CLL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.46Å | |
| C1 | C10 | sing | 1.53Å | 1.68Å | |
| C1 | H11 | sing | 1.09Å | 1.12Å | |
| C1 | H12 | sing | 1.09Å | 1.12Å | |
| C2 | C3 | sing | 1.53Å | 1.44Å | |
| C2 | H21 | sing | 1.09Å | 1.11Å | |
| C2 | H22 | sing | 1.09Å | 1.12Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C3 | O2 | sing | 1.45Å | 1.38Å | |
| C3 | H3 | sing | 1.09Å | 1.12Å | |
| C4 | C5 | sing | 1.52Å | 1.56Å | |
| C4 | H41 | sing | 1.09Å | 1.11Å | |
| C4 | H42 | sing | 1.09Å | 1.11Å | |
| C5 | C6 | doub | 1.29Å | 1.22Å | |
| C5 | C10 | sing | 1.50Å | 1.60Å | |
| C6 | C7 | sing | 1.50Å | 1.48Å | |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| C7 | H71 | sing | 1.09Å | 1.11Å | |
| C7 | H72 | sing | 1.09Å | 1.12Å | |
| C8 | C9 | sing | 1.53Å | 1.59Å | |
| C8 | C14 | sing | 1.52Å | 1.59Å | |
| C8 | H8 | sing | 1.09Å | 1.11Å | |
| C9 | C10 | sing | 1.52Å | 1.44Å | |
| C9 | C11 | sing | 1.53Å | 1.62Å | |
| C9 | H9 | sing | 1.09Å | 1.12Å | |
| C10 | C19 | sing | 1.53Å | 1.63Å | |
| C11 | C12 | sing | 1.54Å | 1.55Å | |
| C11 | H111 | sing | 1.09Å | 1.12Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C12 | C13 | sing | 1.52Å | 1.49Å | |
| C12 | H121 | sing | 1.09Å | 1.12Å | |
| C12 | H122 | sing | 1.09Å | 1.11Å | |
| C13 | C14 | sing | 1.55Å | 1.53Å | |
| C13 | C17 | sing | 1.53Å | 1.56Å | |
| C13 | C18 | sing | 1.53Å | 1.54Å | |
| C14 | C15 | sing | 1.53Å | 1.50Å | |
| C14 | H14 | sing | 1.09Å | 1.12Å | |
| C15 | C16 | sing | 1.55Å | 1.47Å | |
| C15 | H151 | sing | 1.09Å | 1.11Å | |
| C15 | H152 | sing | 1.09Å | 1.11Å | |
| C16 | C17 | sing | 1.55Å | 1.53Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.12Å | |
| C17 | C20 | sing | 1.53Å | 1.50Å | |
| C17 | H17 | sing | 1.09Å | 1.12Å | |
| C18 | H181 | sing | 1.09Å | 1.11Å | |
| C18 | H182 | sing | 1.09Å | 1.12Å | |
| C18 | H183 | sing | 1.09Å | 1.12Å | |
| C19 | H191 | sing | 1.09Å | 1.11Å | |
| C19 | H192 | sing | 1.09Å | 1.12Å | |
| C19 | H193 | sing | 1.09Å | 1.11Å | |
| C20 | C21 | sing | 1.53Å | 1.48Å | |
| C20 | C22 | sing | 1.53Å | 1.50Å | |
| C20 | H20 | sing | 1.09Å | 1.11Å | |
| C21 | H211 | sing | 1.09Å | 1.11Å | |
| C21 | H212 | sing | 1.09Å | 1.12Å | |
| C21 | H213 | sing | 1.09Å | 1.11Å | |
| C22 | C23 | sing | 1.53Å | 1.48Å | |
| C22 | H221 | sing | 1.09Å | 1.11Å | |
| C22 | H222 | sing | 1.09Å | 1.12Å | |
| C23 | C24 | sing | 1.53Å | 1.48Å | |
| C23 | H231 | sing | 1.09Å | 1.11Å | |
| C23 | H232 | sing | 1.09Å | 1.12Å | |
| C24 | C25 | sing | 1.53Å | 1.50Å | |
| C24 | H241 | sing | 1.09Å | 1.12Å | |
| C24 | H242 | sing | 1.09Å | 1.12Å | |
| C25 | C26 | sing | 1.53Å | 1.48Å | |
| C25 | C27 | sing | 1.53Å | 1.48Å | |
| C25 | H25 | sing | 1.09Å | 1.12Å | |
| C26 | H261 | sing | 1.09Å | 1.11Å | |
| C26 | H262 | sing | 1.09Å | 1.11Å | |
| C26 | H263 | sing | 1.09Å | 1.12Å | |
| C27 | H271 | sing | 1.09Å | 1.11Å | |
| C27 | H272 | sing | 1.09Å | 1.12Å | |
| C27 | H273 | sing | 1.09Å | 1.11Å | |
| C28 | C29 | sing | 1.51Å | 1.56Å | |
| C28 | O1 | doub | 1.21Å | 1.18Å | |
| C28 | O2 | sing | 1.34Å | 0.92Å | |
| C29 | C30 | sing | 1.53Å | 1.48Å | |
| C29 | H291 | sing | 1.09Å | 1.11Å | |
| C29 | H292 | sing | 1.09Å | 1.11Å | |
| C30 | C31 | sing | 1.53Å | 1.48Å | |
| C30 | H301 | sing | 1.09Å | 1.12Å | |
| C30 | H302 | sing | 1.09Å | 1.12Å | |
| C31 | C32 | sing | 1.53Å | 1.47Å | |
| C31 | H311 | sing | 1.09Å | 1.12Å | |
| C31 | H312 | sing | 1.09Å | 1.11Å | |
| C32 | C33 | sing | 1.53Å | 1.48Å | |
| C32 | H321 | sing | 1.09Å | 1.12Å | |
| C32 | H322 | sing | 1.09Å | 1.11Å | |
| C33 | C34 | sing | 1.53Å | 1.54Å | |
| C33 | H331 | sing | 1.09Å | 1.12Å | |
| C33 | H332 | sing | 1.09Å | 1.12Å | |
| C34 | C35 | sing | 1.53Å | 1.54Å | |
| C34 | H341 | sing | 1.09Å | 1.11Å | |
| C34 | H342 | sing | 1.09Å | 1.11Å | |
| C35 | C36 | sing | 1.51Å | 1.47Å | |
| C35 | H351 | sing | 1.09Å | 1.12Å | |
| C35 | H352 | sing | 1.09Å | 1.11Å | |
| C36 | C37 | doub | 1.31Å | 1.46Å | |
| C36 | H36 | sing | 1.08Å | 1.10Å | |
| C37 | C38 | sing | 1.51Å | 1.47Å | |
| C37 | H37 | sing | 1.08Å | 1.10Å | |
| C38 | C39 | sing | 1.51Å | 1.47Å | |
| C38 | H381 | sing | 1.09Å | 1.12Å | |
| C38 | H382 | sing | 1.09Å | 1.11Å | |
| C39 | C40 | doub | 1.31Å | 1.48Å | |
| C39 | H39 | sing | 1.08Å | 1.10Å | |
| C40 | C41 | sing | 1.51Å | 1.47Å | |
| C40 | H40 | sing | 1.08Å | 1.10Å | |
| C41 | C42 | sing | 1.53Å | 1.48Å | |
| C41 | H411 | sing | 1.09Å | 1.12Å | |
| C41 | H412 | sing | 1.09Å | 1.11Å | |
| C42 | C43 | sing | 1.53Å | 1.53Å | |
| C42 | H421 | sing | 1.09Å | 1.11Å | |
| C42 | H422 | sing | 1.09Å | 1.12Å | |
| C43 | C44 | sing | 1.53Å | 1.57Å | |
| C43 | H431 | sing | 1.09Å | 1.11Å | |
| C43 | H432 | sing | 1.09Å | 1.11Å | |
| C44 | C45 | sing | 1.53Å | 1.40Å | |
| C44 | H441 | sing | 1.09Å | 1.12Å | |
