 | sing | 1.53Å | 1.54Å | |
| C21 | C22 | sing | 1.53Å | 1.56Å | |
| C22 | O25 | sing | 1.43Å | 1.44Å | |
| C22 | C23 | sing | 1.53Å | 1.56Å | |
| O25 | C26 | sing | 1.43Å | 1.44Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| N16 | S15 | sing | 1.66Å | 1.65Å | |
| S15 | O40 | doub | 1.42Å | 1.50Å | |
| S15 | O41 | doub | 1.42Å | 1.50Å | |
| S15 | C9 | sing | 1.76Å | 1.78Å | |
| C9 | C8 | sing | 1.38Å | 1.42Å | Aromatic |
| C9 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | C13 | sing | 1.51Å | 1.55Å | |
| C8 | C7 | doub | 1.39Å | 1.42Å | Aromatic |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C10 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C7 | sing | 1.39Å | 1.40Å | Aromatic |
| C7 | N3 | sing | 1.40Å | 1.42Å | |
| N3 | C2 | sing | 1.46Å | 1.50Å | |
| N3 | C4 | sing | 1.34Å | 1.42Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C1 | O6 | sing | 1.43Å | 1.46Å | |
| O6 | C5 | sing | 1.43Å | 1.44Å | |
| C5 | C4 | sing | 1.50Å | 1.39Å | |
| C4 | O39 | doub | 1.21Å | 1.23Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| N16 | H16 | sing | 0.97Å | 1.00Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H143 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C2 | H21C | sing | 1.09Å | 1.10Å | |
| C2 | H22C | sing | 1.09Å | 1.10Å | |
| C1 | H11C | sing | 1.09Å | 1.10Å | |
| C1 | H12C | sing | 1.09Å | 1.10Å | |
| C5 | H51C | sing | 1.09Å | 1.10Å | |
| C5 | H52C | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C35 | C34 | C33 | 115.2° | 114.5° |
| C34 | C35 | C36 | 114.2° | 115.2° |
| C35 | C34 | H34 | 122.4° | 122.8° |
| C34 | C35 | H35 | 122.9° | 122.4° |
| C34 | C33 | S37 | 107.8° | 109.3° |
| C34 | C33 | C31 | 126.8° | 125.4° |
| C33 | C34 | H34 | 122.4° | 122.7° |
| C35 | C36 | CL | 124.1° | 125.0° |
| C35 | C36 | S37 | 108.9° | 110.0° |
| C36 | C35 | H35 | 122.9° | 122.4° |
| CL | C36 | S37 | 127.0° | 125.0° |
| C36 | S37 | C33 | 93.8° | 91.1° |
| S37 | C33 | C31 | 125.3° | 125.3° |
| C33 | C31 | C32 | 129.3° | 127.0° |
| C33 | C31 | O30 | 121.3° | 127.0° |
| C32 | C31 | O30 | 109.2° | 106.0° |
| C31 | C32 | C28 | 108.5° | 103.9° |
| C31 | C32 | H32 | 125.8° | 128.1° |
| C31 | O30 | N29 | 105.6° | 111.4° |
| C32 | C28 | N29 | 109.3° | 106.7° |
| C32 | C28 | C27 | 126.1° | 126.7° |
| C28 | C32 | H32 | 125.7° | 128.1° |
| O30 | N29 | C28 | 107.4° | 112.0° |
