13T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | sing | 1.36Å | 1.37Å | |
| O1 | C29 | sing | 1.44Å | 1.48Å | |
| O2 | C1 | doub | 1.22Å | 1.29Å | |
| O3 | C2 | sing | 1.42Å | 1.44Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| O4 | C3 | sing | 1.43Å | 1.46Å | |
| O4 | C32 | sing | 1.42Å | 1.47Å | |
| O5 | C5 | doub | 1.23Å | 1.26Å | |
| O6 | C7 | sing | 1.43Å | 1.44Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| O7 | C11 | doub | 1.23Å | 1.26Å | |
| O9 | C15 | doub | 1.23Å | 1.24Å | |
| O10 | C17 | sing | 1.42Å | 1.43Å | |
| O10 | HO10 | sing | 0.97Å | 0.95Å | |
| C1 | C2 | sing | 1.52Å | 1.55Å | |
| C2 | C3 | sing | 1.54Å | 1.52Å | |
| C2 | H2 | sing | 1.10Å | 1.10Å | |
| C3 | C4 | sing | 1.55Å | 1.59Å | |
| C3 | H3 | sing | 1.10Å | 1.10Å | |
| C4 | C5 | sing | 1.54Å | 1.52Å | |
| C4 | C24 | sing | 1.53Å | 1.55Å | |
| C4 | H4 | sing | 1.10Å | 1.10Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C6 | C7 | sing | 1.55Å | 1.56Å | |
| C6 | C25 | sing | 1.53Å | 1.56Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | C8 | sing | 1.53Å | 1.54Å | |
| C7 | H7 | sing | 1.10Å | 1.10Å | |
| C8 | C9 | doub | 1.35Å | 1.40Å | |
| C8 | C26 | sing | 1.51Å | 1.54Å | |
| C9 | C10 | sing | 1.50Å | 1.57Å | |
| C9 | H9 | sing | 1.09Å | 1.08Å | |
| C10 | C27 | sing | 1.53Å | 1.57Å | |
| C10 | C11 | sing | 1.53Å | 1.54Å | |
| C10 | H10 | sing | 1.10Å | 1.10Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.56Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.54Å | 1.56Å | |
| C13 | H131 | sing | 1.10Å | 1.10Å | |
| C13 | H132 | sing | 1.10Å | 1.10Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C14 | C28 | sing | 1.53Å | 1.54Å | |
| C14 | H14 | sing | 1.10Å | 1.10Å | |
| C15 | C16 | sing | 1.53Å | 1.49Å | |
| C16 | C29 | sing | 1.53Å | 1.55Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| C16 | H16 | sing | 1.10Å | 1.10Å | |
| C17 | C18 | sing | 1.52Å | 1.55Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | C19 | sing | 1.48Å | 1.56Å | |
| C18 | O11 | sing | 1.42Å | 1.45Å | |
| C18 | C30 | sing | 1.47Å | 1.54Å | |
| C19 | O11 | sing | 1.43Å | 1.43Å | |
| C19 | C20 | sing | 1.48Å | 1.53Å | |
| C19 | H19 | sing | 1.08Å | 1.10Å | |
| C20 | C31 | sing | 1.55Å | 1.54Å | |
| C20 | C21 | sing | 1.52Å | 1.54Å | |
| C20 | H20 | sing | 1.11Å | 1.10Å | |
| C21 | C22 | doub | 1.34Å | 1.36Å | |
| C21 | H21 | sing | 1.09Å | 1.08Å | |
| C22 | C23 | sing | 1.49Å | 1.52Å | |
| C22 | H22 | sing | 1.09Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H233 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | 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 | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H273 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C28 | H283 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.10Å | 1.10Å | |
| C29 | H292 | sing | 1.10Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C30 | H303 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.10Å | 1.10Å | |
| C31 | H312 | sing | 1.10Å | 1.10Å | |