| C44 | H442 | sing | 1.09Å | 1.11Å | |
| C45 | H451 | sing | 1.09Å | 1.12Å | |
| C45 | H452 | sing | 1.09Å | 1.11Å | |
| C45 | H453 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C10 | 115.0° | 109.4° |
| C2 | C1 | H11 | 110.2° | 109.5° |
| C2 | C1 | H12 | 110.2° | 109.5° |
| C1 | C2 | C3 | 113.9° | 109.7° |
| C1 | C2 | H21 | 110.5° | 109.5° |
| C1 | C2 | H22 | 110.6° | 109.5° |
| C10 | C1 | H11 | 110.2° | 109.5° |
| C10 | C1 | H12 | 110.2° | 109.5° |
| C1 | C10 | C5 | 112.3° | 109.4° |
| C1 | C10 | C9 | 105.9° | 110.0° |
| C1 | C10 | C19 | 109.5° | 108.1° |
| H11 | C1 | H12 | 100.0° | 109.5° |
| C3 | C2 | H21 | 110.6° | 109.4° |
| C3 | C2 | H22 | 110.6° | 109.4° |
| C2 | C3 | C4 | 114.3° | 109.5° |
| C2 | C3 | O2 | 111.3° | 109.5° |
| C2 | C3 | H3 | 104.1° | 109.5° |
| H21 | C2 | H22 | 99.7° | 109.4° |
| C4 | C3 | O2 | 107.4° | 109.5° |
| C4 | C3 | H3 | 108.3° | 109.5° |
| C3 | C4 | C5 | 111.9° | 108.4° |
| C3 | C4 | H41 | 111.3° | 107.0° |
| C3 | C4 | H42 | 111.3° | 112.2° |
| O2 | C3 | H3 | 111.4° | 109.5° |
| C3 | O2 | C28 | 148.2° | 120.0° |
| C5 | C4 | H41 | 111.3° | 109.6° |
| C5 | C4 | H42 | 111.3° | 109.8° |
| C4 | C5 | C6 | 122.9° | 117.2° |
| C4 | C5 | C10 | 109.4° | 117.9° |
| H41 | C4 | H42 | 99.1° | 109.8° |
| C6 | C5 | C10 | 127.8° | 124.8° |
| C5 | C6 | C7 | 121.4° | 122.6° |
| C5 | C6 | H6 | 109.4° | 118.8° |
| C5 | C10 | C9 | 109.9° | 112.9° |
| C5 | C10 | C19 | 106.1° | 108.1° |
| C7 | C6 | H6 | 129.2° | 118.5° |
| C6 | C7 | C8 | 115.8° | 109.2° |
| C6 | C7 | H71 | 109.9° | 109.5° |
| C6 | C7 | H72 | 109.9° | 109.5° |
| C8 | C7 | H71 | 109.9° | 109.6° |
| C8 | C7 | H72 | 109.9° | 109.5° |
| C7 | C8 | C9 | 111.3° | 108.5° |
| C7 | C8 | C14 | 112.7° | 109.5° |
| C7 | C8 | H8 | 107.9° | 110.3° |
| H71 | C7 | H72 | 100.3° | 109.5° |
| C9 | C8 | C14 | 114.6° | 107.5° |
| C9 | C8 | H8 | 105.5° | 110.7° |
| C8 | C9 | C10 | 112.3° | 110.5° |
| C8 | C9 | C11 | 109.4° | 111.3° |
| C8 | C9 | H9 | 111.0° | 108.5° |
| C14 | C8 | H8 | 104.0° | 110.3° |
| C8 | C14 | C13 | 112.7° | 106.8° |
| C8 | C14 | C15 | 122.4° | 116.0° |
| C8 | C14 | H14 | 95.9° | 111.3° |
| C10 | C9 | C11 | 117.7° | 109.7° |
| C10 | C9 | H9 | 101.2° | 108.4° |
| C9 | C10 | C19 | 113.3° | 108.2° |
| C11 | C9 | H9 | 104.5° | 108.3° |
| C9 | C11 | C12 | 112.7° | 111.8° |
| C9 | C11 | H111 | 111.0° | 109.0° |
| C9 | C11 | H112 | 111.1° | 109.1° |
| C10 | C19 | H191 | 109.5° | 109.5° |
| C10 | C19 | H192 | 112.2° | 109.4° |
| C10 | C19 | H193 | 112.2° | 109.4° |
| C12 | C11 | H111 | 111.0° | 109.0° |
| C12 | C11 | H112 | 111.0° | 109.0° |
| C11 | C12 | C13 | 113.3° | 107.1° |
| C11 | C12 | H121 | 110.8° | 109.9° |
| C11 | C12 | H122 | 110.8° | 109.9° |
| H111 | C11 | H112 | 99.3° | 108.9° |
| C13 | C12 | H121 | 110.8° | 110.0° |
| C13 | C12 | H122 | 110.8° | 109.9° |
| C12 | C13 | C14 | 109.7° | 107.1° |
| C12 | C13 | C17 | 111.9° | 116.4° |
| C12 | C13 | C18 | 112.6° | 109.9° |
| H121 | C12 | H122 | 99.5° | 109.9° |
| C14 | C13 | C17 | 101.6° | 103.5° |
| C14 | C13 | C18 | 110.3° | 109.9° |
| C13 | C14 | C15 | 106.9° | 101.6° |
| C13 | C14 | H14 | 115.2° | 110.1° |
| C17 | C13 | C18 | 110.2° | 109.8° |
| C13 | C17 | C16 | 97.0° | 105.3° |
| C13 | C17 | C20 | 119.9° | 110.3° |
| C13 | C17 | H17 | 115.0° | 110.3° |
| C13 | C18 | H181 | 112.6° | 109.5° |
| C13 | C18 | H182 | 111.0° | 109.5° |
| C13 | C18 | H183 | 111.0° | 109.5° |
| C15 | C14 | H14 | 103.3° | 110.3° |
| C14 | C15 | C16 | 94.8° | 103.1° |
| C14 | C15 | H151 | 117.9° | 110.8° |
| C14 | C15 | H152 | 117.9° | 110.4° |
| C16 | C15 | H151 | 118.0° | 110.7° |
| C16 | C15 | H152 | 117.9° | 110.8° |
| C15 | C16 | C17 | 118.5° | 106.4° |
| C15 | C16 | H161 | 109.0° | 110.2° |
| C15 | C16 | H162 | 108.9° | 110.0° |
| H151 | C15 | H152 | 92.4° | 110.7° |
| C17 | C16 | H161 | 108.9° | 110.1° |
| C17 | C16 | H162 | 108.9° | 110.1° |
| C16 | C17 | C20 | 118.5° | 110.4° |
| C16 | C17 | H17 | 116.6° | 110.2° |
| H161 | C16 | H162 | 101.1° | 110.1° |
| C20 | C17 | H17 | 91.6° | 110.2° |
| C17 | C20 | C21 | 115.3° | 109.5° |
| C17 | C20 | C22 | 109.8° | 109.5° |
| C17 | C20 | H20 | 107.0° | 109.5° |
| H181 | C18 | H182 | 111.1° | 109.5° |
| H181 | C18 | H183 | 111.1° | 109.4° |
| H182 | C18 | H183 | 99.2° | 109.4° |
| H191 | C19 | H192 | 112.2° | 109.5° |
| H191 | C19 | H193 | 112.2° | 109.5° |
| H192 | C19 | H193 | 98.2° | 109.5° |
| C21 | C20 | C22 | 114.5° | 109.4° |
| C21 | C20 | H20 | 101.4° | 109.5° |
| C20 | C21 | H211 | 115.3° | 109.5° |
| C20 | C21 | H212 | 110.1° | 109.4° |
| C20 | C21 | H213 | 110.1° | 109.6° |
| C22 | C20 | H20 | 107.9° | 109.4° |
| C20 | C22 | C23 | 121.9° | 109.5° |
| C20 | C22 | H221 | 107.8° | 109.5° |
| C20 | C22 | H222 | 107.8° | 109.5° |
| H211 | C21 | H212 | 110.1° | 109.4° |
| H211 | C21 | H213 | 110.2° | 109.5° |
