YZY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | sing | 1.43Å | 1.44Å | |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| O2 | C2 | sing | 1.45Å | 1.45Å | |
| C2 | C19 | sing | 1.53Å | 1.51Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | O2 | sing | 1.34Å | 1.37Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| C3 | O3 | doub | 1.21Å | 1.22Å | |
| C5 | C4 | sing | 1.53Å | 1.50Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C4 | H42 | sing | 1.09Å | 1.10Å | |
| C6 | C5 | sing | 1.53Å | 1.52Å | |
| C5 | H51 | sing | 1.09Å | 1.10Å | |
| C5 | H52 | sing | 1.09Å | 1.10Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C7 | H71 | sing | 1.09Å | 1.10Å | |
| C7 | H72 | sing | 1.09Å | 1.10Å | |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C8 | H81 | sing | 1.09Å | 1.10Å | |
| C8 | H82 | sing | 1.09Å | 1.10Å | |
| C10 | C9 | sing | 1.53Å | 1.52Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| C9 | H92 | sing | 1.09Å | 1.10Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C13 | C12 | sing | 1.53Å | 1.54Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C14 | C13 | sing | 1.53Å | 1.54Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C15 | C14 | sing | 1.53Å | 1.55Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.53Å | 1.54Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C17 | C16 | sing | 1.53Å | 1.55Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H183 | sing | 1.09Å | 1.10Å | |
| O4 | C19 | sing | 1.45Å | 1.46Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| O4 | C20 | sing | 1.34Å | 1.37Å | |
| C21 | C20 | sing | 1.51Å | 1.55Å | |
| C20 | O5 | doub | 1.21Å | 1.24Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C23 | C22 | sing | 1.53Å | 1.54Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C26 | C25 | sing | 1.53Å | 1.55Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C27 | C26 | sing | 1.53Å | 1.57Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C28 | C27 | sing | 1.51Å | 1.41Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C29 | C28 | doub | 1.31Å | 1.41Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C29 | C30 | sing | 1.51Å | 1.40Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C31 | C30 | sing | 1.53Å | 1.54Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C31 | C32 | sing | 1.53Å | 1.56Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C32 | C33 | sing | 1.53Å | 1.54Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C33 | C34 | sing | 1.53Å | 1.53Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C34 | C35 | sing | 1.53Å | 1.54Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C35 | C36 | sing | 1.53Å | 1.55Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C36 | C37 | sing | 1.53Å | 1.55Å | |
| C36 | H361 | sing | 1.09Å | 1.10Å | |
| C36 | H362 | sing | 1.09Å | 1.10Å | |
| C37 | H371 | sing | 1.09Å | 1.10Å | |
| C37 | H372 | sing | 1.09Å | 1.10Å | |
| C37 | H373 | sing | 1.09Å | 1.10Å | |