| C31 | H313 | sing | 1.10Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C32 | H323 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | O1 | C29 | 121.1° | 117.0° |
| O1 | C1 | O2 | 128.1° | 125.7° |
| O1 | C1 | C2 | 111.6° | 110.0° |
| O1 | C29 | C16 | 106.6° | 109.5° |
| O1 | C29 | H291 | 110.5° | 110.7° |
| O1 | C29 | H292 | 111.1° | 107.9° |
| O2 | C1 | C2 | 120.3° | 124.3° |
| C2 | O3 | HO3 | 109.5° | 106.9° |
| O3 | C2 | C1 | 107.3° | 106.6° |
| O3 | C2 | C3 | 109.8° | 111.0° |
| O3 | C2 | H2 | 110.7° | 107.7° |
| C3 | O4 | C32 | 115.3° | 111.3° |
| O4 | C3 | C2 | 110.5° | 109.0° |
| O4 | C3 | C4 | 115.6° | 109.5° |
| O4 | C3 | H3 | 105.4° | 105.6° |
| O4 | C32 | H321 | 109.5° | 109.5° |
| O4 | C32 | H322 | 109.5° | 109.5° |
| O4 | C32 | H323 | 109.5° | 109.0° |
| O5 | C5 | C4 | 121.1° | 121.7° |
| O5 | C5 | C6 | 120.5° | 120.7° |
| C7 | O6 | HO6 | 109.5° | 106.4° |
| O6 | C7 | C6 | 109.3° | 112.1° |
| O6 | C7 | C8 | 106.7° | 110.2° |
| O6 | C7 | H7 | 111.4° | 104.1° |
| O7 | C11 | C10 | 119.8° | 119.6° |
| O7 | C11 | C12 | 119.8° | 121.6° |
| O9 | C15 | C14 | 124.0° | 121.7° |
| O9 | C15 | C16 | 119.2° | 121.5° |
| C17 | O10 | HO10 | 109.5° | 106.6° |
| O10 | C17 | C16 | 108.2° | 109.0° |
| O10 | C17 | C18 | 104.5° | 109.4° |
| O10 | C17 | H17 | 115.6° | 107.6° |
| C1 | C2 | C3 | 109.6° | 112.5° |
| C1 | C2 | H2 | 110.9° | 108.4° |
| C3 | C2 | H2 | 108.4° | 110.5° |
| C2 | C3 | C4 | 112.4° | 117.0° |
| C2 | C3 | H3 | 109.2° | 107.4° |
| C4 | C3 | H3 | 103.2° | 107.7° |
| C3 | C4 | C5 | 109.5° | 114.4° |
| C3 | C4 | C24 | 113.4° | 111.6° |
| C3 | C4 | H4 | 106.1° | 108.0° |
| C5 | C4 | C24 | 107.4° | 110.4° |
| C5 | C4 | H4 | 112.2° | 105.2° |
| C4 | C5 | C6 | 118.4° | 117.6° |
| C24 | C4 | H4 | 108.3° | 106.7° |
| C4 | C24 | H241 | 109.5° | 110.6° |
| C4 | C24 | H242 | 109.5° | 110.6° |
| C4 | C24 | H243 | 109.4° | 110.6° |
| C5 | C6 | C7 | 106.7° | 109.3° |
| C5 | C6 | C25 | 109.0° | 107.7° |
| C5 | C6 | H6 | 112.3° | 107.3° |
| C7 | C6 | C25 | 111.8° | 115.5° |
| C7 | C6 | H6 | 109.7° | 109.5° |
| C6 | C7 | C8 | 109.4° | 113.6° |
| C6 | C7 | H7 | 108.8° | 108.4° |
| C25 | C6 | H6 | 107.4° | 107.3° |
| C6 | C25 | H251 | 109.5° | 110.6° |
| C6 | C25 | H252 | 109.5° | 110.5° |
| C6 | C25 | H253 | 109.5° | 110.5° |
| C8 | C7 | H7 | 111.2° | 107.9° |
| C7 | C8 | C9 | 120.9° | 119.1° |
| C7 | C8 | C26 | 118.9° | 117.1° |
| C9 | C8 | C26 | 120.1° | 123.8° |
| C8 | C9 | C10 | 123.6° | 128.5° |
| C8 | C9 | H9 | 118.2° | 117.3° |
| C8 | C26 | H261 | 109.5° | 109.2° |
| C8 | C26 | H262 | 109.4° | 109.2° |
| C8 | C26 | H263 | 109.5° | 109.3° |
| C10 | C9 | H9 | 118.2° | 114.1° |
| C9 | C10 | C27 | 113.1° | 111.7° |
| C9 | C10 | C11 | 111.2° | 108.2° |
| C9 | C10 | H10 | 105.6° | 111.1° |
| C27 | C10 | C11 | 109.3° | 112.9° |
| C27 | C10 | H10 | 107.6° | 106.0° |
| C10 | C27 | H271 | 109.5° | 110.5° |
| C10 | C27 | H272 | 109.4° | 110.6° |
| C10 | C27 | H273 | 109.4° | 110.6° |
| C11 | C10 | H10 | 109.7° | 106.8° |
| C10 | C11 | C12 | 120.3° | 118.7° |
| C11 | C12 | C13 | 111.5° | 112.2° |