| H212 | C21 | H213 | 100.1° | 109.5° |
| C23 | C22 | H221 | 107.8° | 109.4° |
| C23 | C22 | H222 | 107.8° | 109.4° |
| C22 | C23 | C24 | 115.2° | 109.5° |
| C22 | C23 | H231 | 110.1° | 109.4° |
| C22 | C23 | H232 | 110.1° | 109.5° |
| H221 | C22 | H222 | 102.0° | 109.5° |
| C24 | C23 | H231 | 110.1° | 109.4° |
| C24 | C23 | H232 | 110.1° | 109.5° |
| C23 | C24 | C25 | 123.1° | 109.5° |
| C23 | C24 | H241 | 107.4° | 109.4° |
| C23 | C24 | H242 | 107.4° | 109.5° |
| H231 | C23 | H232 | 100.1° | 109.4° |
| C25 | C24 | H241 | 107.4° | 109.5° |
| C25 | C24 | H242 | 107.4° | 109.5° |
| C24 | C25 | C26 | 115.5° | 109.5° |
| C24 | C25 | C27 | 115.2° | 109.5° |
| C24 | C25 | H25 | 104.6° | 109.5° |
| H241 | C24 | H242 | 102.4° | 109.5° |
| C26 | C25 | C27 | 118.9° | 109.4° |
| C26 | C25 | H25 | 98.7° | 109.4° |
| C25 | C26 | H261 | 115.5° | 109.6° |
| C25 | C26 | H262 | 110.0° | 109.5° |
| C25 | C26 | H263 | 110.0° | 109.5° |
| C27 | C25 | H25 | 99.2° | 109.5° |
| C25 | C27 | H271 | 115.2° | 109.5° |
| C25 | C27 | H272 | 110.1° | 109.4° |
| C25 | C27 | H273 | 110.1° | 109.5° |
| H261 | C26 | H262 | 110.0° | 109.5° |
| H261 | C26 | H263 | 110.0° | 109.4° |
| H262 | C26 | H263 | 100.2° | 109.4° |
| H271 | C27 | H272 | 110.1° | 109.4° |
| H271 | C27 | H273 | 110.2° | 109.4° |
| H272 | C27 | H273 | 100.1° | 109.5° |
| C29 | C28 | O1 | 110.8° | 120.0° |
| C29 | C28 | O2 | 136.1° | 120.0° |
| C28 | C29 | C30 | 121.8° | 109.5° |
| C28 | C29 | H291 | 107.8° | 109.5° |
| C28 | C29 | H292 | 107.8° | 109.5° |
| O1 | C28 | O2 | 113.2° | 120.0° |
| C30 | C29 | H291 | 107.8° | 109.4° |
| C30 | C29 | H292 | 107.8° | 109.5° |
| C29 | C30 | C31 | 114.9° | 109.5° |
| C29 | C30 | H301 | 110.2° | 109.4° |
| C29 | C30 | H302 | 110.2° | 109.5° |
| H291 | C29 | H292 | 102.1° | 109.4° |
| C31 | C30 | H301 | 110.3° | 109.4° |
| C31 | C30 | H302 | 110.2° | 109.5° |
| C30 | C31 | C32 | 114.9° | 109.5° |
| C30 | C31 | H311 | 110.2° | 109.5° |
| C30 | C31 | H312 | 110.2° | 109.5° |
| H301 | C30 | H302 | 100.0° | 109.5° |
| C32 | C31 | H311 | 110.2° | 109.5° |
| C32 | C31 | H312 | 110.3° | 109.5° |
| C31 | C32 | C33 | 115.0° | 109.5° |
| C31 | C32 | H321 | 110.1° | 109.4° |
| C31 | C32 | H322 | 110.2° | 109.4° |
| H311 | C31 | H312 | 100.0° | 109.4° |
| C33 | C32 | H321 | 110.2° | 109.5° |
| C33 | C32 | H322 | 110.2° | 109.5° |
| C32 | C33 | C34 | 105.5° | 109.5° |
| C32 | C33 | H331 | 113.7° | 109.5° |
| C32 | C33 | H332 | 113.7° | 109.5° |
| H321 | C32 | H322 | 100.1° | 109.5° |
| C34 | C33 | H331 | 113.7° | 109.4° |
| C34 | C33 | H332 | 113.7° | 109.5° |
| C33 | C34 | C35 | 115.8° | 109.5° |
| C33 | C34 | H341 | 109.9° | 109.4° |
| C33 | C34 | H342 | 109.9° | 109.5° |
| H331 | C33 | H332 | 96.7° | 109.5° |
| C35 | C34 | H341 | 109.9° | 109.4° |
| C35 | C34 | H342 | 109.9° | 109.5° |
| C34 | C35 | C36 | 105.4° | 109.5° |
| C34 | C35 | H351 | 113.7° | 109.5° |
| C34 | C35 | H352 | 113.7° | 109.5° |
| H341 | C34 | H342 | 100.3° | 109.4° |
| C36 | C35 | H351 | 113.8° | 109.5° |
| C36 | C35 | H352 | 113.8° | 109.5° |
| C35 | C36 | C37 | 121.7° | 120.0° |
| C35 | C36 | H36 | 119.6° | 120.0° |
| H351 | C35 | H352 | 96.7° | 109.5° |
| C37 | C36 | H36 | 118.7° | 119.9° |
| C36 | C37 | C38 | 124.0° | 120.0° |
| C36 | C37 | H37 | 117.8° | 120.0° |
| C38 | C37 | H37 | 118.2° | 120.0° |
| C37 | C38 | C39 | 113.2° | 109.4° |
| C37 | C38 | H381 | 110.8° | 109.4° |
| C37 | C38 | H382 | 110.9° | 109.5° |
| C39 | C38 | H381 | 110.8° | 109.5° |
| C39 | C38 | H382 | 110.9° | 109.5° |
| C38 | C39 | C40 | 113.7° | 120.0° |
| C38 | C39 | H39 | 122.9° | 120.0° |
| H381 | C38 | H382 | 99.4° | 109.5° |
| C40 | C39 | H39 | 123.4° | 120.0° |
| C39 | C40 | C41 | 124.8° | 120.0° |
| C39 | C40 | H40 | 118.1° | 120.0° |
| C41 | C40 | H40 | 117.1° | 120.0° |
| C40 | C41 | C42 | 122.0° | 109.5° |
| C40 | C41 | H411 | 107.8° | 109.5° |
| C40 | C41 | H412 | 107.8° | 109.5° |
| C42 | C41 | H411 | 107.7° | 109.5° |
| C42 | C41 | H412 | 107.7° | 109.4° |
| C41 | C42 | C43 | 105.3° | 109.5° |
| C41 | C42 | H421 | 113.8° | 109.5° |
| C41 | C42 | H422 | 113.8° | 109.4° |
| H411 | C41 | H412 | 102.1° | 109.5° |
| C43 | C42 | H421 | 113.8° | 109.5° |
| C43 | C42 | H422 | 113.8° | 109.5° |
| C42 | C43 | C44 | 110.9° | 109.5° |
| C42 | C43 | H431 | 111.7° | 109.5° |
| C42 | C43 | H432 | 111.7° | 109.4° |
| H421 | C42 | H422 | 96.7° | 109.4° |
| C44 | C43 | H431 | 111.7° | 109.5° |
| C44 | C43 | H432 | 111.7° | 109.5° |
| C43 | C44 | C45 | 114.3° | 109.5° |
| C43 | C44 | H441 | 110.5° | 109.5° |
| C43 | C44 | H442 | 110.5° | 109.5° |
| H431 | C43 | H432 | 98.7° | 109.5° |
| C45 | C44 | H441 | 110.4° | 109.5° |
| C45 | C44 | H442 | 110.4° | 109.5° |
| C44 | C45 | H451 | 114.3° | 109.5° |
| C44 | C45 | H452 | 110.4° | 109.4° |
| C44 | C45 | H453 | 110.4° | 109.5° |