| H1O | O1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 101.7° | 109.4° |
| O1 | C1 | H11 | 111.4° | 109.5° |
| O1 | C1 | H12 | 111.4° | 109.5° |
| C1 | O1 | H1O | 109.5° | 114.0° |
| C2 | C1 | H11 | 111.4° | 109.5° |
| C2 | C1 | H12 | 111.4° | 109.5° |
| C1 | C2 | O2 | 109.3° | 109.5° |
| C1 | C2 | C19 | 105.5° | 109.5° |
| C1 | C2 | H21 | 109.8° | 109.4° |
| H11 | C1 | H12 | 109.5° | 109.5° |
| O2 | C2 | C19 | 111.8° | 109.5° |
| O2 | C2 | H21 | 110.6° | 109.5° |
| C2 | O2 | C3 | 117.6° | 117.0° |
| C19 | C2 | H21 | 109.7° | 109.5° |
| C2 | C19 | O4 | 110.6° | 109.5° |
| C2 | C19 | H191 | 109.2° | 109.5° |
| C2 | C19 | H192 | 109.2° | 109.5° |
| O2 | C3 | C4 | 120.0° | 120.0° |
| O2 | C3 | O3 | 122.2° | 120.0° |
| C4 | C3 | O3 | 117.8° | 120.0° |
| C3 | C4 | C5 | 108.8° | 109.5° |
| C3 | C4 | H41 | 109.6° | 109.5° |
| C3 | C4 | H42 | 109.6° | 109.4° |
| C5 | C4 | H41 | 109.6° | 109.5° |
| C5 | C4 | H42 | 109.6° | 109.5° |
| C4 | C5 | C6 | 112.3° | 109.4° |
| C4 | C5 | H51 | 108.8° | 109.5° |
| C4 | C5 | H52 | 108.7° | 109.4° |
| H41 | C4 | H42 | 109.5° | 109.4° |
| C6 | C5 | H51 | 108.7° | 109.4° |
| C6 | C5 | H52 | 108.8° | 109.5° |
| C5 | C6 | C7 | 107.4° | 109.4° |
| C5 | C6 | H61 | 110.0° | 109.4° |
| C5 | C6 | H62 | 110.0° | 109.5° |
| H51 | C5 | H52 | 109.4° | 109.5° |
| C7 | C6 | H61 | 110.0° | 109.5° |
| C7 | C6 | H62 | 110.0° | 109.5° |
| C6 | C7 | C8 | 110.7° | 109.5° |
| C6 | C7 | H71 | 109.2° | 109.5° |
| C6 | C7 | H72 | 109.2° | 109.5° |
| H61 | C6 | H62 | 109.5° | 109.5° |
| C8 | C7 | H71 | 109.2° | 109.5° |
| C8 | C7 | H72 | 109.2° | 109.4° |
| C7 | C8 | C9 | 111.4° | 109.5° |
| C7 | C8 | H81 | 109.0° | 109.5° |
| C7 | C8 | H82 | 109.0° | 109.5° |
| H71 | C7 | H72 | 109.5° | 109.5° |
| C9 | C8 | H81 | 109.0° | 109.5° |
| C9 | C8 | H82 | 109.0° | 109.5° |
| C8 | C9 | C10 | 111.1° | 109.5° |
| C8 | C9 | H91 | 109.1° | 109.5° |
| C8 | C9 | H92 | 109.1° | 109.5° |
| H81 | C8 | H82 | 109.5° | 109.4° |
| C10 | C9 | H91 | 109.1° | 109.5° |
| C10 | C9 | H92 | 109.1° | 109.5° |
| C9 | C10 | C11 | 110.0° | 109.5° |
| C9 | C10 | H101 | 109.3° | 109.5° |
| C9 | C10 | H102 | 109.3° | 109.5° |
| H91 | C9 | H92 | 109.5° | 109.4° |
| C11 | C10 | H101 | 109.3° | 109.5° |
| C11 | C10 | H102 | 109.4° | 109.5° |
| C10 | C11 | C12 | 108.9° | 109.4° |
| C10 | C11 | H111 | 109.6° | 109.5° |
| C10 | C11 | H112 | 109.6° | 109.5° |
| H101 | C10 | H102 | 109.5° | 109.4° |
| C12 | C11 | H111 | 109.6° | 109.4° |
| C12 | C11 | H112 | 109.6° | 109.5° |
| C11 | C12 | C13 | 114.6° | 109.4° |
| C11 | C12 | H121 | 108.2° | 109.4° |
| C11 | C12 | H122 | 108.2° | 109.5° |
| H111 | C11 | H112 | 109.4° | 109.5° |
| C13 | C12 | H121 | 108.2° | 109.5° |
| C13 | C12 | H122 | 108.2° | 109.4° |
| C12 | C13 | C14 | 109.7° | 109.5° |
| C12 | C13 | H131 | 109.4° | 109.5° |
| C12 | C13 | H132 | 109.4° | 109.5° |
| H121 | C12 | H122 | 109.5° | 109.5° |
| C14 | C13 | H131 | 109.4° | 109.4° |
| C14 | C13 | H132 | 109.4° | 109.5° |