| C11 | C12 | H121 | 108.8° | 108.2° |
| C11 | C12 | H122 | 108.4° | 108.7° |
| C13 | C12 | H121 | 108.8° | 110.5° |
| C13 | C12 | H122 | 108.4° | 108.6° |
| C12 | C13 | C14 | 114.8° | 112.3° |
| C12 | C13 | H131 | 107.7° | 108.2° |
| C12 | C13 | H132 | 106.5° | 109.9° |
| H121 | C12 | H122 | 111.0° | 108.6° |
| C14 | C13 | H131 | 107.7° | 109.6° |
| C14 | C13 | H132 | 106.5° | 110.3° |
| C13 | C14 | C15 | 113.7° | 111.8° |
| C13 | C14 | C28 | 113.2° | 110.7° |
| C13 | C14 | H14 | 103.5° | 108.8° |
| H131 | C13 | H132 | 113.8° | 106.2° |
| C15 | C14 | C28 | 109.0° | 107.9° |
| C15 | C14 | H14 | 108.2° | 108.6° |
| C14 | C15 | C16 | 116.8° | 116.8° |
| C28 | C14 | H14 | 108.8° | 109.0° |
| C14 | C28 | H281 | 109.5° | 110.6° |
| C14 | C28 | H282 | 109.5° | 110.5° |
| C14 | C28 | H283 | 109.4° | 110.6° |
| C15 | C16 | C29 | 107.3° | 109.4° |
| C15 | C16 | C17 | 111.3° | 110.5° |
| C15 | C16 | H16 | 112.2° | 107.9° |
| C29 | C16 | C17 | 115.8° | 112.6° |
| C29 | C16 | H16 | 107.3° | 108.8° |
| C16 | C29 | H291 | 110.5° | 109.9° |
| C16 | C29 | H292 | 111.1° | 110.1° |
| C17 | C16 | H16 | 102.9° | 107.6° |
| C16 | C17 | C18 | 115.2° | 111.7° |
| C16 | C17 | H17 | 105.0° | 109.2° |
| C18 | C17 | H17 | 108.6° | 109.8° |
| C17 | C18 | C19 | 122.3° | 118.2° |
| C17 | C18 | O11 | 115.3° | 111.9° |
| C17 | C18 | C30 | 112.0° | 115.5° |
| C19 | C18 | O11 | 56.6° | 59.1° |
| C19 | C18 | C30 | 122.9° | 123.0° |
| C18 | C19 | O11 | 58.0° | 58.2° |
| C18 | C19 | C20 | 120.6° | 120.2° |
| C18 | C19 | H19 | 134.4° | 121.4° |
| O11 | C18 | C30 | 114.6° | 115.1° |
| C18 | O11 | C19 | 65.4° | 62.7° |
| C18 | C30 | H301 | 109.5° | 110.6° |
| C18 | C30 | H302 | 109.5° | 110.6° |
| C18 | C30 | H303 | 109.4° | 110.6° |
| O11 | C19 | C20 | 117.3° | 113.7° |
| O11 | C19 | H19 | 137.3° | 118.2° |
| C20 | C19 | H19 | 91.3° | 113.4° |
| C19 | C20 | C31 | 111.3° | 112.1° |
| C19 | C20 | C21 | 108.4° | 111.8° |
| C19 | C20 | H20 | 109.7° | 110.3° |
| C31 | C20 | C21 | 111.5° | 108.5° |
| C31 | C20 | H20 | 106.5° | 106.0° |
| C20 | C31 | H311 | 109.5° | 112.6° |
| C20 | C31 | H312 | 109.5° | 109.8° |
| C20 | C31 | H313 | 109.4° | 110.8° |
| C21 | C20 | H20 | 109.4° | 107.9° |
| C20 | C21 | C22 | 130.5° | 124.5° |
| C20 | C21 | H21 | 114.7° | 116.3° |
| C22 | C21 | H21 | 114.8° | 119.2° |
| C21 | C22 | C23 | 127.5° | 123.8° |
| C21 | C22 | H22 | 116.2° | 119.6° |
| C23 | C22 | H22 | 116.2° | 116.6° |
| C22 | C23 | H231 | 109.5° | 112.3° |
| C22 | C23 | H232 | 109.5° | 109.9° |
| C22 | C23 | H233 | 109.5° | 109.9° |
| H231 | C23 | H232 | 109.5° | 108.1° |
| H231 | C23 | H233 | 109.5° | 108.2° |
| H232 | C23 | H233 | 109.5° | 108.4° |
| H241 | C24 | H242 | 109.5° | 108.3° |
| H241 | C24 | H243 | 109.4° | 108.3° |
| H242 | C24 | H243 | 109.5° | 108.4° |
| H251 | C25 | H252 | 109.4° | 108.4° |
| H251 | C25 | H253 | 109.5° | 108.4° |
| H252 | C25 | H253 | 109.5° | 108.3° |
| H261 | C26 | H262 | 109.5° | 109.8° |
| H261 | C26 | H263 | 109.4° | 109.9° |
| H262 | C26 | H263 | 109.5° | 109.4° |
| H271 | C27 | H272 | 109.5° | 108.3° |