| N29 | C28 | C27 | 124.7° | 126.7° |
| C28 | C27 | C17 | 114.6° | 109.5° |
| C28 | C27 | H271 | 108.1° | 109.5° |
| C28 | C27 | H272 | 108.2° | 109.5° |
| C27 | C17 | C18 | 114.9° | 109.5° |
| C27 | C17 | N16 | 109.6° | 109.5° |
| C17 | C27 | H271 | 108.2° | 109.4° |
| C17 | C27 | H272 | 108.2° | 109.5° |
| C27 | C17 | H17 | 106.9° | 109.5° |
| C18 | C17 | N16 | 110.6° | 109.4° |
| C17 | C18 | O43 | 118.6° | 120.0° |
| C17 | C18 | N19 | 122.2° | 120.0° |
| C18 | C17 | H17 | 106.8° | 109.5° |
| C17 | N16 | S15 | 112.6° | 120.0° |
| N16 | C17 | H17 | 107.7° | 109.4° |
| C17 | N16 | H16 | 108.7° | 120.0° |
| O43 | C18 | N19 | 119.0° | 120.0° |
| C18 | N19 | C20 | 120.4° | 120.7° |
| C18 | N19 | C24 | 122.7° | 120.6° |
| C20 | N19 | C24 | 116.9° | 118.7° |
| N19 | C20 | C21 | 111.1° | 108.8° |
| N19 | C20 | H201 | 109.1° | 109.6° |
| N19 | C20 | H202 | 109.0° | 109.5° |
| N19 | C24 | C23 | 110.5° | 109.0° |
| N19 | C24 | H241 | 109.2° | 109.6° |
| N19 | C24 | H242 | 109.2° | 109.6° |
| C20 | C21 | C22 | 114.1° | 109.3° |
| C21 | C20 | H201 | 109.0° | 109.6° |
| C21 | C20 | H202 | 109.1° | 109.6° |
| C20 | C21 | H211 | 108.3° | 109.5° |
| C20 | C21 | H212 | 108.3° | 109.5° |
| C21 | C22 | O25 | 112.8° | 109.4° |
| C21 | C22 | C23 | 121.7° | 109.6° |
| C22 | C21 | H211 | 108.3° | 109.5° |
| C22 | C21 | H212 | 108.3° | 109.5° |
| C21 | C22 | H22 | 101.6° | 109.4° |
| O25 | C22 | C23 | 112.9° | 109.5° |
| C22 | O25 | C26 | 110.2° | 114.0° |
| O25 | C22 | H22 | 102.6° | 109.5° |
| C22 | C23 | C24 | 113.5° | 109.4° |
| C23 | C22 | H22 | 101.6° | 109.5° |
| C22 | C23 | H231 | 108.4° | 109.5° |
| C22 | C23 | H232 | 108.4° | 109.5° |
| O25 | C26 | H261 | 109.5° | 109.4° |
| O25 | C26 | H262 | 109.5° | 109.5° |
| O25 | C26 | H263 | 109.5° | 109.5° |
| C23 | C24 | H241 | 109.2° | 109.5° |
| C23 | C24 | H242 | 109.2° | 109.5° |
| C24 | C23 | H231 | 108.5° | 109.5° |
| C24 | C23 | H232 | 108.5° | 109.4° |
| N16 | S15 | O40 | 109.1° | 106.4° |
| N16 | S15 | O41 | 109.7° | 106.4° |
| N16 | S15 | C9 | 110.2° | 107.2° |
| S15 | N16 | H16 | 108.7° | 120.0° |
| O40 | S15 | O41 | 107.4° | 123.1° |
| O40 | S15 | C9 | 110.4° | 106.4° |
| O41 | S15 | C9 | 109.9° | 106.4° |
| S15 | C9 | C8 | 123.1° | 120.0° |
| S15 | C9 | C10 | 116.2° | 120.0° |
| C8 | C9 | C10 | 120.7° | 120.1° |
| C9 | C8 | C13 | 121.6° | 120.1° |
| C9 | C8 | C7 | 117.2° | 119.9° |