| H441 | C44 | H442 | 99.8° | 109.5° |
| H451 | C45 | H452 | 110.4° | 109.5° |
| H451 | C45 | H453 | 110.4° | 109.5° |
| H452 | C45 | H453 | 99.9° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C10 | H11 | 125.3° | 120.0° |
| C2 | C1 | C10 | H12 | 125.3° | 120.0° |
| C2 | C1 | H11 | H12 | 116.1° | 120.0° |
| C1 | C2 | C3 | H21 | 125.2° | 120.1° |
| C1 | C2 | C3 | H22 | 125.2° | 120.1° |
| C1 | C2 | H21 | H22 | 116.4° | 120.0° |
| C1 | C2 | C3 | C4 | 56.3° | 63.7° |
| C1 | C2 | C3 | O2 | 178.2° | 176.3° |
| C1 | C2 | C3 | H3 | 61.7° | 56.3° |
| C2 | C1 | C10 | C5 | 41.4° | 54.2° |
| C2 | C1 | C10 | C9 | 161.2° | 178.7° |
| C2 | C1 | C10 | C19 | 76.3° | 63.3° |
| C10 | C1 | H11 | H12 | 116.0° | 120.0° |
| C10 | C1 | C2 | C3 | 46.5° | 62.8° |
| C10 | C1 | C2 | H21 | 78.8° | 177.2° |
| C10 | C1 | C2 | H22 | 171.8° | 57.3° |
| C1 | C10 | C5 | C4 | 43.7° | 51.1° |
| C1 | C10 | C5 | C6 | 136.4° | 132.1° |
| C1 | C10 | C5 | C9 | 117.5° | 122.9° |
| C1 | C10 | C5 | C19 | 119.6° | 117.5° |
| C1 | C10 | C9 | C8 | 164.9° | 160.2° |
| C1 | C10 | C9 | C19 | 120.0° | 117.9° |
| C1 | C10 | C9 | C11 | 66.6° | 76.6° |
| C1 | C10 | C9 | H9 | 46.5° | 41.5° |
| C1 | C10 | C19 | H191 | 180.0° | 60.0° |
| C1 | C10 | C19 | H192 | 54.7° | 180.0° |
| C1 | C10 | C19 | H193 | 54.7° | 60.0° |
| H11 | C1 | C2 | C3 | 78.8° | 57.1° |
| H11 | C1 | C2 | H21 | 156.0° | 62.9° |
| H11 | C1 | C2 | H22 | 46.5° | 177.2° |
| H11 | C1 | C10 | C5 | 83.9° | 65.8° |
| H11 | C1 | C10 | C9 | 35.9° | 58.8° |
| H11 | C1 | C10 | C19 | 158.4° | 176.7° |
| H12 | C1 | C2 | C3 | 171.8° | 177.2° |
| H12 | C1 | C2 | H21 | 46.5° | 57.2° |
| H12 | C1 | C2 | H22 | 62.9° | 62.7° |
| H12 | C1 | C10 | C5 | 166.7° | 174.2° |
| H12 | C1 | C10 | C9 | 73.5° | 61.3° |
| H12 | C1 | C10 | C19 | 49.0° | 56.7° |
| C3 | C2 | H21 | H22 | 116.5° | 119.8° |
| C2 | C3 | C4 | O2 | 124.1° | 120.0° |
| C2 | C3 | C4 | H3 | 115.5° | 120.0° |
| C2 | C3 | O2 | H3 | 115.7° | 120.0° |
| C2 | C3 | C4 | C5 | 60.5° | 55.1° |
| C2 | C3 | C4 | H41 | 64.7° | 63.0° |
| C2 | C3 | C4 | H42 | 174.3° | 176.5° |
| C2 | C3 | O2 | C28 | 83.7° | 150.0° |
| H21 | C2 | C3 | C4 | 69.0° | 176.2° |
| H21 | C2 | C3 | O2 | 53.0° | 56.2° |
| H21 | C2 | C3 | H3 | 173.1° | 63.8° |
| H22 | C2 | C3 | C4 | 178.5° | 56.4° |
| H22 | C2 | C3 | O2 | 56.6° | 63.6° |
| H22 | C2 | C3 | H3 | 63.6° | 176.4° |
| C4 | C3 | O2 | H3 | 118.5° | 120.0° |
| C3 | C4 | C5 | H41 | 125.2° | 116.5° |
| C3 | C4 | C5 | H42 | 125.2° | 122.9° |
| C3 | C4 | H41 | H42 | 117.2° | 122.0° |
| C3 | C4 | C5 | C6 | 127.3° | 131.6° |
| C3 | C4 | C5 | C10 | 52.9° | 51.4° |
| C4 | C3 | O2 | C28 | 150.5° | 90.0° |
| O2 | C3 | C4 | C5 | 175.4° | 175.1° |
| O2 | C3 | C4 | H41 | 59.4° | 57.0° |
| O2 | C3 | C4 | H42 | 50.2° | 63.5° |
| C3 | O2 | C28 | C29 | 173.3° | 180.0° |
| C3 | O2 | C28 | O1 | 5.9° | 0.0° |
| H3 | C3 | C4 | C5 | 55.0° | 64.9° |
| H3 | C3 | C4 | H41 | 179.8° | 176.9° |
| H3 | C3 | C4 | H42 | 70.3° | 56.5° |
| H3 | C3 | O2 | C28 | 32.0° | 30.0° |
| C5 | C4 | H41 | H42 | 117.2° | 120.6° |
| C4 | C5 | C6 | C10 | 179.8° | 176.8° |
| C4 | C5 | C6 | C7 | 179.6° | 178.3° |
| C4 | C5 | C6 | H6 | 0.4° | 0.6° |
| C4 | C5 | C10 | C9 | 161.2° | 173.9° |
| C4 | C5 | C10 | C19 | 75.9° | 66.4° |
| H41 | C4 | C5 | C6 | 107.5° | 112.0° |
| H41 | C4 | C5 | C10 | 72.3° | 65.1° |
| H42 | C4 | C5 | C6 | 2.0° | 8.7° |
| H42 | C4 | C5 | C10 | 178.1° | 174.3° |
| C5 | C6 | C7 | H6 | 180.0° | 177.7° |
| C5 | C6 | C7 | C8 | 10.1° | 28.7° |
| C5 | C6 | C7 | H71 | 135.4° | 91.3° |
| C5 | C6 | C7 | H72 | 115.1° | 148.6° |
| C6 | C5 | C10 | C9 | 18.9° | 9.3° |
| C6 | C5 | C10 | C19 | 103.9° | 110.3° |
| C10 | C5 | C6 | C7 | 0.6° | 4.9° |
| C10 | C5 | C6 | H6 | 179.4° | 177.4° |
| C5 | C10 | C9 | C8 | 43.5° | 37.7° |
| C5 | C10 | C9 | C19 | 118.5° | 119.6° |
| C5 | C10 | C9 | C11 | 171.9° | 160.9° |
| C5 | C10 | C9 | H9 | 74.9° | 81.0° |
| C5 | C10 | C19 | H191 | 58.6° | 58.4° |
| C5 | C10 | C19 | H192 | 176.2° | 61.6° |
| C5 | C10 | C19 | H193 | 66.7° | 178.3° |
| C6 | C7 | C8 | H71 | 125.3° | 120.0° |
| C6 | C7 | C8 | H72 | 125.2° | 119.8° |
| C6 | C7 | H71 | H72 | 115.7° | 120.1° |
| C6 | C7 | C8 | C9 | 35.2° | 55.9° |
| C6 | C7 | C8 | C14 | 165.7° | 173.0° |
| C6 | C7 | C8 | H8 | 80.1° | 65.5° |
| H6 | C6 | C7 | C8 | 169.9° | 153.5° |
| H6 | C6 | C7 | H71 | 44.6° | 86.4° |
| H6 | C6 | C7 | H72 | 64.9° | 33.7° |
| C8 | C7 | H71 | H72 | 115.7° | 120.2° |
| C7 | C8 | C9 | C14 | 129.4° | 118.3° |
| C7 | C8 | C9 | H8 | 116.8° | 121.2° |
| C7 | C8 | C14 | H8 | 116.6° | 121.5° |
| C7 | C8 | C9 | C10 | 53.9° | 62.1° |
| C7 | C8 | C9 | C11 | 173.4° | 175.7° |
| C7 | C8 | C9 | H9 | 58.6° | 56.5° |
| C7 | C8 | C14 | C13 | 179.3° | 177.5° |
| C7 | C8 | C14 | C15 | 50.9° | 65.1° |
| C7 | C8 | C14 | H14 | 58.8° | 62.2° |