| H271 | C27 | H273 | 109.5° | 108.4° |
| H272 | C27 | H273 | 109.5° | 108.4° |
| H281 | C28 | H282 | 109.5° | 108.4° |
| H281 | C28 | H283 | 109.5° | 108.4° |
| H282 | C28 | H283 | 109.5° | 108.3° |
| H291 | C29 | H292 | 107.2° | 108.8° |
| H301 | C30 | H302 | 109.5° | 108.3° |
| H301 | C30 | H303 | 109.5° | 108.3° |
| H302 | C30 | H303 | 109.5° | 108.3° |
| H311 | C31 | H312 | 109.5° | 107.7° |
| H311 | C31 | H313 | 109.4° | 107.9° |
| H312 | C31 | H313 | 109.5° | 107.8° |
| H321 | C32 | H322 | 109.5° | 110.1° |
| H321 | C32 | H323 | 109.5° | 109.3° |
| H322 | C32 | H323 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | O2 | C2 | 179.2° | 179.4° |
| O1 | C1 | C2 | O3 | 170.0° | 174.6° |
| O1 | C1 | C2 | C3 | 70.8° | 52.8° |
| O1 | C1 | C2 | H2 | 48.9° | 69.7° |
| C1 | O1 | C29 | C16 | 174.6° | 152.5° |
| C1 | O1 | C29 | H291 | 54.6° | 31.3° |
| C1 | O1 | C29 | H292 | 64.2° | 87.6° |
| C29 | O1 | C1 | O2 | 3.0° | 5.9° |
| C29 | O1 | C1 | C2 | 177.7° | 174.6° |
| O1 | C29 | C16 | C15 | 56.3° | 67.8° |
| O1 | C29 | C16 | H291 | 120.0° | 121.7° |
| O1 | C29 | C16 | H292 | 121.1° | 118.4° |
| O1 | C29 | C16 | C17 | 178.7° | 55.4° |
| O1 | C29 | C16 | H16 | 64.4° | 174.6° |
| O1 | C29 | H291 | H292 | 121.2° | 118.4° |
| O2 | C1 | C2 | O3 | 9.3° | 5.9° |
| O2 | C1 | C2 | C3 | 109.9° | 127.7° |
| O2 | C1 | C2 | H2 | 130.4° | 109.8° |
| O3 | C2 | C3 | O4 | 79.1° | 73.4° |
| O3 | C2 | C1 | C3 | 119.3° | 121.9° |
| O3 | C2 | C1 | H2 | 121.0° | 115.6° |
| O3 | C2 | C3 | H2 | 121.1° | 119.4° |
| O3 | C2 | C3 | C4 | 51.7° | 51.4° |
| O3 | C2 | C3 | H3 | 165.5° | 172.5° |
| HO3 | O3 | C2 | C1 | 83.6° | 15.6° |
| HO3 | O3 | C2 | C3 | 157.2° | 138.4° |
| HO3 | O3 | C2 | H2 | 37.5° | 100.5° |
| O4 | C3 | C2 | C1 | 38.6° | 45.9° |
| O4 | C3 | C2 | C4 | 130.7° | 124.9° |
| O4 | C3 | C2 | H3 | 115.4° | 114.0° |
| O4 | C3 | C2 | H2 | 159.8° | 167.2° |
| O4 | C3 | C4 | H3 | 114.5° | 114.4° |
| O4 | C3 | C4 | C5 | 170.7° | 58.3° |
| O4 | C3 | C4 | C24 | 50.8° | 175.4° |
| O4 | C3 | C4 | H4 | 68.0° | 58.4° |
| C3 | O4 | C32 | H321 | 16.9° | 156.1° |
| C3 | O4 | C32 | H322 | 103.1° | 35.4° |
| C3 | O4 | C32 | H323 | 136.9° | 84.3° |
| C32 | O4 | C3 | C2 | 54.6° | 170.8° |
| C32 | O4 | C3 | C4 | 74.4° | 60.0° |
| C32 | O4 | C3 | H3 | 172.4° | 55.7° |
| O4 | C32 | H321 | H322 | 120.0° | 120.4° |
| O4 | C32 | H321 | H323 | 120.0° | 119.4° |
| O4 | C32 | H322 | H323 | 120.0° | 119.4° |
| O5 | C5 | C4 | C3 | 51.2° | 104.4° |
| O5 | C5 | C4 | C6 | 178.1° | 179.2° |
| O5 | C5 | C4 | C24 | 72.3° | 22.5° |
| O5 | C5 | C4 | H4 | 168.8° | 137.3° |
| O5 | C5 | C6 | C7 | 23.3° | 61.4° |
| O5 | C5 | C6 | C25 | 97.6° | 64.7° |
| O5 | C5 | C6 | H6 | 143.5° | 180.0° |
| O6 | C7 | C6 | C5 | 174.4° | 95.0° |
| O6 | C7 | C6 | C8 | 116.5° | 125.8° |
| O6 | C7 | C6 | H7 | 121.8° | 114.3° |
| O6 | C7 | C6 | C25 | 55.2° | 26.6° |
| O6 | C7 | C6 | H6 | 63.7° | 147.8° |
| O6 | C7 | C8 | H7 | 121.7° | 113.1° |
| O6 | C7 | C8 | C9 | 82.8° | 120.8° |
| O6 | C7 | C8 | C26 | 94.9° | 59.9° |
| HO6 | O6 | C7 | C6 | 152.6° | 176.3° |