| C13 | C14 | C15 | 114.6° | 109.4° |
| C13 | C14 | H141 | 108.2° | 109.4° |
| C13 | C14 | H142 | 108.2° | 109.4° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| C15 | C14 | H141 | 108.2° | 109.5° |
| C15 | C14 | H142 | 108.1° | 109.5° |
| C14 | C15 | C16 | 114.4° | 109.5° |
| C14 | C15 | H151 | 108.2° | 109.5° |
| C14 | C15 | H152 | 108.2° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.5° |
| C16 | C15 | H151 | 108.2° | 109.5° |
| C16 | C15 | H152 | 108.2° | 109.4° |
| C15 | C16 | C17 | 111.8° | 109.5° |
| C15 | C16 | H161 | 108.9° | 109.5° |
| C15 | C16 | H162 | 108.9° | 109.5° |
| H151 | C15 | H152 | 109.5° | 109.5° |
| C17 | C16 | H161 | 108.9° | 109.5° |
| C17 | C16 | H162 | 108.8° | 109.5° |
| C16 | C17 | C18 | 114.5° | 109.5° |
| C16 | C17 | H171 | 108.2° | 109.4° |
| C16 | C17 | H172 | 108.2° | 109.4° |
| H161 | C16 | H162 | 109.5° | 109.4° |
| C18 | C17 | H171 | 108.2° | 109.5° |
| C18 | C17 | H172 | 108.2° | 109.5° |
| C17 | C18 | H181 | 109.5° | 109.5° |
| C17 | C18 | H182 | 109.5° | 109.5° |
| C17 | C18 | H183 | 109.5° | 109.5° |
| H171 | C17 | H172 | 109.5° | 109.5° |
| H181 | C18 | H182 | 109.4° | 109.5° |
| H181 | C18 | H183 | 109.5° | 109.5° |
| H182 | C18 | H183 | 109.5° | 109.5° |
| O4 | C19 | H191 | 109.2° | 109.5° |
| O4 | C19 | H192 | 109.2° | 109.4° |
| C19 | O4 | C20 | 109.2° | 117.0° |
| H191 | C19 | H192 | 109.5° | 109.5° |
| O4 | C20 | C21 | 121.5° | 120.0° |
| O4 | C20 | O5 | 118.5° | 120.0° |
| C21 | C20 | O5 | 119.9° | 120.0° |
| C20 | C21 | C22 | 117.1° | 109.5° |
| C20 | C21 | H211 | 107.5° | 109.5° |
| C20 | C21 | H212 | 107.5° | 109.5° |
| C22 | C21 | H211 | 107.5° | 109.5° |
| C22 | C21 | H212 | 107.5° | 109.5° |
| C21 | C22 | C23 | 108.5° | 109.5° |
| C21 | C22 | H221 | 109.7° | 109.5° |
| C21 | C22 | H222 | 109.7° | 109.5° |
| H211 | C21 | H212 | 109.5° | 109.4° |
| C23 | C22 | H221 | 109.7° | 109.5° |
| C23 | C22 | H222 | 109.7° | 109.5° |
| C22 | C23 | C24 | 113.8° | 109.5° |
| C22 | C23 | H231 | 108.4° | 109.4° |
| C22 | C23 | H232 | 108.4° | 109.5° |
| H221 | C22 | H222 | 109.4° | 109.4° |
| C24 | C23 | H231 | 108.4° | 109.5° |
| C24 | C23 | H232 | 108.4° | 109.4° |
| C23 | C24 | C25 | 110.2° | 109.5° |
| C23 | C24 | H241 | 109.3° | 109.5° |
| C23 | C24 | H242 | 109.3° | 109.5° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| C25 | C24 | H241 | 109.3° | 109.5° |
| C25 | C24 | H242 | 109.3° | 109.4° |
| C24 | C25 | C26 | 110.8° | 109.5° |
| C24 | C25 | H251 | 109.2° | 109.5° |
| C24 | C25 | H252 | 109.1° | 109.5° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| C26 | C25 | H251 | 109.1° | 109.5° |
| C26 | C25 | H252 | 109.1° | 109.4° |
| C25 | C26 | C27 | 115.8° | 109.5° |
| C25 | C26 | H261 | 107.9° | 109.5° |
| C25 | C26 | H262 | 107.9° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.5° |
| C27 | C26 | H261 | 107.8° | 109.4° |
| C27 | C26 | H262 | 107.9° | 109.4° |
| C26 | C27 | C28 | 111.6° | 109.5° |
| C26 | C27 | H271 | 108.9° | 109.5° |