| C9 | C10 | C11 | 121.3° | 120.2° |
| C9 | C10 | H10 | 119.4° | 119.9° |
| C13 | C8 | C7 | 121.2° | 120.0° |
| C8 | C13 | C14 | 111.9° | 109.5° |
| C8 | C13 | H131 | 108.9° | 109.5° |
| C8 | C13 | H132 | 108.8° | 109.4° |
| C8 | C7 | C12 | 121.1° | 119.9° |
| C8 | C7 | N3 | 122.2° | 120.1° |
| C14 | C13 | H131 | 108.9° | 109.4° |
| C14 | C13 | H132 | 108.9° | 109.5° |
| C13 | C14 | H141 | 109.5° | 109.5° |
| C13 | C14 | H142 | 109.5° | 109.5° |
| C13 | C14 | H143 | 109.4° | 109.5° |
| C10 | C11 | C12 | 118.9° | 120.0° |
| C11 | C10 | H10 | 119.3° | 119.9° |
| C10 | C11 | H11 | 120.5° | 120.0° |
| C11 | C12 | C7 | 120.8° | 119.9° |
| C12 | C11 | H11 | 120.5° | 120.0° |
| C11 | C12 | H12 | 119.6° | 120.0° |
| C12 | C7 | N3 | 116.6° | 120.0° |
| C7 | C12 | H12 | 119.6° | 120.0° |
| C7 | N3 | C2 | 119.1° | 118.7° |
| C7 | N3 | C4 | 119.5° | 118.7° |
| C2 | N3 | C4 | 121.3° | 122.5° |
| N3 | C2 | C1 | 113.6° | 109.9° |
| N3 | C2 | H21C | 108.5° | 109.4° |
| N3 | C2 | H22C | 108.4° | 109.4° |
| N3 | C4 | C5 | 119.5° | 122.4° |
| N3 | C4 | O39 | 121.4° | 118.8° |
| C2 | C1 | O6 | 118.1° | 108.7° |
| C1 | C2 | H21C | 108.4° | 109.4° |
| C1 | C2 | H22C | 108.4° | 109.4° |
| C2 | C1 | H11C | 107.3° | 109.7° |
| C2 | C1 | H12C | 107.2° | 109.6° |
| C1 | O6 | C5 | 113.8° | 113.0° |
| O6 | C1 | H11C | 107.2° | 109.6° |
| O6 | C1 | H12C | 107.3° | 109.6° |
| O6 | C5 | C4 | 118.2° | 109.9° |
| O6 | C5 | H51C | 107.2° | 109.4° |
| O6 | C5 | H52C | 107.3° | 109.4° |
| C5 | C4 | O39 | 119.0° | 118.8° |
| C4 | C5 | H51C | 107.3° | 109.6° |
| C4 | C5 | H52C | 107.3° | 109.3° |
| H271 | C27 | H272 | 109.5° | 109.4° |
| H201 | C20 | H202 | 109.5° | 109.7° |
| H241 | C24 | H242 | 109.5° | 109.7° |
| H211 | C21 | H212 | 109.5° | 109.6° |
| H231 | C23 | H232 | 109.5° | 109.6° |
| H261 | C26 | H262 | 109.4° | 109.4° |
| H261 | C26 | H263 | 109.5° | 109.5° |
| H262 | C26 | H263 | 109.4° | 109.5° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.4° |
| H141 | C14 | H143 | 109.5° | 109.5° |
| H142 | C14 | H143 | 109.5° | 109.4° |
| H21C | C2 | H22C | 109.5° | 109.3° |
| H11C | C1 | H12C | 109.5° | 109.7° |
| H51C | C5 | H52C | 109.4° | 109.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C35 | C34 | C33 | H34 | 180.0° | 179.6° |
| C34 | C35 | C36 | H35 | 180.0° | 179.8° |
| C34 | C35 | C36 | CL | 178.4° | 180.0° |