| HO6 | O6 | C7 | C8 | 34.3° | 48.7° |
| HO6 | O6 | C7 | H7 | 87.2° | 66.8° |
| O7 | C11 | C10 | C9 | 109.1° | 98.8° |
| O7 | C11 | C10 | C27 | 16.6° | 137.1° |
| O7 | C11 | C10 | C12 | 176.0° | 176.4° |
| O7 | C11 | C10 | H10 | 134.4° | 20.9° |
| O7 | C11 | C12 | C13 | 34.5° | 7.2° |
| O7 | C11 | C12 | H121 | 85.6° | 115.0° |
| O7 | C11 | C12 | H122 | 153.6° | 127.3° |
| O9 | C15 | C14 | C13 | 19.9° | 33.0° |
| O9 | C15 | C14 | C16 | 176.7° | 179.5° |
| O9 | C15 | C14 | C28 | 107.5° | 88.9° |
| O9 | C15 | C14 | H14 | 134.3° | 153.1° |
| O9 | C15 | C16 | C29 | 63.0° | 87.8° |
| O9 | C15 | C16 | C17 | 64.7° | 36.7° |
| O9 | C15 | C16 | H16 | 179.4° | 154.1° |
| O10 | C17 | C16 | C15 | 62.4° | 57.4° |
| O10 | C17 | C16 | C29 | 174.7° | 180.0° |
| O10 | C17 | C16 | C18 | 116.5° | 121.1° |
| O10 | C17 | C16 | H17 | 124.0° | 117.3° |
| O10 | C17 | C16 | H16 | 58.0° | 60.1° |
| O10 | C17 | C18 | H17 | 123.9° | 117.9° |
| O10 | C17 | C18 | C19 | 153.0° | 154.9° |
| O10 | C17 | C18 | O11 | 87.9° | 89.2° |
| O10 | C17 | C18 | C30 | 45.5° | 45.2° |
| HO10 | O10 | C17 | C16 | 111.8° | 18.1° |
| HO10 | O10 | C17 | C18 | 11.5° | 140.5° |
| HO10 | O10 | C17 | H17 | 130.8° | 100.3° |
| C1 | C2 | C3 | H2 | 121.2° | 121.2° |
| C1 | C2 | C3 | C4 | 169.4° | 170.8° |
| C1 | C2 | C3 | H3 | 76.8° | 68.1° |
| C2 | C3 | C4 | H3 | 117.5° | 121.0° |
| C2 | C3 | C4 | C5 | 61.3° | 66.4° |
| C2 | C3 | C4 | C24 | 178.8° | 59.9° |
| C2 | C3 | C4 | H4 | 60.0° | 176.9° |
| H2 | C2 | C3 | C4 | 69.5° | 68.0° |
| H2 | C2 | C3 | H3 | 44.4° | 53.2° |
| C3 | C4 | C5 | C24 | 123.5° | 126.9° |
| C3 | C4 | C5 | H4 | 117.6° | 118.3° |
| C3 | C4 | C24 | H4 | 117.5° | 117.8° |
| C3 | C4 | C5 | C6 | 130.8° | 76.4° |
| C3 | C4 | C24 | H241 | 59.3° | 3.4° |
| C3 | C4 | C24 | H242 | 179.3° | 123.3° |
| C3 | C4 | C24 | H243 | 60.6° | 116.6° |
| H3 | C3 | C4 | C5 | 56.2° | 172.7° |
| H3 | C3 | C4 | C24 | 63.7° | 61.1° |
| H3 | C3 | C4 | H4 | 177.5° | 56.0° |
| C5 | C4 | C24 | H4 | 121.4° | 113.8° |
| C4 | C5 | C6 | C7 | 158.6° | 119.4° |
| C4 | C5 | C6 | C25 | 80.5° | 114.4° |
| C4 | C5 | C6 | H6 | 38.4° | 0.8° |
| C5 | C4 | C24 | H241 | 179.6° | 131.8° |
| C5 | C4 | C24 | H242 | 59.6° | 108.2° |
| C5 | C4 | C24 | H243 | 60.5° | 11.8° |
| C24 | C4 | C5 | C6 | 105.7° | 156.7° |
| C4 | C24 | H241 | H242 | 120.0° | 121.4° |
| C4 | C24 | H241 | H243 | 120.0° | 121.3° |
| C4 | C24 | H242 | H243 | 120.0° | 121.4° |
| H4 | C4 | C5 | C6 | 13.2° | 41.9° |
| H4 | C4 | C24 | H241 | 58.2° | 114.4° |
| H4 | C4 | C24 | H242 | 61.8° | 5.6° |
| H4 | C4 | C24 | H243 | 178.1° | 125.6° |
| C5 | C6 | C7 | C25 | 119.2° | 121.5° |
| C5 | C6 | C7 | H6 | 121.9° | 117.2° |
| C5 | C6 | C25 | H6 | 121.9° | 115.2° |
| C5 | C6 | C7 | C8 | 69.1° | 139.3° |
| C5 | C6 | C7 | H7 | 52.6° | 19.4° |
| C5 | C6 | C25 | H251 | 167.9° | 6.7° |
| C5 | C6 | C25 | H252 | 48.0° | 126.8° |
| C5 | C6 | C25 | H253 | 72.0° | 113.3° |
| C7 | C6 | C25 | H6 | 120.3° | 122.4° |
| C6 | C7 | C8 | H7 | 120.2° | 120.2° |
| C6 | C7 | C8 | C9 | 159.1° | 112.4° |
| C6 | C7 | C8 | C26 | 23.2° | 66.8° |