| C26 | C27 | H272 | 108.9° | 109.5° |
| H261 | C26 | H262 | 109.5° | 109.5° |
| C28 | C27 | H271 | 108.9° | 109.5° |
| C28 | C27 | H272 | 109.0° | 109.5° |
| C27 | C28 | C29 | 127.8° | 120.0° |
| C27 | C28 | H281 | 116.1° | 120.0° |
| H271 | C27 | H272 | 109.5° | 109.4° |
| C29 | C28 | H281 | 116.1° | 120.0° |
| C28 | C29 | C30 | 126.2° | 120.0° |
| C28 | C29 | H291 | 116.9° | 120.0° |
| C30 | C29 | H291 | 116.9° | 120.0° |
| C29 | C30 | C31 | 112.0° | 109.5° |
| C29 | C30 | H301 | 108.8° | 109.4° |
| C29 | C30 | H302 | 108.8° | 109.5° |
| C31 | C30 | H301 | 108.8° | 109.4° |
| C31 | C30 | H302 | 108.8° | 109.5° |
| C30 | C31 | C32 | 115.4° | 109.4° |
| C30 | C31 | H311 | 107.9° | 109.4° |
| C30 | C31 | H312 | 108.0° | 109.5° |
| H301 | C30 | H302 | 109.5° | 109.5° |
| C32 | C31 | H311 | 108.0° | 109.4° |
| C32 | C31 | H312 | 107.9° | 109.5° |
| C31 | C32 | C33 | 113.3° | 109.4° |
| C31 | C32 | H321 | 108.5° | 109.4° |
| C31 | C32 | H322 | 108.5° | 109.5° |
| H311 | C31 | H312 | 109.5° | 109.5° |
| C33 | C32 | H321 | 108.5° | 109.5° |
| C33 | C32 | H322 | 108.5° | 109.5° |
| C32 | C33 | C34 | 112.1° | 109.4° |
| C32 | C33 | H331 | 108.8° | 109.5° |
| C32 | C33 | H332 | 108.8° | 109.5° |
| H321 | C32 | H322 | 109.5° | 109.5° |
| C34 | C33 | H331 | 108.8° | 109.5° |
| C34 | C33 | H332 | 108.8° | 109.5° |
| C33 | C34 | C35 | 111.4° | 109.5° |
| C33 | C34 | H341 | 109.0° | 109.5° |
| C33 | C34 | H342 | 109.0° | 109.5° |
| H331 | C33 | H332 | 109.5° | 109.4° |
| C35 | C34 | H341 | 109.0° | 109.4° |
| C35 | C34 | H342 | 109.0° | 109.5° |
| C34 | C35 | C36 | 113.0° | 109.5° |
| C34 | C35 | H351 | 108.6° | 109.4° |
| C34 | C35 | H352 | 108.6° | 109.5° |
| H341 | C34 | H342 | 109.4° | 109.5° |
| C36 | C35 | H351 | 108.6° | 109.5° |
| C36 | C35 | H352 | 108.6° | 109.5° |
| C35 | C36 | C37 | 113.2° | 109.4° |
| C35 | C36 | H361 | 108.5° | 109.5° |
| C35 | C36 | H362 | 108.5° | 109.5° |
| H351 | C35 | H352 | 109.5° | 109.5° |
| C37 | C36 | H361 | 108.5° | 109.5° |
| C37 | C36 | H362 | 108.5° | 109.5° |
| C36 | C37 | H371 | 109.5° | 109.5° |
| C36 | C37 | H372 | 109.5° | 109.5° |
| C36 | C37 | H373 | 109.5° | 109.5° |
| H361 | C36 | H362 | 109.5° | 109.5° |
| H371 | C37 | H372 | 109.5° | 109.5° |
| H371 | C37 | H373 | 109.5° | 109.5° |
| H372 | C37 | H373 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | H11 | 118.7° | 120.0° |
| O1 | C1 | C2 | H12 | 118.7° | 120.0° |
| O1 | C1 | H11 | H12 | 123.6° | 120.0° |
| O1 | C1 | C2 | O2 | 64.6° | 65.0° |
| O1 | C1 | C2 | C19 | 175.1° | 55.0° |
| O1 | C1 | C2 | H21 | 56.9° | 175.0° |
| C2 | C1 | H11 | H12 | 123.6° | 120.0° |
| C1 | C2 | O2 | C19 | 116.4° | 120.0° |
| C1 | C2 | O2 | H21 | 121.0° | 120.0° |
| C1 | C2 | C19 | H21 | 118.2° | 120.0° |
| C1 | C2 | O2 | C3 | 103.2° | 90.0° |
| C1 | C2 | C19 | O4 | 169.1° | 55.0° |
| C1 | C2 | C19 | H191 | 49.0° | 175.0° |
| C1 | C2 | C19 | H192 | 70.7° | 65.0° |
| C2 | C1 | O1 | H1O | 180.0° | 180.0° |