| H71 | C7 | C8 | C9 | 160.5° | 64.1° |
| H71 | C7 | C8 | C14 | 69.1° | 53.0° |
| H71 | C7 | C8 | H8 | 45.1° | 174.5° |
| H72 | C7 | C8 | C9 | 90.0° | 175.8° |
| H72 | C7 | C8 | C14 | 40.4° | 67.1° |
| H72 | C7 | C8 | H8 | 154.7° | 54.3° |
| C9 | C8 | C14 | H8 | 114.7° | 120.8° |
| C8 | C9 | C10 | C11 | 128.4° | 123.1° |
| C8 | C9 | C10 | H9 | 118.4° | 118.7° |
| C8 | C9 | C11 | H9 | 119.0° | 119.2° |
| C8 | C9 | C10 | C19 | 75.0° | 81.9° |
| C8 | C9 | C11 | C12 | 46.3° | 54.2° |
| C8 | C9 | C11 | H111 | 171.6° | 174.8° |
| C8 | C9 | C11 | H112 | 78.9° | 66.4° |
| C9 | C8 | C14 | C13 | 50.6° | 64.8° |
| C9 | C8 | C14 | C15 | 179.7° | 177.2° |
| C9 | C8 | C14 | H14 | 69.9° | 55.4° |
| C14 | C8 | C9 | C10 | 176.7° | 179.5° |
| C14 | C8 | C9 | C11 | 44.0° | 57.3° |
| C14 | C8 | C9 | H9 | 70.9° | 61.8° |
| C8 | C14 | C13 | C12 | 56.7° | 70.5° |
| C8 | C14 | C13 | C15 | 137.3° | 122.0° |
| C8 | C14 | C13 | H14 | 108.6° | 121.0° |
| C8 | C14 | C13 | C17 | 175.2° | 166.0° |
| C8 | C14 | C13 | C18 | 67.9° | 48.7° |
| C8 | C14 | C15 | H14 | 105.9° | 127.8° |
| C8 | C14 | C15 | C16 | 173.5° | 156.6° |
| C8 | C14 | C15 | H151 | 48.3° | 84.9° |
| C8 | C14 | C15 | H152 | 61.3° | 38.2° |
| H8 | C8 | C9 | C10 | 62.9° | 59.0° |
| H8 | C8 | C9 | C11 | 69.8° | 63.2° |
| H8 | C8 | C9 | H9 | 175.3° | 177.7° |
| H8 | C8 | C14 | C13 | 64.1° | 56.0° |
| H8 | C8 | C14 | C15 | 65.6° | 56.4° |
| H8 | C8 | C14 | H14 | 175.4° | 176.3° |
| C10 | C9 | C11 | H9 | 111.2° | 118.2° |
| C10 | C9 | C11 | C12 | 176.1° | 176.8° |
| C10 | C9 | C11 | H111 | 58.7° | 62.6° |
| C10 | C9 | C11 | H112 | 50.9° | 56.2° |
| C9 | C10 | C19 | H191 | 62.1° | 179.1° |
| C9 | C10 | C19 | H192 | 63.2° | 60.9° |
| C9 | C10 | C19 | H193 | 172.6° | 59.1° |
| C11 | C9 | C10 | C19 | 53.4° | 41.3° |
| C9 | C11 | C12 | H111 | 125.2° | 120.5° |
| C9 | C11 | C12 | H112 | 125.3° | 120.6° |
| C9 | C11 | H111 | H112 | 117.0° | 118.9° |
| C9 | C11 | C12 | C13 | 56.8° | 57.5° |
| C9 | C11 | C12 | H121 | 68.4° | 62.0° |
| C9 | C11 | C12 | H122 | 177.9° | 176.9° |
| H9 | C9 | C10 | C19 | 166.5° | 159.4° |
| H9 | C9 | C11 | C12 | 72.6° | 65.0° |
| H9 | C9 | C11 | H111 | 52.6° | 55.6° |
| H9 | C9 | C11 | H112 | 162.1° | 174.4° |
| C10 | C19 | H191 | H192 | 125.2° | 120.0° |
| C10 | C19 | H191 | H193 | 125.3° | 119.9° |
| C10 | C19 | H192 | H193 | 118.1° | 120.0° |
| C12 | C11 | H111 | H112 | 116.9° | 118.9° |
| C11 | C12 | C13 | H121 | 125.3° | 119.4° |
| C11 | C12 | C13 | H122 | 125.3° | 119.4° |
| C11 | C12 | H121 | H122 | 116.7° | 121.1° |
| C11 | C12 | C13 | C14 | 60.7° | 64.9° |
| C11 | C12 | C13 | C17 | 172.7° | 179.9° |
| C11 | C12 | C13 | C18 | 62.5° | 54.3° |
| H111 | C11 | C12 | C13 | 177.9° | 178.0° |
| H111 | C11 | C12 | H121 | 56.8° | 58.5° |
| H111 | C11 | C12 | H122 | 52.6° | 62.6° |
| H112 | C11 | C12 | C13 | 68.4° | 63.2° |
| H112 | C11 | C12 | H121 | 166.3° | 177.3° |
| H112 | C11 | C12 | H122 | 56.8° | 56.2° |
| C13 | C12 | H121 | H122 | 116.7° | 121.2° |
| C12 | C13 | C14 | C17 | 118.5° | 123.5° |
| C12 | C13 | C14 | C18 | 124.6° | 119.3° |
| C12 | C13 | C17 | C18 | 126.1° | 125.6° |
| C12 | C13 | C14 | C15 | 166.0° | 167.5° |
| C12 | C13 | C14 | H14 | 52.0° | 50.5° |
| C12 | C13 | C17 | C16 | 145.6° | 146.2° |
| C12 | C13 | C17 | C20 | 85.7° | 94.7° |
| C12 | C13 | C17 | H17 | 21.9° | 27.2° |
| C12 | C13 | C18 | H181 | 180.0° | 61.3° |
| C12 | C13 | C18 | H182 | 54.7° | 178.7° |
| C12 | C13 | C18 | H183 | 54.7° | 58.7° |
| H121 | C12 | C13 | C14 | 64.5° | 54.5° |
| H121 | C12 | C13 | C17 | 47.4° | 60.6° |
| H121 | C12 | C13 | C18 | 172.2° | 173.8° |
| H122 | C12 | C13 | C14 | 174.0° | 175.7° |
| H122 | C12 | C13 | C17 | 62.1° | 60.5° |
| H122 | C12 | C13 | C18 | 62.7° | 65.1° |
| C14 | C13 | C17 | C18 | 116.9° | 117.3° |
| C13 | C14 | C15 | H14 | 122.0° | 116.8° |
| C13 | C14 | C15 | C16 | 41.4° | 41.2° |
| C13 | C14 | C15 | H151 | 83.9° | 159.7° |
| C13 | C14 | C15 | H152 | 166.6° | 77.2° |
| C14 | C13 | C17 | C16 | 28.7° | 29.0° |
| C14 | C13 | C17 | C20 | 157.3° | 148.1° |
| C14 | C13 | C17 | H17 | 95.0° | 89.9° |
| C14 | C13 | C18 | H181 | 57.1° | 56.2° |
| C14 | C13 | C18 | H182 | 177.6° | 63.8° |
| C14 | C13 | C18 | H183 | 68.2° | 176.2° |
| C17 | C13 | C14 | C15 | 47.5° | 44.0° |
| C17 | C13 | C14 | H14 | 66.5° | 73.0° |
| C13 | C17 | C16 | C15 | 3.9° | 3.4° |
| C13 | C17 | C16 | C20 | 129.6° | 119.0° |
| C13 | C17 | C16 | H17 | 122.5° | 119.0° |
| C13 | C17 | C16 | H161 | 121.3° | 122.7° |
| C13 | C17 | C16 | H162 | 129.2° | 115.8° |
| C13 | C17 | C20 | H17 | 120.2° | 122.0° |
| C17 | C13 | C18 | H181 | 54.3° | 169.5° |
| C17 | C13 | C18 | H182 | 71.0° | 49.4° |
| C17 | C13 | C18 | H183 | 179.6° | 70.6° |
| C13 | C17 | C20 | C21 | 44.4° | 65.5° |
| C13 | C17 | C20 | C22 | 175.5° | 174.5° |
| C13 | C17 | C20 | H20 | 67.6° | 54.5° |