| C7 | C6 | C25 | H251 | 50.2° | 129.1° |
| C7 | C6 | C25 | H252 | 69.8° | 110.9° |
| C7 | C6 | C25 | H253 | 170.2° | 9.1° |
| C25 | C6 | C7 | C8 | 171.8° | 99.2° |
| C25 | C6 | C7 | H7 | 66.6° | 140.9° |
| C6 | C25 | H251 | H252 | 120.0° | 121.3° |
| C6 | C25 | H251 | H253 | 120.0° | 121.3° |
| C6 | C25 | H252 | H253 | 120.0° | 121.3° |
| H6 | C6 | C7 | C8 | 52.8° | 22.1° |
| H6 | C6 | C7 | H7 | 174.5° | 97.8° |
| H6 | C6 | C25 | H251 | 70.1° | 108.5° |
| H6 | C6 | C25 | H252 | 169.9° | 11.5° |
| H6 | C6 | C25 | H253 | 49.9° | 131.5° |
| C7 | C8 | C9 | C26 | 177.7° | 179.2° |
| C7 | C8 | C9 | C10 | 173.8° | 179.3° |
| C7 | C8 | C9 | H9 | 6.3° | 0.7° |
| C7 | C8 | C26 | H261 | 119.7° | 104.9° |
| C7 | C8 | C26 | H262 | 0.4° | 135.0° |
| C7 | C8 | C26 | H263 | 120.4° | 15.3° |
| H7 | C7 | C8 | C9 | 38.9° | 7.8° |
| H7 | C7 | C8 | C26 | 143.4° | 173.0° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C8 | C9 | C10 | C27 | 123.7° | 140.1° |
| C8 | C9 | C10 | C11 | 112.8° | 94.9° |
| C8 | C9 | C10 | H10 | 6.2° | 22.0° |
| C9 | C8 | C26 | H261 | 58.0° | 75.9° |
| C9 | C8 | C26 | H262 | 178.1° | 44.2° |
| C9 | C8 | C26 | H263 | 61.9° | 163.9° |
| C26 | C8 | C9 | C10 | 3.9° | 1.5° |
| C26 | C8 | C9 | H9 | 176.1° | 178.4° |
| C8 | C26 | H261 | H262 | 120.0° | 119.8° |
| C8 | C26 | H261 | H263 | 120.0° | 119.8° |
| C8 | C26 | H262 | H263 | 120.0° | 119.6° |
| C9 | C10 | C27 | C11 | 124.6° | 122.3° |
| C9 | C10 | C27 | H10 | 116.3° | 121.1° |
| C9 | C10 | C11 | H10 | 116.5° | 119.7° |
| C9 | C10 | C11 | C12 | 66.9° | 77.7° |
| C9 | C10 | C27 | H271 | 49.7° | 176.4° |
| C9 | C10 | C27 | H272 | 70.3° | 56.4° |
| C9 | C10 | C27 | H273 | 169.7° | 63.6° |
| H9 | C9 | C10 | C27 | 56.3° | 39.9° |
| H9 | C9 | C10 | C11 | 67.2° | 85.0° |
| H9 | C9 | C10 | H10 | 173.8° | 158.0° |
| C27 | C10 | C11 | H10 | 117.8° | 116.1° |
| C27 | C10 | C11 | C12 | 167.4° | 46.5° |
| C10 | C27 | H271 | H272 | 120.0° | 121.3° |
| C10 | C27 | H271 | H273 | 120.0° | 121.3° |
| C10 | C27 | H272 | H273 | 120.0° | 121.4° |
| C10 | C11 | C12 | C13 | 141.6° | 176.4° |
| C10 | C11 | C12 | H121 | 98.4° | 61.4° |
| C10 | C11 | C12 | H122 | 22.4° | 56.4° |
| C11 | C10 | C27 | H271 | 74.8° | 54.1° |
| C11 | C10 | C27 | H272 | 165.1° | 65.8° |
| C11 | C10 | C27 | H273 | 45.2° | 174.1° |
| H10 | C10 | C11 | C12 | 49.6° | 162.6° |
| H10 | C10 | C27 | H271 | 166.0° | 62.5° |
| H10 | C10 | C27 | H272 | 46.0° | 177.6° |
| H10 | C10 | C27 | H273 | 73.9° | 57.5° |
| C11 | C12 | C13 | H121 | 120.0° | 120.9° |
| C11 | C12 | C13 | H122 | 119.2° | 120.1° |
| C11 | C12 | H121 | H122 | 119.2° | 117.8° |
| C11 | C12 | C13 | C14 | 174.3° | 175.6° |
| C11 | C12 | C13 | H131 | 65.7° | 63.3° |
| C11 | C12 | C13 | H132 | 56.7° | 52.3° |
| C13 | C12 | H121 | H122 | 119.2° | 119.0° |
| C12 | C13 | C14 | H131 | 120.0° | 120.3° |
| C12 | C13 | C14 | H132 | 117.6° | 123.1° |
| C12 | C13 | H131 | H132 | 117.8° | 118.0° |
| C12 | C13 | C14 | C15 | 42.8° | 74.8° |
| C12 | C13 | C14 | C28 | 168.0° | 164.9° |
| C12 | C13 | C14 | H14 | 74.4° | 45.2° |