| H11 | C1 | C2 | O2 | 176.7° | 55.0° |
| H11 | C1 | C2 | C19 | 56.4° | 175.0° |
| H11 | C1 | C2 | H21 | 61.8° | 65.0° |
| H11 | C1 | O1 | H1O | 61.3° | 60.0° |
| H12 | C1 | C2 | O2 | 54.2° | 175.0° |
| H12 | C1 | C2 | C19 | 66.1° | 65.0° |
| H12 | C1 | C2 | H21 | 175.7° | 55.0° |
| H12 | C1 | O1 | H1O | 61.2° | 60.0° |
| O2 | C2 | C19 | H21 | 123.1° | 120.0° |
| C2 | O2 | C3 | C4 | 159.7° | 180.0° |
| C2 | O2 | C3 | O3 | 23.2° | 0.0° |
| O2 | C2 | C19 | O4 | 72.2° | 65.0° |
| O2 | C2 | C19 | H191 | 167.7° | 55.1° |
| O2 | C2 | C19 | H192 | 48.0° | 175.0° |
| C19 | C2 | O2 | C3 | 140.4° | 150.0° |
| C2 | C19 | O4 | H191 | 120.2° | 120.0° |
| C2 | C19 | O4 | H192 | 120.2° | 120.0° |
| C2 | C19 | H191 | H192 | 119.5° | 120.0° |
| C2 | C19 | O4 | C20 | 170.4° | 180.0° |
| H21 | C2 | O2 | C3 | 17.8° | 29.9° |
| H21 | C2 | C19 | O4 | 50.9° | 175.0° |
| H21 | C2 | C19 | H191 | 69.3° | 65.0° |
| H21 | C2 | C19 | H192 | 171.1° | 55.0° |
| O2 | C3 | C4 | O3 | 177.1° | 180.0° |
| O2 | C3 | C4 | C5 | 90.6° | 180.0° |
| O2 | C3 | C4 | H41 | 29.3° | 60.0° |
| O2 | C3 | C4 | H42 | 149.5° | 60.0° |
| C3 | C4 | C5 | H41 | 119.9° | 120.0° |
| C3 | C4 | C5 | H42 | 119.9° | 120.0° |
| C3 | C4 | H41 | H42 | 120.3° | 119.9° |
| C3 | C4 | C5 | C6 | 117.5° | 180.0° |
| C3 | C4 | C5 | H51 | 2.9° | 60.0° |
| C3 | C4 | C5 | H52 | 122.0° | 60.0° |
| O3 | C3 | C4 | C5 | 86.6° | 0.0° |
| O3 | C3 | C4 | H41 | 153.6° | 120.0° |
| O3 | C3 | C4 | H42 | 33.4° | 120.0° |
| C5 | C4 | H41 | H42 | 120.3° | 120.0° |
| C4 | C5 | C6 | H51 | 120.5° | 119.9° |
| C4 | C5 | C6 | H52 | 120.4° | 120.0° |
| C4 | C5 | H51 | H52 | 118.7° | 120.0° |
| C4 | C5 | C6 | C7 | 141.0° | 180.0° |
| C4 | C5 | C6 | H61 | 99.3° | 60.1° |
| C4 | C5 | C6 | H62 | 21.4° | 60.0° |
| H41 | C4 | C5 | C6 | 122.6° | 60.0° |
| H41 | C4 | C5 | H51 | 117.0° | 179.9° |
| H41 | C4 | C5 | H52 | 2.1° | 60.0° |
| H42 | C4 | C5 | C6 | 2.4° | 60.0° |
| H42 | C4 | C5 | H51 | 122.9° | 60.0° |
| H42 | C4 | C5 | H52 | 118.0° | 180.0° |
| C6 | C5 | H51 | H52 | 118.7° | 120.1° |
| C5 | C6 | C7 | H61 | 119.7° | 119.9° |
| C5 | C6 | C7 | H62 | 119.7° | 120.0° |
| C5 | C6 | H61 | H62 | 121.0° | 120.1° |
| C5 | C6 | C7 | C8 | 118.8° | 180.0° |
| C5 | C6 | C7 | H71 | 121.0° | 60.0° |
| C5 | C6 | C7 | H72 | 1.4° | 60.0° |
| H51 | C5 | C6 | C7 | 20.6° | 60.1° |
| H51 | C5 | C6 | H61 | 140.2° | 180.0° |
| H51 | C5 | C6 | H62 | 99.1° | 59.9° |
| H52 | C5 | C6 | C7 | 98.5° | 60.0° |
| H52 | C5 | C6 | H61 | 21.1° | 59.9° |
| H52 | C5 | C6 | H62 | 141.8° | 180.0° |
| C7 | C6 | H61 | H62 | 121.0° | 120.0° |
| C6 | C7 | C8 | H71 | 120.2° | 120.0° |
| C6 | C7 | C8 | H72 | 120.2° | 120.0° |
| C6 | C7 | H71 | H72 | 119.4° | 120.0° |
| C6 | C7 | C8 | C9 | 117.0° | 180.0° |
| C6 | C7 | C8 | H81 | 122.7° | 60.0° |
| C6 | C7 | C8 | H82 | 3.3° | 60.0° |
| H61 | C6 | C7 | C8 | 0.8° | 60.0° |
| H61 | C6 | C7 | H71 | 119.3° | 179.9° |
| H61 | C6 | C7 | H72 | 121.0° | 59.9° |
| H62 | C6 | C7 | C8 | 121.5° | 60.0° |