| C18 | C13 | C14 | C15 | 69.3° | 73.3° |
| C18 | C13 | C14 | H14 | 176.6° | 169.8° |
| C18 | C13 | C17 | C16 | 88.3° | 88.2° |
| C18 | C13 | C17 | C20 | 40.4° | 30.9° |
| C18 | C13 | C17 | H17 | 148.0° | 152.8° |
| C13 | C18 | H181 | H182 | 125.3° | 120.1° |
| C13 | C18 | H181 | H183 | 125.2° | 120.0° |
| C13 | C18 | H182 | H183 | 116.9° | 120.0° |
| C14 | C15 | C16 | H151 | 125.2° | 118.6° |
| C14 | C15 | C16 | H152 | 125.2° | 118.2° |
| C14 | C15 | H151 | H152 | 123.5° | 122.9° |
| C14 | C15 | C16 | C17 | 22.8° | 23.8° |
| C14 | C15 | C16 | H161 | 148.1° | 95.5° |
| C14 | C15 | C16 | H162 | 102.4° | 143.0° |
| H14 | C14 | C15 | C16 | 80.6° | 75.6° |
| H14 | C14 | C15 | H151 | 154.2° | 42.9° |
| H14 | C14 | C15 | H152 | 44.7° | 166.0° |
| C16 | C15 | H151 | H152 | 123.6° | 123.3° |
| C15 | C16 | C17 | H161 | 125.3° | 119.3° |
| C15 | C16 | C17 | H162 | 125.3° | 119.2° |
| C15 | C16 | H161 | H162 | 114.7° | 121.5° |
| C15 | C16 | C17 | C20 | 133.6° | 122.4° |
| C15 | C16 | C17 | H17 | 118.6° | 115.6° |
| H151 | C15 | C16 | C17 | 102.4° | 142.3° |
| H151 | C15 | C16 | H161 | 22.8° | 23.0° |
| H151 | C15 | C16 | H162 | 132.3° | 98.5° |
| H152 | C15 | C16 | C17 | 148.0° | 94.4° |
| H152 | C15 | C16 | H161 | 86.7° | 146.3° |
| H152 | C15 | C16 | H162 | 22.8° | 24.8° |
| C17 | C16 | H161 | H162 | 114.6° | 121.5° |
| C16 | C17 | C20 | H17 | 121.6° | 122.0° |
| C16 | C17 | C20 | C21 | 162.5° | 178.5° |
| C16 | C17 | C20 | C22 | 66.3° | 58.5° |
| C16 | C17 | C20 | H20 | 50.6° | 61.5° |
| H161 | C16 | C17 | C20 | 8.3° | 118.3° |
| H161 | C16 | C17 | H17 | 116.1° | 3.7° |
| H162 | C16 | C17 | C20 | 101.2° | 3.2° |
| H162 | C16 | C17 | H17 | 6.7° | 125.2° |
| C17 | C20 | C21 | C22 | 128.9° | 120.0° |
| C17 | C20 | C21 | H20 | 115.2° | 120.0° |
| C17 | C20 | C22 | H20 | 116.4° | 120.0° |
| C17 | C20 | C21 | H211 | 180.0° | 57.0° |
| C17 | C20 | C21 | H212 | 54.7° | 63.0° |
| C17 | C20 | C21 | H213 | 54.7° | 177.0° |
| C17 | C20 | C22 | C23 | 173.0° | 180.0° |
| C17 | C20 | C22 | H221 | 47.7° | 60.0° |
| C17 | C20 | C22 | H222 | 61.7° | 60.1° |
| H17 | C17 | C20 | C21 | 75.9° | 56.5° |
| H17 | C17 | C20 | C22 | 55.3° | 63.5° |
| H17 | C17 | C20 | H20 | 172.2° | 176.5° |
| H181 | C18 | H182 | H183 | 117.0° | 119.9° |
| H191 | C19 | H192 | H193 | 118.2° | 120.0° |
| C21 | C20 | C22 | H20 | 112.1° | 120.0° |
| C20 | C21 | H211 | H212 | 125.2° | 119.9° |
| C20 | C21 | H211 | H213 | 125.3° | 120.1° |
| C20 | C21 | H212 | H213 | 115.9° | 120.1° |
| C21 | C20 | C22 | C23 | 55.4° | 60.0° |
| C21 | C20 | C22 | H221 | 179.3° | 180.0° |
| C21 | C20 | C22 | H222 | 69.9° | 60.0° |
| C22 | C20 | C21 | H211 | 51.1° | 63.1° |
| C22 | C20 | C21 | H212 | 74.1° | 177.0° |
| C22 | C20 | C21 | H213 | 176.4° | 57.0° |
| C20 | C22 | C23 | H221 | 125.3° | 120.0° |
| C20 | C22 | C23 | H222 | 125.3° | 120.0° |
| C20 | C22 | H221 | H222 | 113.3° | 120.0° |
| C20 | C22 | C23 | C24 | 85.3° | 180.0° |
| C20 | C22 | C23 | H231 | 39.9° | 60.0° |
| C20 | C22 | C23 | H232 | 149.4° | 60.0° |
| H20 | C20 | C21 | H211 | 64.8° | 177.0° |
| H20 | C20 | C21 | H212 | 169.9° | 57.1° |
| H20 | C20 | C21 | H213 | 60.5° | 62.9° |
| H20 | C20 | C22 | C23 | 56.7° | 60.0° |
| H20 | C20 | C22 | H221 | 68.6° | 60.0° |
| H20 | C20 | C22 | H222 | 178.1° | 180.0° |
| H211 | C21 | H212 | H213 | 116.0° | 119.9° |
| C23 | C22 | H221 | H222 | 113.4° | 120.0° |
| C22 | C23 | C24 | H231 | 125.3° | 120.0° |
| C22 | C23 | C24 | H232 | 125.2° | 120.1° |
| C22 | C23 | H231 | H232 | 115.9° | 120.0° |
| C22 | C23 | C24 | C25 | 170.4° | 180.0° |
| C22 | C23 | C24 | H241 | 45.1° | 60.0° |
| C22 | C23 | C24 | H242 | 64.3° | 60.0° |
| H221 | C22 | C23 | C24 | 149.4° | 60.0° |
| H221 | C22 | C23 | H231 | 85.3° | 180.0° |
| H221 | C22 | C23 | H232 | 24.2° | 60.0° |
| H222 | C22 | C23 | C24 | 40.0° | 60.0° |
| H222 | C22 | C23 | H231 | 165.2° | 60.0° |
| H222 | C22 | C23 | H232 | 85.3° | 180.0° |
| C24 | C23 | H231 | H232 | 115.9° | 120.0° |
| C23 | C24 | C25 | H241 | 125.2° | 119.9° |
| C23 | C24 | C25 | H242 | 125.3° | 120.0° |
| C23 | C24 | H241 | H242 | 112.9° | 120.0° |
| C23 | C24 | C25 | C26 | 34.9° | 180.0° |
| C23 | C24 | C25 | C27 | 179.7° | 60.1° |
| C23 | C24 | C25 | H25 | 72.5° | 60.0° |
| H231 | C23 | C24 | C25 | 64.4° | 60.0° |
| H231 | C23 | C24 | H241 | 170.4° | 180.0° |
| H231 | C23 | C24 | H242 | 60.9° | 60.0° |
| H232 | C23 | C24 | C25 | 45.1° | 59.9° |
| H232 | C23 | C24 | H241 | 80.1° | 60.0° |
| H232 | C23 | C24 | H242 | 170.4° | 180.0° |
| C25 | C24 | H241 | H242 | 113.0° | 120.1° |
| C24 | C25 | C26 | C27 | 143.5° | 120.0° |
| C24 | C25 | C26 | H25 | 110.9° | 120.0° |
| C24 | C25 | C27 | H25 | 111.0° | 120.1° |
| C24 | C25 | C26 | H261 | 180.0° | 180.0° |
| C24 | C25 | C26 | H262 | 54.7° | 60.0° |
| C24 | C25 | C26 | H263 | 54.8° | 59.9° |