| H121 | C12 | C13 | C14 | 54.3° | 54.7° |
| H121 | C12 | C13 | H131 | 174.3° | 175.8° |
| H121 | C12 | C13 | H132 | 63.3° | 68.6° |
| H122 | C12 | C13 | C14 | 66.5° | 64.3° |
| H122 | C12 | C13 | H131 | 53.5° | 56.8° |
| H122 | C12 | C13 | H132 | 175.9° | 172.4° |
| C14 | C13 | H131 | H132 | 117.8° | 119.2° |
| C13 | C14 | C15 | C28 | 127.4° | 121.9° |
| C13 | C14 | C15 | H14 | 114.4° | 120.1° |
| C13 | C14 | C28 | H14 | 114.5° | 119.6° |
| C13 | C14 | C15 | C16 | 156.8° | 147.5° |
| C13 | C14 | C28 | H281 | 136.5° | 75.0° |
| C13 | C14 | C28 | H282 | 16.5° | 45.0° |
| C13 | C14 | C28 | H283 | 103.5° | 165.0° |
| H131 | C13 | C14 | C15 | 162.8° | 164.9° |
| H131 | C13 | C14 | C28 | 72.0° | 44.5° |
| H131 | C13 | C14 | H14 | 45.6° | 75.2° |
| H132 | C13 | C14 | C15 | 74.8° | 48.3° |
| H132 | C13 | C14 | C28 | 50.4° | 72.0° |
| H132 | C13 | C14 | H14 | 168.0° | 168.3° |
| C15 | C14 | C28 | H14 | 117.8° | 117.8° |
| C14 | C15 | C16 | C29 | 113.9° | 92.7° |
| C14 | C15 | C16 | C17 | 118.4° | 142.8° |
| C14 | C15 | C16 | H16 | 3.7° | 25.4° |
| C15 | C14 | C28 | H281 | 95.8° | 162.4° |
| C15 | C14 | C28 | H282 | 144.2° | 77.6° |
| C15 | C14 | C28 | H283 | 24.2° | 42.4° |
| C28 | C14 | C15 | C16 | 75.7° | 90.6° |
| C14 | C28 | H281 | H282 | 120.0° | 121.3° |
| C14 | C28 | H281 | H283 | 120.0° | 121.3° |
| C14 | C28 | H282 | H283 | 120.0° | 121.3° |
| H14 | C14 | C15 | C16 | 42.4° | 27.4° |
| H14 | C14 | C28 | H281 | 22.0° | 44.7° |
| H14 | C14 | C28 | H282 | 98.0° | 164.6° |
| H14 | C14 | C28 | H283 | 142.0° | 75.4° |
| C15 | C16 | C29 | C17 | 125.0° | 123.2° |
| C15 | C16 | C29 | H16 | 120.7° | 117.6° |
| C15 | C16 | C17 | H16 | 120.4° | 117.5° |
| C15 | C16 | C17 | C18 | 178.9° | 178.4° |
| C15 | C16 | C17 | H17 | 61.6° | 59.9° |
| C15 | C16 | C29 | H291 | 63.7° | 53.9° |
| C15 | C16 | C29 | H292 | 177.4° | 173.8° |
| C29 | C16 | C17 | H16 | 116.7° | 119.9° |
| C29 | C16 | C17 | C18 | 58.1° | 59.0° |
| C29 | C16 | C17 | H17 | 61.3° | 62.7° |
| C16 | C29 | H291 | H292 | 121.2° | 120.6° |
| C16 | C17 | C18 | H17 | 117.5° | 121.3° |
| C16 | C17 | C18 | C19 | 88.4° | 84.3° |
| C16 | C17 | C18 | O11 | 153.5° | 150.0° |
| C16 | C17 | C18 | C30 | 73.1° | 75.6° |
| C17 | C16 | C29 | H291 | 61.3° | 177.1° |
| C17 | C16 | C29 | H292 | 57.5° | 63.0° |
| H16 | C16 | C17 | C18 | 58.6° | 60.9° |
| H16 | C16 | C17 | H17 | 178.0° | 177.5° |
| H16 | C16 | C29 | H291 | 175.6° | 63.7° |
| H16 | C16 | C29 | H292 | 56.7° | 56.2° |
| C17 | C18 | C19 | O11 | 100.9° | 100.0° |
| C17 | C18 | C19 | C30 | 159.5° | 158.3° |
| C17 | C18 | O11 | C30 | 132.2° | 134.5° |
| C17 | C18 | C19 | C20 | 154.1° | 159.2° |
| C17 | C18 | C19 | H19 | 26.1° | 5.8° |
| C17 | C18 | C30 | H301 | 174.8° | 141.5° |
| C17 | C18 | C30 | H302 | 54.8° | 98.5° |
| C17 | C18 | C30 | H303 | 65.2° | 21.6° |
| H17 | C17 | C18 | C19 | 29.1° | 37.0° |
| H17 | C17 | C18 | O11 | 36.0° | 28.7° |
| H17 | C17 | C18 | C30 | 169.4° | 163.1° |
| C19 | C18 | O11 | C30 | 114.4° | 114.8° |
| C18 | C19 | O11 | C20 | 110.6° | 112.0° |