| H62 | C6 | C7 | H71 | 1.3° | 60.0° |
| H62 | C6 | C7 | H72 | 118.3° | 179.9° |
| C8 | C7 | H71 | H72 | 119.4° | 120.0° |
| C7 | C8 | C9 | H81 | 120.3° | 120.0° |
| C7 | C8 | C9 | H82 | 120.3° | 120.0° |
| C7 | C8 | H81 | H82 | 119.1° | 120.0° |
| C7 | C8 | C9 | C10 | 171.4° | NaN° |
| C7 | C8 | C9 | H91 | 51.1° | 60.0° |
| C7 | C8 | C9 | H92 | 68.4° | 60.0° |
| H71 | C7 | C8 | C9 | 3.2° | 60.0° |
| H71 | C7 | C8 | H81 | 117.1° | NaN° |
| H71 | C7 | C8 | H82 | 123.5° | 60.0° |
| H72 | C7 | C8 | C9 | 122.8° | 60.0° |
| H72 | C7 | C8 | H81 | 2.5° | 60.0° |
| H72 | C7 | C8 | H82 | 116.9° | 180.0° |
| C9 | C8 | H81 | H82 | 119.1° | 120.0° |
| C8 | C9 | C10 | H91 | 120.2° | 120.0° |
| C8 | C9 | C10 | H92 | 120.3° | 120.0° |
| C8 | C9 | H91 | H92 | 119.2° | 120.0° |
| C8 | C9 | C10 | C11 | 161.1° | 180.0° |
| C8 | C9 | C10 | H101 | 78.8° | 60.0° |
| C8 | C9 | C10 | H102 | 41.0° | 60.0° |
| H81 | C8 | C9 | C10 | 68.3° | 60.0° |
| H81 | C8 | C9 | H91 | 171.4° | 180.0° |
| H81 | C8 | C9 | H92 | 51.9° | 60.1° |
| H82 | C8 | C9 | C10 | 51.1° | 60.0° |
| H82 | C8 | C9 | H91 | 69.2° | 60.1° |
| H82 | C8 | C9 | H92 | 171.3° | 180.0° |
| C10 | C9 | H91 | H92 | 119.3° | 120.0° |
| C9 | C10 | C11 | H101 | 120.1° | 120.0° |
| C9 | C10 | C11 | H102 | 120.1° | 120.0° |
| C9 | C10 | H101 | H102 | 119.7° | 120.0° |
| C9 | C10 | C11 | C12 | 129.0° | 180.0° |
| C9 | C10 | C11 | H111 | 9.1° | 60.0° |
| C9 | C10 | C11 | H112 | 111.1° | 60.0° |
| H91 | C9 | C10 | C11 | 40.9° | 60.0° |
| H91 | C9 | C10 | H101 | 160.9° | 180.0° |
| H91 | C9 | C10 | H102 | 79.2° | 60.0° |
| H92 | C9 | C10 | C11 | 78.6° | 60.0° |
| H92 | C9 | C10 | H101 | 41.4° | 60.0° |
| H92 | C9 | C10 | H102 | 161.3° | 180.0° |
| C11 | C10 | H101 | H102 | 119.8° | 120.0° |
| C10 | C11 | C12 | H111 | 119.9° | 119.9° |
| C10 | C11 | C12 | H112 | 119.9° | 120.0° |
| C10 | C11 | H111 | H112 | 120.3° | 120.0° |
| C10 | C11 | C12 | C13 | 129.8° | 180.0° |
| C10 | C11 | C12 | H121 | 9.1° | 60.1° |
| C10 | C11 | C12 | H122 | 109.5° | 60.0° |
| H101 | C10 | C11 | C12 | 110.9° | 60.0° |
| H101 | C10 | C11 | H111 | 129.1° | 179.9° |
| H101 | C10 | C11 | H112 | 9.0° | 60.0° |
| H102 | C10 | C11 | C12 | 8.9° | 60.0° |
| H102 | C10 | C11 | H111 | 111.0° | 60.0° |
| H102 | C10 | C11 | H112 | 128.9° | 180.0° |
| C12 | C11 | H111 | H112 | 120.2° | 120.1° |
| C11 | C12 | C13 | H121 | 120.8° | 119.9° |
| C11 | C12 | C13 | H122 | 120.7° | 120.0° |
| C11 | C12 | H121 | H122 | 117.7° | 120.1° |
| C11 | C12 | C13 | C14 | 143.5° | 180.0° |
| C11 | C12 | C13 | H131 | 96.5° | 60.1° |
| C11 | C12 | C13 | H132 | 23.5° | 60.0° |
| H111 | C11 | C12 | C13 | 110.3° | 60.1° |
| H111 | C11 | C12 | H121 | 129.0° | 180.0° |
| H111 | C11 | C12 | H122 | 10.5° | 59.9° |
| H112 | C11 | C12 | C13 | 9.9° | 60.0° |
| H112 | C11 | C12 | H121 | 110.9° | 59.9° |
| H112 | C11 | C12 | H122 | 130.6° | 180.0° |
| C13 | C12 | H121 | H122 | 117.6° | 120.0° |
| C12 | C13 | C14 | H131 | 120.0° | 120.0° |