| C34 | C35 | C36 | S37 | 2.7° | 0.1° |
| C35 | C34 | C33 | S37 | 2.2° | 0.1° |
| C35 | C34 | C33 | C31 | 177.9° | 180.0° |
| C33 | C34 | C35 | C36 | 3.3° | 0.1° |
| C34 | C33 | S37 | C36 | 0.5° | 0.0° |
| C34 | C33 | S37 | C31 | 179.9° | 180.0° |
| C34 | C33 | C31 | C32 | 130.4° | 180.0° |
| C34 | C33 | C31 | O30 | 44.7° | 0.4° |
| C33 | C34 | C35 | H35 | 176.7° | 179.9° |
| C35 | C36 | CL | S37 | 178.7° | 179.9° |
| C35 | C36 | S37 | C33 | 1.2° | 0.0° |
| C36 | C35 | C34 | H34 | 176.7° | 179.7° |
| CL | C36 | S37 | C33 | 179.9° | 179.9° |
| CL | C36 | C35 | H35 | 1.6° | 0.2° |
| C36 | S37 | C33 | C31 | 179.6° | 180.0° |
| S37 | C36 | C35 | H35 | 177.3° | 179.9° |
| S37 | C33 | C31 | C32 | 49.7° | 0.1° |
| S37 | C33 | C31 | O30 | 135.2° | 179.7° |
| S37 | C33 | C34 | H34 | 177.8° | 179.7° |
| C33 | C31 | C32 | O30 | 175.6° | 179.7° |
| C33 | C31 | C32 | C28 | 177.3° | 179.9° |
| C33 | C31 | O30 | N29 | 177.3° | 179.9° |
| C31 | C33 | C34 | H34 | 2.1° | 0.3° |
| C33 | C31 | C32 | H32 | 2.7° | 0.2° |
| C31 | C32 | C28 | H32 | 180.0° | 179.9° |
| C32 | C31 | O30 | N29 | 1.4° | 0.2° |
| C31 | C32 | C28 | N29 | 1.4° | 0.2° |
| C31 | C32 | C28 | C27 | 179.2° | 180.0° |
| O30 | C31 | C32 | C28 | 1.7° | 0.3° |
| C31 | O30 | N29 | C28 | 0.5° | 0.1° |
| O30 | C31 | C32 | H32 | 178.3° | 179.8° |
| C32 | C28 | N29 | O30 | 0.5° | 0.1° |
| C32 | C28 | N29 | C27 | 179.4° | 179.8° |
| C32 | C28 | C27 | C17 | 83.5° | 125.0° |
| C32 | C28 | C27 | H271 | 37.3° | 115.0° |
| C32 | C28 | C27 | H272 | 155.8° | 4.9° |
| O30 | N29 | C28 | C27 | 179.9° | 179.9° |
| N29 | C28 | C27 | C17 | 95.8° | 54.8° |
| N29 | C28 | C32 | H32 | 178.6° | 179.9° |
| N29 | C28 | C27 | H271 | 143.4° | 65.2° |
| N29 | C28 | C27 | H272 | 24.9° | 174.9° |
| C28 | C27 | C17 | H271 | 120.7° | 120.0° |
| C28 | C27 | C17 | H272 | 120.8° | 120.0° |
| C28 | C27 | C17 | C18 | 14.3° | 176.0° |
| C28 | C27 | C17 | N16 | 111.0° | 64.0° |
| C27 | C28 | C32 | H32 | 0.8° | 0.1° |
| C28 | C27 | H271 | H272 | 117.6° | 120.0° |
| C28 | C27 | C17 | H17 | 132.6° | 56.0° |
| C27 | C17 | C18 | N16 | 124.7° | 120.0° |
| C27 | C17 | C18 | H17 | 118.3° | 120.1° |
| C27 | C17 | N16 | H17 | 115.9° | 120.0° |
| C27 | C17 | C18 | O43 | 85.2° | 102.1° |
| C27 | C17 | C18 | N19 | 99.8° | 77.8° |
| C27 | C17 | N16 | S15 | 140.5° | 142.7° |
| C17 | C27 | H271 | H272 | 117.6° | 120.0° |