| C18 | C19 | O11 | H19 | 122.7° | 111.2° |
| C18 | C19 | C20 | H19 | 145.8° | 155.4° |
| C18 | C19 | C20 | C31 | 166.1° | 135.8° |
| C18 | C19 | C20 | C21 | 43.1° | 102.1° |
| C18 | C19 | C20 | H20 | 76.4° | 17.9° |
| C19 | C18 | C30 | H301 | 13.5° | 59.6° |
| C19 | C18 | C30 | H302 | 106.5° | 60.4° |
| C19 | C18 | C30 | H303 | 133.5° | 179.6° |
| O11 | C18 | C30 | H301 | 51.4° | 8.6° |
| O11 | C18 | C30 | H302 | 171.4° | 128.6° |
| O11 | C18 | C30 | H303 | 68.6° | 111.3° |
| C30 | C18 | C19 | C20 | 5.3° | 0.9° |
| C30 | C18 | C19 | H19 | 133.4° | 152.5° |
| C18 | C30 | H301 | H302 | 120.0° | 121.4° |
| C18 | C30 | H301 | H303 | 120.0° | 121.3° |
| C18 | C30 | H302 | H303 | 120.0° | 121.4° |
| O11 | C19 | C20 | H19 | 147.0° | 138.9° |
| O11 | C19 | C20 | C31 | 126.7° | 70.0° |
| O11 | C19 | C20 | C21 | 110.2° | 167.9° |
| O11 | C19 | C20 | H20 | 9.2° | 47.9° |
| C19 | C20 | C31 | C21 | 121.2° | 124.0° |
| C19 | C20 | C31 | H20 | 119.5° | 120.4° |
| C19 | C20 | C21 | H20 | 119.6° | 121.4° |
| C19 | C20 | C21 | C22 | 131.0° | 151.4° |
| C19 | C20 | C21 | H21 | 49.0° | 30.3° |
| C19 | C20 | C31 | H311 | 16.7° | 2.2° |
| C19 | C20 | C31 | H312 | 136.7° | 117.9° |
| C19 | C20 | C31 | H313 | 103.2° | 123.1° |
| H19 | C19 | C20 | C31 | 20.3° | 68.8° |
| H19 | C19 | C20 | C21 | 102.7° | 53.2° |
| H19 | C19 | C20 | H20 | 137.8° | 173.3° |
| C31 | C20 | C21 | H20 | 117.5° | 114.4° |
| C31 | C20 | C21 | C22 | 8.1° | 84.4° |
| C31 | C20 | C21 | H21 | 171.9° | 93.9° |
| C20 | C31 | H311 | H312 | 120.0° | 121.3° |
| C20 | C31 | H311 | H313 | 120.0° | 122.5° |
| C20 | C31 | H312 | H313 | 120.0° | 120.8° |
| C20 | C21 | C22 | H21 | 180.0° | 178.3° |
| C20 | C21 | C22 | C23 | 0.9° | 0.0° |
| C20 | C21 | C22 | H22 | 179.1° | 180.0° |
| C21 | C20 | C31 | H311 | 104.5° | 121.8° |
| C21 | C20 | C31 | H312 | 15.5° | 118.1° |
| C21 | C20 | C31 | H313 | 135.5° | 0.9° |
| H20 | C20 | C21 | C22 | 109.4° | 30.0° |
| H20 | C20 | C21 | H21 | 70.6° | 151.7° |
| H20 | C20 | C31 | H311 | 136.2° | 122.5° |
| H20 | C20 | C31 | H312 | 103.8° | 2.4° |
| H20 | C20 | C31 | H313 | 16.2° | 116.6° |
| C21 | C22 | C23 | H22 | 180.0° | 180.0° |
| C21 | C22 | C23 | H231 | 70.0° | 0.2° |
| C21 | C22 | C23 | H232 | 170.0° | 120.6° |
| C21 | C22 | C23 | H233 | 50.0° | 120.3° |
| H21 | C21 | C22 | C23 | 179.1° | 178.3° |
| H21 | C21 | C22 | H22 | 0.9° | 1.8° |
| C22 | C23 | H231 | H232 | 120.0° | 121.4° |
| C22 | C23 | H231 | H233 | 120.0° | 121.5° |
| C22 | C23 | H232 | H233 | 120.0° | 120.1° |
| H22 | C22 | C23 | H231 | 110.0° | 179.8° |
| H22 | C22 | C23 | H232 | 10.0° | 59.4° |
| H22 | C22 | C23 | H233 | 130.0° | 59.7° |
| H231 | C23 | H232 | H233 | 120.0° | 117.0° |
| H241 | C24 | H242 | H243 | 120.0° | 117.3° |
| H251 | C25 | H252 | H253 | 120.0° | 117.4° |
| H261 | C26 | H262 | H263 | 120.0° | 120.7° |
| H271 | C27 | H272 | H273 | 120.0° | 117.4° |
| H281 | C28 | H282 | H283 | 120.0° | 117.4° |
| H301 | C30 | H302 | H303 | 120.0° | 117.3° |
| H311 | C31 | H312 | H313 | 120.0° | 116.2° |
| H321 | C32 | H322 | H323 | 120.0° | 120.2° |