| C12 | C13 | C14 | H132 | 120.0° | 120.0° |
| C12 | C13 | H131 | H132 | 119.9° | 120.1° |
| C12 | C13 | C14 | C15 | 109.6° | 180.0° |
| C12 | C13 | C14 | H141 | 129.7° | 60.0° |
| C12 | C13 | C14 | H142 | 11.1° | 60.0° |
| H121 | C12 | C13 | C14 | 22.7° | 60.1° |
| H121 | C12 | C13 | H131 | 142.7° | 180.0° |
| H121 | C12 | C13 | H132 | 97.3° | 60.0° |
| H122 | C12 | C13 | C14 | 95.8° | 60.0° |
| H122 | C12 | C13 | H131 | 24.2° | 59.9° |
| H122 | C12 | C13 | H132 | 144.2° | 180.0° |
| C14 | C13 | H131 | H132 | 119.9° | 120.0° |
| C13 | C14 | C15 | H141 | 120.8° | 120.0° |
| C13 | C14 | C15 | H142 | 120.8° | 119.9° |
| C13 | C14 | H141 | H142 | 117.7° | 120.0° |
| C13 | C14 | C15 | C16 | 81.5° | 180.0° |
| C13 | C14 | C15 | H151 | 39.2° | 60.0° |
| C13 | C14 | C15 | H152 | 157.7° | 60.0° |
| H131 | C13 | C14 | C15 | 10.4° | 60.0° |
| H131 | C13 | C14 | H141 | 110.3° | 180.0° |
| H131 | C13 | C14 | H142 | 131.2° | 60.0° |
| H132 | C13 | C14 | C15 | 130.4° | 60.0° |
| H132 | C13 | C14 | H141 | 9.6° | 60.0° |
| H132 | C13 | C14 | H142 | 108.9° | 180.0° |
| C15 | C14 | H141 | H142 | 117.6° | 120.1° |
| C14 | C15 | C16 | H151 | 120.7° | 120.0° |
| C14 | C15 | C16 | H152 | 120.7° | 120.0° |
| C14 | C15 | H151 | H152 | 117.7° | 120.0° |
| C14 | C15 | C16 | C17 | 117.7° | 180.0° |
| C14 | C15 | C16 | H161 | 2.6° | 60.0° |
| C14 | C15 | C16 | H162 | 121.9° | 60.0° |
| H141 | C14 | C15 | C16 | 157.7° | 60.0° |
| H141 | C14 | C15 | H151 | 81.5° | 179.9° |
| H141 | C14 | C15 | H152 | 37.0° | 59.9° |
| H142 | C14 | C15 | C16 | 39.2° | 60.1° |
| H142 | C14 | C15 | H151 | 160.0° | 60.0° |
| H142 | C14 | C15 | H152 | 81.5° | 180.0° |
| C16 | C15 | H151 | H152 | 117.7° | 120.0° |
| C15 | C16 | C17 | H161 | 120.4° | 120.0° |
| C15 | C16 | C17 | H162 | 120.4° | 120.0° |
| C15 | C16 | H161 | H162 | 118.9° | 120.0° |
| C15 | C16 | C17 | C18 | 130.0° | 180.0° |
| C15 | C16 | C17 | H171 | 9.3° | 60.0° |
| C15 | C16 | C17 | H172 | 109.2° | 60.0° |
| H151 | C15 | C16 | C17 | 121.5° | 60.0° |
| H151 | C15 | C16 | H161 | 118.2° | 180.0° |
| H151 | C15 | C16 | H162 | 1.2° | 60.0° |
| H152 | C15 | C16 | C17 | 3.0° | 60.0° |
| H152 | C15 | C16 | H161 | 123.3° | 60.0° |
| H152 | C15 | C16 | H162 | 117.3° | 180.0° |
| C17 | C16 | H161 | H162 | 118.9° | 120.0° |
| C16 | C17 | C18 | H171 | 120.7° | 120.0° |
| C16 | C17 | C18 | H172 | 120.8° | 119.9° |
| C16 | C17 | H171 | H172 | 117.7° | 119.9° |
| C16 | C17 | C18 | H181 | 180.0° | 60.0° |
| C16 | C17 | C18 | H182 | 60.0° | 60.0° |
| C16 | C17 | C18 | H183 | 60.0° | 180.0° |
| H161 | C16 | C17 | C18 | 109.6° | 60.0° |
| H161 | C16 | C17 | H171 | 129.7° | 180.0° |
| H161 | C16 | C17 | H172 | 11.1° | 60.0° |
| H162 | C16 | C17 | C18 | 9.7° | 60.0° |
| H162 | C16 | C17 | H171 | 111.0° | 60.1° |
| H162 | C16 | C17 | H172 | 130.4° | 180.0° |
| C18 | C17 | H171 | H172 | 117.7° | 120.1° |
| C17 | C18 | H181 | H182 | 120.0° | 120.0° |
| C17 | C18 | H181 | H183 | 120.0° | 120.0° |
| C17 | C18 | H182 | H183 | 120.0° | 120.0° |