| C24 | C25 | C27 | H271 | 180.0° | 59.9° |
| C24 | C25 | C27 | H272 | 54.7° | 60.0° |
| C24 | C25 | C27 | H273 | 54.7° | 179.9° |
| H241 | C24 | C25 | C26 | 160.1° | 60.1° |
| H241 | C24 | C25 | C27 | 55.1° | 180.0° |
| H241 | C24 | C25 | H25 | 52.7° | 59.9° |
| H242 | C24 | C25 | C26 | 90.4° | 60.0° |
| H242 | C24 | C25 | C27 | 54.4° | 59.9° |
| H242 | C24 | C25 | H25 | 162.2° | NaN° |
| C26 | C25 | C27 | H25 | 105.4° | 119.9° |
| C25 | C26 | H261 | H262 | 125.3° | 120.0° |
| C25 | C26 | H261 | H263 | 125.2° | 120.0° |
| C25 | C26 | H262 | H263 | 115.8° | 120.0° |
| C26 | C25 | C27 | H271 | 36.4° | 60.0° |
| C26 | C25 | C27 | H272 | 161.7° | 180.0° |
| C26 | C25 | C27 | H273 | 88.9° | 60.0° |
| C27 | C25 | C26 | H261 | 36.5° | 60.0° |
| C27 | C25 | C26 | H262 | 88.8° | 180.0° |
| C27 | C25 | C26 | H263 | 161.8° | 60.0° |
| C25 | C27 | H271 | H272 | 125.3° | 120.0° |
| C25 | C27 | H271 | H273 | 125.3° | 120.1° |
| C25 | C27 | H272 | H273 | 115.9° | 120.1° |
| H25 | C25 | C26 | H261 | 69.1° | 60.0° |
| H25 | C25 | C26 | H262 | 165.6° | 60.0° |
| H25 | C25 | C26 | H263 | 56.1° | 180.0° |
| H25 | C25 | C27 | H271 | 69.0° | 180.0° |
| H25 | C25 | C27 | H272 | 56.3° | 60.1° |
| H25 | C25 | C27 | H273 | 165.7° | 60.0° |
| H261 | C26 | H262 | H263 | 115.9° | 119.9° |
| H271 | C27 | H272 | H273 | 116.0° | 119.9° |
| C29 | C28 | O1 | O2 | 179.4° | 180.0° |
| C28 | C29 | C30 | H291 | 125.2° | 120.0° |
| C28 | C29 | C30 | H292 | 125.2° | 120.1° |
| C28 | C29 | H291 | H292 | 113.3° | 120.1° |
| C28 | C29 | C30 | C31 | 117.2° | 180.0° |
| C28 | C29 | C30 | H301 | 8.1° | 60.0° |
| C28 | C29 | C30 | H302 | 117.5° | 60.0° |
| O1 | C28 | C29 | C30 | 102.7° | 0.0° |
| O1 | C28 | C29 | H291 | 22.5° | 120.0° |
| O1 | C28 | C29 | H292 | 132.0° | 120.0° |
| O2 | C28 | C29 | C30 | 78.0° | 180.0° |
| O2 | C28 | C29 | H291 | 156.7° | 60.0° |
| O2 | C28 | C29 | H292 | 47.2° | 60.0° |
| C30 | C29 | H291 | H292 | 113.5° | 119.9° |
| C29 | C30 | C31 | H301 | 125.3° | 119.9° |
| C29 | C30 | C31 | H302 | 125.3° | 120.0° |
| C29 | C30 | H301 | H302 | 116.0° | 120.0° |
| C29 | C30 | C31 | C32 | 107.3° | 180.0° |
| C29 | C30 | C31 | H311 | 18.0° | 60.0° |
| C29 | C30 | C31 | H312 | 127.4° | 59.9° |
| H291 | C29 | C30 | C31 | 117.6° | 60.0° |
| H291 | C29 | C30 | H301 | 117.1° | 179.9° |
| H291 | C29 | C30 | H302 | 7.7° | 60.0° |
| H292 | C29 | C30 | C31 | 8.0° | 59.9° |
| H292 | C29 | C30 | H301 | 133.3° | 60.0° |
| H292 | C29 | C30 | H302 | 117.2° | 179.9° |
| C31 | C30 | H301 | H302 | 116.1° | 120.0° |
| C30 | C31 | C32 | H311 | 125.2° | 120.0° |
| C30 | C31 | C32 | H312 | 125.3° | 120.0° |
| C30 | C31 | H311 | H312 | 116.0° | 120.0° |
| C30 | C31 | C32 | C33 | 86.5° | 180.0° |
| C30 | C31 | C32 | H321 | 38.7° | 59.9° |
| C30 | C31 | C32 | H322 | 148.2° | 60.0° |
| H301 | C30 | C31 | C32 | 127.5° | 60.0° |
| H301 | C30 | C31 | H311 | 107.3° | 180.0° |
| H301 | C30 | C31 | H312 | 2.2° | 60.0° |
| H302 | C30 | C31 | C32 | 18.0° | 60.0° |
| H302 | C30 | C31 | H311 | 143.2° | 60.0° |
| H302 | C30 | C31 | H312 | 107.3° | 180.0° |
| C32 | C31 | H311 | H312 | 116.1° | 120.0° |
| C31 | C32 | C33 | H321 | 125.2° | 120.0° |
| C31 | C32 | C33 | H322 | 125.2° | 120.0° |
| C31 | C32 | H321 | H322 | 116.0° | 119.9° |
| C31 | C32 | C33 | C34 | 179.8° | 180.0° |
| C31 | C32 | C33 | H331 | 54.9° | 60.0° |
| C31 | C32 | C33 | H332 | 54.5° | 60.0° |
| H311 | C31 | C32 | C33 | 148.2° | 60.0° |
| H311 | C31 | C32 | H321 | 86.5° | 180.0° |
| H311 | C31 | C32 | H322 | 23.0° | 60.0° |
| H312 | C31 | C32 | C33 | 38.7° | 60.0° |
| H312 | C31 | C32 | H321 | 164.0° | 60.1° |
| H312 | C31 | C32 | H322 | 86.5° | 180.0° |
| C33 | C32 | H321 | H322 | 116.1° | 120.1° |
| C32 | C33 | C34 | H331 | 125.3° | 120.0° |
| C32 | C33 | C34 | H332 | 125.3° | 120.0° |
| C32 | C33 | H331 | H332 | 119.5° | 120.0° |
| C32 | C33 | C34 | C35 | 129.3° | 180.0° |
| C32 | C33 | C34 | H341 | 4.1° | 60.0° |
| C32 | C33 | C34 | H342 | 105.4° | 60.0° |
| H321 | C32 | C33 | C34 | 54.5° | 60.0° |
| H321 | C32 | C33 | H331 | 179.9° | 180.0° |
| H321 | C32 | C33 | H332 | 70.7° | 60.0° |
| H322 | C32 | C33 | C34 | 55.0° | 60.0° |
| H322 | C32 | C33 | H331 | 70.3° | 60.0° |
| H322 | C32 | C33 | H332 | 179.7° | 180.0° |
| C34 | C33 | H331 | H332 | 119.6° | 120.0° |
| C33 | C34 | C35 | H341 | 125.2° | 120.0° |
| C33 | C34 | C35 | H342 | 125.2° | 120.1° |
| C33 | C34 | H341 | H342 | 115.7° | 120.0° |
| C33 | C34 | C35 | C36 | 163.4° | 180.0° |
| C33 | C34 | C35 | H351 | 38.1° | 60.0° |
| C33 | C34 | C35 | H352 | 71.3° | 60.0° |
| H331 | C33 | C34 | C35 | 105.4° | 60.0° |
| H331 | C33 | C34 | H341 | 129.4° | 180.0° |
| H331 | C33 | C34 | H342 | 19.9° | 60.0° |
| H332 | C33 | C34 | C35 | 4.1° | 60.0° |
| H332 | C33 | C34 | H341 | 121.2° | 60.0° |