| C27 | C17 | N16 | H16 | 99.0° | 37.3° |
| C18 | C17 | N16 | H17 | 116.4° | 120.0° |
| C17 | C18 | O43 | N19 | 175.2° | 180.0° |
| C17 | C18 | N19 | C20 | 177.3° | 175.0° |
| C17 | C18 | N19 | C24 | 3.3° | 5.4° |
| C18 | C17 | N16 | S15 | 91.8° | 97.3° |
| C18 | C17 | C27 | H271 | 135.0° | 56.0° |
| C18 | C17 | C27 | H272 | 106.5° | 63.9° |
| C18 | C17 | N16 | H16 | 28.7° | 82.7° |
| N16 | C17 | C18 | O43 | 39.5° | 17.9° |
| N16 | C17 | C18 | N19 | 135.5° | 162.2° |
| C17 | N16 | S15 | H16 | 120.5° | 180.0° |
| C17 | N16 | S15 | O40 | 173.5° | 178.9° |
| C17 | N16 | S15 | O41 | 56.1° | 48.1° |
| C17 | N16 | S15 | C9 | 65.1° | 65.4° |
| N16 | C17 | C27 | H271 | 9.7° | 176.0° |
| N16 | C17 | C27 | H272 | 128.2° | 56.0° |
| O43 | C18 | N19 | C20 | 2.3° | 5.0° |
| O43 | C18 | N19 | C24 | 178.3° | 174.7° |
| O43 | C18 | C17 | H17 | 156.4° | 137.8° |
| C18 | N19 | C20 | C24 | 179.4° | 179.7° |
| C18 | N19 | C20 | C21 | 120.5° | 126.3° |
| C18 | N19 | C24 | C23 | 118.8° | 126.4° |
| N19 | C18 | C17 | H17 | 18.6° | 42.2° |
| C18 | N19 | C20 | H201 | 0.3° | 113.9° |
| C18 | N19 | C20 | H202 | 119.2° | 6.5° |
| C18 | N19 | C24 | H241 | 121.1° | 6.6° |
| C18 | N19 | C24 | H242 | 1.4° | 113.8° |
| N19 | C20 | C21 | H201 | 120.3° | 119.8° |
| N19 | C20 | C21 | H202 | 120.2° | 119.8° |
| N19 | C20 | C21 | C22 | 36.4° | 54.6° |
| C20 | N19 | C24 | C23 | 60.6° | 53.3° |
| N19 | C20 | H201 | H202 | 119.2° | 120.3° |
| C20 | N19 | C24 | H241 | 59.6° | 173.1° |
| C20 | N19 | C24 | H242 | 179.2° | 66.5° |
| N19 | C20 | C21 | H211 | 84.3° | 174.6° |
| N19 | C20 | C21 | H212 | 157.1° | 65.3° |
| C24 | N19 | C20 | C21 | 58.8° | 53.4° |
| N19 | C24 | C23 | C22 | 39.6° | 54.4° |
| N19 | C24 | C23 | H241 | 120.2° | 119.9° |
| N19 | C24 | C23 | H242 | 120.2° | 119.9° |
| C24 | N19 | C20 | H201 | 179.1° | 66.5° |
| C24 | N19 | C20 | H202 | 61.4° | 173.2° |
| N19 | C24 | H241 | H242 | 119.5° | 120.4° |
| N19 | C24 | C23 | H231 | 80.9° | 174.5° |
| N19 | C24 | C23 | H232 | 160.2° | 65.5° |
| C20 | C21 | C22 | H211 | 120.7° | 120.0° |
| C20 | C21 | C22 | H212 | 120.7° | 119.9° |
| C20 | C21 | C22 | O25 | 116.7° | 178.6° |
| C20 | C21 | C22 | C23 | 22.5° | 61.3° |
| C21 | C20 | H201 | H202 | 119.2° | 120.4° |
| C20 | C21 | H211 | H212 | 117.9° | 120.1° |
| C20 | C21 | C22 | H22 | 134.1° | 58.7° |
| C21 | C22 | O25 | C23 | 142.9° | 120.1° |
| C21 | C22 | O25 | H22 | 108.6° | 119.9° |
| C21 | C22 | C23 | H22 | 111.7° | 120.0° |
| C21 | C22 | O25 | C26 | 106.6° | 150.0° |
| C21 | C22 | C23 | C24 | 24.2° | 61.2° |
| C22 | C21 | C20 | H201 | 156.7° | 65.2° |
| C22 | C21 | C20 | H202 | 83.8° | 174.4° |
| C22 | C21 | H211 | H212 | 117.9° | 120.1° |
| C21 | C22 | C23 | H231 | 96.4° | 178.7° |
| C21 | C22 | C23 | H232 | 144.8° | 58.6° |
| O25 | C22 | C23 | H22 | 109.2° | 120.0° |
| O25 | C22 | C23 | C24 | 115.0° | 178.7° |
| O25 | C22 | C21 | H211 | 122.7° | 58.7° |
| O25 | C22 | C21 | H212 | 4.0° | 61.5° |
| O25 | C22 | C23 | H231 | 124.4° | 58.7° |
| O25 | C22 | C23 | H232 | 5.7° | 61.4° |
| C22 | O25 | C26 | H261 | 180.0° | 180.0° |
| C22 | O25 | C26 | H262 | 60.0° | 60.0° |
| C22 | O25 | C26 | H263 | 60.0° | 60.0° |
| C23 | C22 | O25 | C26 | 110.6° | 89.9° |
| C22 | C23 | C24 | H231 | 120.6° | 120.0° |
| C22 | C23 | C24 | H232 | 120.6° | 119.9° |
| C22 | C23 | C24 | H241 | 80.5° | 174.3° |
| C22 | C23 | C24 | H242 | 159.8° | 65.4° |
| C23 | C22 | C21 | H211 | 98.2° | 178.7° |
| C23 | C22 | C21 | H212 | 143.2° | 58.5° |
| C22 | C23 | H231 | H232 | 118.1° | 120.1° |
| C26 | O25 | C22 | H22 | 2.0° | 30.0° |
| O25 | C26 | H261 | H262 | 120.0° | 120.0° |
| O25 | C26 | H261 | H263 | 120.0° | 120.0° |
| O25 | C26 | H262 | H263 | 120.0° | 120.1° |
| C23 | C24 | H241 | H242 | 119.5° | 120.1° |
| C24 | C23 | C22 | H22 | 135.8° | 58.7° |
| C24 | C23 | H231 | H232 | 118.2° | 120.0° |
| N16 | S15 | O40 | O41 | 118.8° | 123.0° |
| N16 | S15 | O40 | C9 | 121.3° | 114.1° |
| N16 | S15 | O41 | C9 | 121.4° | 114.1° |
| N16 | S15 | C9 | C8 | 63.9° | 65.7° |
| N16 | S15 | C9 | C10 | 114.0° | 114.6° |
| S15 | N16 | C17 | H17 | 24.6° | 22.7° |
| O40 | S15 | O41 | C9 | 120.2° | 122.9° |
| O40 | S15 | C9 | C8 | 56.8° | 47.9° |
| O40 | S15 | C9 | C10 | 125.4° | 131.9° |
| O40 | S15 | N16 | H16 | 66.0° | 1.1° |
| O41 | S15 | C9 | C8 | 175.1° | 179.2° |
| O41 | S15 | C9 | C10 | 7.1° | 1.0° |
| O41 | S15 | N16 | H16 | 176.6° | 131.8° |
| S15 | C9 | C8 | C10 | 177.8° | 179.8° |
| S15 | C9 | C8 | C13 | 1.0° | 0.1° |
| S15 | C9 | C8 | C7 | 178.4° | 180.0° |
| S15 | C9 | C10 | C11 | 178.8° | 180.0° |
| C9 | S15 | N16 | H16 | 55.4° | 114.6° |
| S15 | C9 | C10 | H10 | 1.2° | 0.0° |
| C9 | C8 | C13 | C7 | 179.4° | 179.9° |
| C9 | C8 | C13 | C14 | 96.6° | 95.4° |