| H332 | C33 | C34 | H342 | 129.4° | 180.0° |
| C35 | C34 | H341 | H342 | 115.8° | 120.0° |
| C34 | C35 | C36 | H351 | 125.3° | 120.0° |
| C34 | C35 | C36 | H352 | 125.3° | 120.0° |
| C34 | C35 | H351 | H352 | 119.6° | 120.0° |
| C34 | C35 | C36 | C37 | 172.2° | 127.6° |
| C34 | C35 | C36 | H36 | 7.8° | 52.5° |
| H341 | C34 | C35 | C36 | 71.4° | 60.0° |
| H341 | C34 | C35 | H351 | 163.3° | 180.0° |
| H341 | C34 | C35 | H352 | 53.9° | 60.0° |
| H342 | C34 | C35 | C36 | 38.2° | 60.0° |
| H342 | C34 | C35 | H351 | 87.2° | 60.0° |
| H342 | C34 | C35 | H352 | 163.5° | 180.0° |
| C36 | C35 | H351 | H352 | 119.7° | 120.0° |
| C35 | C36 | C37 | H36 | 180.0° | 180.0° |
| C35 | C36 | C37 | C38 | 2.4° | 7.2° |
| C35 | C36 | C37 | H37 | 177.6° | 172.8° |
| H351 | C35 | C36 | C37 | 62.5° | 112.5° |
| H351 | C35 | C36 | H36 | 117.5° | 67.5° |
| H352 | C35 | C36 | C37 | 46.9° | 7.6° |
| H352 | C35 | C36 | H36 | 133.1° | 172.5° |
| C36 | C37 | C38 | H37 | 180.0° | 180.0° |
| C36 | C37 | C38 | C39 | 114.2° | 127.8° |
| C36 | C37 | C38 | H381 | 11.1° | 7.8° |
| C36 | C37 | C38 | H382 | 120.5° | 112.2° |
| H36 | C36 | C37 | C38 | 177.6° | 172.8° |
| H36 | C36 | C37 | H37 | 2.4° | 7.2° |
| C37 | C38 | C39 | H381 | 125.3° | 120.0° |
| C37 | C38 | C39 | H382 | 125.3° | 120.0° |
| C37 | C38 | H381 | H382 | 116.7° | 120.0° |
| C37 | C38 | C39 | C40 | 154.4° | 127.6° |
| C37 | C38 | C39 | H39 | 25.6° | 52.4° |
| H37 | C37 | C38 | C39 | 65.8° | 52.3° |
| H37 | C37 | C38 | H381 | 168.9° | 172.3° |
| H37 | C37 | C38 | H382 | 59.5° | 67.7° |
| C39 | C38 | H381 | H382 | 116.7° | 120.0° |
| C38 | C39 | C40 | H39 | 180.0° | 180.0° |
| C38 | C39 | C40 | C41 | 2.7° | 7.2° |
| C38 | C39 | C40 | H40 | 177.3° | 172.7° |
| H381 | C38 | C39 | C40 | 80.3° | 112.5° |
| H381 | C38 | C39 | H39 | 99.7° | 67.5° |
| H382 | C38 | C39 | C40 | 29.1° | 7.6° |
| H382 | C38 | C39 | H39 | 150.9° | 172.4° |
| C39 | C40 | C41 | H40 | 180.0° | 179.9° |
| C39 | C40 | C41 | C42 | 150.6° | 127.8° |
| C39 | C40 | C41 | H411 | 25.4° | 7.8° |
| C39 | C40 | C41 | H412 | 84.2° | 112.2° |
| H39 | C39 | C40 | C41 | 177.3° | 172.8° |
| H39 | C39 | C40 | H40 | 2.7° | 7.3° |
| C40 | C41 | C42 | H411 | 125.2° | 120.0° |
| C40 | C41 | C42 | H412 | 125.3° | 120.0° |
| C40 | C41 | H411 | H412 | 113.4° | 120.0° |
| C40 | C41 | C42 | C43 | 157.8° | 180.0° |
| C40 | C41 | C42 | H421 | 32.5° | 60.0° |
| C40 | C41 | C42 | H422 | 77.0° | 60.0° |
| H40 | C40 | C41 | C42 | 29.4° | 52.3° |
| H40 | C40 | C41 | H411 | 154.6° | 172.3° |
| H40 | C40 | C41 | H412 | 95.9° | 67.7° |
| C42 | C41 | H411 | H412 | 113.3° | 119.9° |
| C41 | C42 | C43 | H421 | 125.3° | 120.1° |
| C41 | C42 | C43 | H422 | 125.2° | 120.0° |
| C41 | C42 | H421 | H422 | 119.7° | 119.9° |
| C41 | C42 | C43 | C44 | 142.9° | 180.0° |
| C41 | C42 | C43 | H431 | 17.7° | 60.0° |
| C41 | C42 | C43 | H432 | 91.8° | 60.0° |
| H411 | C41 | C42 | C43 | 76.9° | 60.0° |
| H411 | C41 | C42 | H421 | 157.7° | 180.0° |
| H411 | C41 | C42 | H422 | 48.3° | 60.0° |
| H412 | C41 | C42 | C43 | 32.5° | 60.0° |
| H412 | C41 | C42 | H421 | 92.8° | 60.0° |
| H412 | C41 | C42 | H422 | 157.8° | 180.0° |
| C43 | C42 | H421 | H422 | 119.7° | 120.0° |
| C42 | C43 | C44 | H431 | 125.3° | 120.0° |
| C42 | C43 | C44 | H432 | 125.2° | 120.0° |
| C42 | C43 | H431 | H432 | 117.6° | 120.0° |
| C42 | C43 | C44 | C45 | 60.4° | 180.0° |
| C42 | C43 | C44 | H441 | 64.9° | 60.0° |
| C42 | C43 | C44 | H442 | 174.4° | 60.0° |
| H421 | C42 | C43 | C44 | 91.8° | 60.0° |
| H421 | C42 | C43 | H431 | 143.0° | 179.9° |
| H421 | C42 | C43 | H432 | 33.4° | 60.0° |
| H422 | C42 | C43 | C44 | 17.7° | 60.0° |
| H422 | C42 | C43 | H431 | 107.6° | 60.0° |
| H422 | C42 | C43 | H432 | 142.9° | 180.0° |
| C44 | C43 | H431 | H432 | 117.6° | 120.0° |
| C43 | C44 | C45 | H441 | 125.3° | 120.0° |
| C43 | C44 | C45 | H442 | 125.3° | 120.0° |
| C43 | C44 | H441 | H442 | 116.3° | 120.0° |
| C43 | C44 | C45 | H451 | 180.0° | 180.0° |
| C43 | C44 | C45 | H452 | 54.8° | 60.0° |
| C43 | C44 | C45 | H453 | 54.8° | 60.0° |
| H431 | C43 | C44 | C45 | 174.4° | 60.0° |
| H431 | C43 | C44 | H441 | 60.4° | 180.0° |
| H431 | C43 | C44 | H442 | 49.1° | 60.0° |
| H432 | C43 | C44 | C45 | 64.9° | 60.0° |
| H432 | C43 | C44 | H441 | 169.9° | 59.9° |
| H432 | C43 | C44 | H442 | 60.4° | 180.0° |
| C45 | C44 | H441 | H442 | 116.2° | 120.0° |
| C44 | C45 | H451 | H452 | 125.3° | 120.0° |
| C44 | C45 | H451 | H453 | 125.2° | 120.0° |
| C44 | C45 | H452 | H453 | 116.3° | 120.0° |
| H441 | C44 | C45 | H451 | 54.7° | 60.0° |
| H441 | C44 | C45 | H452 | 180.0° | 60.0° |
| H441 | C44 | C45 | H453 | 70.5° | 179.9° |
| H442 | C44 | C45 | H451 | 54.7° | 60.0° |
| H442 | C44 | C45 | H452 | 70.5° | 180.0° |
| H442 | C44 | C45 | H453 | 179.9° | 60.0° |
| H451 | C45 | H452 | H453 | 116.3° | 120.0° |