| C8 | C9 | C10 | C11 | 0.9° | 0.2° |
| C9 | C8 | C7 | C12 | 0.3° | 0.1° |
| C9 | C8 | C7 | N3 | 178.3° | 180.0° |
| C8 | C9 | C10 | H10 | 179.1° | 179.7° |
| C9 | C8 | C13 | H131 | 143.0° | 144.6° |
| C9 | C8 | C13 | H132 | 23.7° | 24.6° |
| C10 | C9 | C8 | C13 | 178.8° | 179.7° |
| C10 | C9 | C8 | C7 | 0.6° | 0.2° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | C12 | 0.3° | 0.0° |
| C9 | C10 | C11 | H11 | 179.7° | 179.9° |
| C8 | C13 | C14 | H131 | 120.4° | 120.0° |
| C8 | C13 | C14 | H132 | 120.3° | 120.0° |
| C13 | C8 | C7 | C12 | 179.7° | 180.0° |
| C13 | C8 | C7 | N3 | 2.3° | 0.1° |
| C8 | C13 | H131 | H132 | 118.9° | 120.0° |
| C8 | C13 | C14 | H141 | 180.0° | 66.0° |
| C8 | C13 | C14 | H142 | 60.0° | 174.0° |
| C8 | C13 | C14 | H143 | 60.0° | 54.1° |
| C7 | C8 | C13 | C14 | 84.0° | 84.5° |
| C8 | C7 | C12 | C11 | 0.9° | 0.3° |
| C8 | C7 | C12 | N3 | 178.2° | 179.9° |
| C8 | C7 | N3 | C2 | 87.5° | 83.9° |
| C8 | C7 | N3 | C4 | 96.6° | 95.8° |
| C7 | C8 | C13 | H131 | 36.4° | 35.5° |
| C7 | C8 | C13 | H132 | 155.7° | 155.5° |
| C8 | C7 | C12 | H12 | 179.1° | 180.0° |
| C14 | C13 | H131 | H132 | 118.9° | 120.0° |
| C13 | C14 | H141 | H142 | 120.0° | 120.0° |
| C13 | C14 | H141 | H143 | 120.0° | 120.1° |
| C13 | C14 | H142 | H143 | 120.0° | 120.0° |
| C10 | C11 | C12 | H11 | 180.0° | 179.9° |
| C10 | C11 | C12 | C7 | 0.6° | 0.3° |
| C10 | C11 | C12 | H12 | 179.4° | 180.0° |
| C11 | C12 | C7 | H12 | 180.0° | 179.7° |
| C11 | C12 | C7 | N3 | 179.0° | 179.8° |
| C12 | C11 | C10 | H10 | 179.7° | 180.0° |
| C12 | C7 | N3 | C2 | 94.4° | 96.0° |
| C12 | C7 | N3 | C4 | 81.5° | 84.3° |
| C7 | C12 | C11 | H11 | 179.4° | 179.6° |
| C7 | N3 | C2 | C4 | 175.8° | 179.7° |
| C7 | N3 | C2 | C1 | 171.4° | 161.6° |
| C7 | N3 | C4 | C5 | 179.5° | 178.3° |
| C7 | N3 | C4 | O39 | 3.9° | 1.9° |
| N3 | C7 | C12 | H12 | 1.0° | 0.1° |
| C7 | N3 | C2 | H21C | 68.0° | 78.3° |
| C7 | N3 | C2 | H22C | 50.8° | 41.4° |
| N3 | C2 | C1 | H21C | 120.6° | 120.1° |
| N3 | C2 | C1 | H22C | 120.6° | 120.2° |
| N3 | C2 | C1 | O6 | 7.7° | 49.1° |
| C2 | N3 | C4 | C5 | 3.7° | 1.3° |
| C2 | N3 | C4 | O39 | 179.7° | 178.4° |
| N3 | C2 | H21C | H22C | 118.2° | 119.8° |
| N3 | C2 | C1 | H11C | 113.5° | 168.9° |
| N3 | C2 | C1 | H12C | 128.9° | 70.6° |
| C4 | N3 | C2 | C1 | 12.8° | 18.1° |
| N3 | C4 | C5 | O6 | 27.2° | 15.4° |
| N3 | C4 | C5 | O39 | 176.7° | 179.8° |
| C4 | N3 | C2 | H21C | 107.8° | 102.0° |
| C4 | N3 | C2 | H22C | 133.3° | 138.2° |
| N3 | C4 | C5 | H51C | 94.0° | 135.7° |
| N3 | C4 | C5 | H52C | 148.5° | 104.6° |
| C2 | C1 | O6 | H11C | 121.2° | 119.8° |
| C2 | C1 | O6 | H12C | 121.2° | 119.7° |
| C2 | C1 | O6 | C5 | 36.1° | 68.3° |
| C1 | C2 | H21C | H22C | 118.1° | 119.8° |
| C2 | C1 | H11C | H12C | 116.1° | 120.4° |
| C1 | O6 | C5 | C4 | 46.9° | 49.4° |
| O6 | C1 | C2 | H21C | 128.3° | 71.0° |
| O6 | C1 | C2 | H22C | 112.9° | 169.3° |
| O6 | C1 | H11C | H12C | 116.1° | 120.4° |
| C1 | O6 | C5 | H51C | 74.3° | 169.7° |
| C1 | O6 | C5 | H52C | 168.2° | 70.6° |
| O6 | C5 | C4 | H51C | 121.2° | 120.2° |
| O6 | C5 | C4 | H52C | 121.3° | 120.0° |
| O6 | C5 | C4 | O39 | 149.5° | 164.3° |
| C5 | O6 | C1 | H11C | 85.2° | 171.9° |
| C5 | O6 | C1 | H12C | 157.3° | 51.4° |
| O6 | C5 | H51C | H52C | 116.0° | 119.8° |
| C4 | C5 | H51C | H52C | 116.1° | 119.7° |
| O39 | C4 | C5 | H51C | 89.3° | 44.1° |
| O39 | C4 | C5 | H52C | 28.2° | 75.7° |
| H34 | C34 | C35 | H35 | 3.3° | 0.4° |
| H271 | C27 | C17 | H17 | 106.7° | 64.0° |
| H272 | C27 | C17 | H17 | 11.8° | 176.0° |
| H17 | C17 | N16 | H16 | 145.1° | 157.3° |
| H201 | C20 | C21 | H211 | 36.0° | 54.7° |
| H201 | C20 | C21 | H212 | 82.6° | 174.9° |
| H202 | C20 | C21 | H211 | 155.5° | 65.7° |
| H202 | C20 | C21 | H212 | 36.9° | 54.5° |
| H241 | C24 | C23 | H231 | 158.9° | 65.7° |
| H241 | C24 | C23 | H232 | 40.1° | 54.4° |
| H242 | C24 | C23 | H231 | 39.2° | 54.6° |
| H242 | C24 | C23 | H232 | 79.6° | 174.7° |
| H211 | C21 | C22 | H22 | 13.5° | 61.3° |
| H212 | C21 | C22 | H22 | 105.2° | 178.6° |
| H22 | C22 | C23 | H231 | 15.2° | 61.3° |
| H22 | C22 | C23 | H232 | 103.6° | 178.6° |
| H261 | C26 | H262 | H263 | 120.0° | 120.0° |
| H10 | C10 | C11 | H11 | 0.3° | 0.0° |
| H131 | C13 | C14 | H141 | 59.6° | 54.0° |
| H131 | C13 | C14 | H142 | 179.6° | 65.9° |
| H131 | C13 | C14 | H143 | 60.4° | 174.1° |
| H132 | C13 | C14 | H141 | 59.7° | 174.0° |
| H132 | C13 | C14 | H142 | 60.3° | 54.0° |
| H132 | C13 | C14 | H143 | 179.7° | 65.9° |
| H141 | C14 | H142 | H143 | 120.0° | 119.9° |
| H11 | C11 | C12 | H12 | 0.6° | 0.0° |
| H21C | C2 | C1 | H11C | 7.1° | 48.8° |
| H21C | C2 | C1 | H12C | 110.5° | 169.3° |
| H22C | C2 | C1 | H11C | 125.9° | 70.9° |
| H22C | C2 | C1 | H12C | 8.3° | 49.6° |