| H171 | C17 | C18 | H181 | 59.3° | 180.0° |
| H171 | C17 | C18 | H182 | 179.2° | 59.9° |
| H171 | C17 | C18 | H183 | 60.7° | 60.1° |
| H172 | C17 | C18 | H181 | 59.2° | 60.0° |
| H172 | C17 | C18 | H182 | 60.7° | 180.0° |
| H172 | C17 | C18 | H183 | 179.3° | 60.0° |
| H181 | C18 | H182 | H183 | 120.0° | 120.0° |
| O4 | C19 | H191 | H192 | 119.5° | 120.0° |
| C19 | O4 | C20 | C21 | 159.1° | 180.0° |
| C19 | O4 | C20 | O5 | 23.5° | 0.0° |
| H191 | C19 | O4 | C20 | 69.4° | 60.0° |
| H192 | C19 | O4 | C20 | 50.2° | 60.0° |
| O4 | C20 | C21 | O5 | 177.4° | 180.0° |
| O4 | C20 | C21 | C22 | 38.1° | 180.0° |
| O4 | C20 | C21 | H211 | 83.0° | 60.0° |
| O4 | C20 | C21 | H212 | 159.2° | 60.0° |
| C20 | C21 | C22 | H211 | 121.1° | 120.0° |
| C20 | C21 | C22 | H212 | 121.1° | 120.1° |
| C20 | C21 | H211 | H212 | 116.5° | 120.0° |
| C20 | C21 | C22 | C23 | 149.3° | 180.0° |
| C20 | C21 | C22 | H221 | 29.4° | 60.0° |
| C20 | C21 | C22 | H222 | 90.8° | 59.9° |
| O5 | C20 | C21 | C22 | 144.5° | 0.0° |
| O5 | C20 | C21 | H211 | 94.4° | 120.0° |
| O5 | C20 | C21 | H212 | 23.4° | 120.0° |
| C22 | C21 | H211 | H212 | 116.5° | 120.0° |
| C21 | C22 | C23 | H221 | 119.9° | 120.0° |
| C21 | C22 | C23 | H222 | 119.8° | 120.0° |
| C21 | C22 | H221 | H222 | 120.4° | 120.0° |
| C21 | C22 | C23 | C24 | 171.8° | 180.0° |
| C21 | C22 | C23 | H231 | 51.2° | 60.0° |
| C21 | C22 | C23 | H232 | 67.5° | 60.0° |
| H211 | C21 | C22 | C23 | 89.6° | 60.0° |
| H211 | C21 | C22 | H221 | 150.6° | 180.0° |
| H211 | C21 | C22 | H222 | 30.3° | 60.0° |
| H212 | C21 | C22 | C23 | 28.2° | 60.0° |
| H212 | C21 | C22 | H221 | 91.6° | 60.0° |
| H212 | C21 | C22 | H222 | 148.1° | 180.0° |
| C23 | C22 | H221 | H222 | 120.4° | 120.0° |
| C22 | C23 | C24 | H231 | 120.7° | 120.0° |
| C22 | C23 | C24 | H232 | 120.6° | 120.0° |
| C22 | C23 | H231 | H232 | 118.0° | 120.0° |
| C22 | C23 | C24 | C25 | 172.6° | 180.0° |
| C22 | C23 | C24 | H241 | 52.5° | 60.0° |
| C22 | C23 | C24 | H242 | 67.3° | 60.0° |
| H221 | C22 | C23 | C24 | 68.3° | 60.0° |
| H221 | C22 | C23 | H231 | 171.0° | 180.0° |
| H221 | C22 | C23 | H232 | 52.3° | 60.0° |
| H222 | C22 | C23 | C24 | 52.0° | 60.0° |
| H222 | C22 | C23 | H231 | 68.7° | 60.0° |
| H222 | C22 | C23 | H232 | 172.6° | 179.9° |
| C24 | C23 | H231 | H232 | 118.0° | 120.0° |
| C23 | C24 | C25 | H241 | 120.1° | 120.0° |
| C23 | C24 | C25 | H242 | 120.1° | 120.0° |
| C23 | C24 | H241 | H242 | 119.7° | 120.0° |
| C23 | C24 | C25 | C26 | 114.2° | 180.0° |
| C23 | C24 | C25 | H251 | 125.6° | 60.0° |
| C23 | C24 | C25 | H252 | 6.0° | 60.0° |
| H231 | C23 | C24 | C25 | 66.8° | 60.0° |
| H231 | C23 | C24 | H241 | 173.1° | 179.9° |
| H231 | C23 | C24 | H242 | 53.3° | 59.9° |
| H232 | C23 | C24 | C25 | 51.9° | 60.1° |
| H232 | C23 | C24 | H241 | 68.2° | 60.0° |
| H232 | C23 | C24 | H242 | 172.0° | 180.0° |
| C25 | C24 | H241 | H242 | 119.6° | 119.9° |
| C24 | C25 | C26 | H251 | 120.2° | 120.0° |
| C24 | C25 | C26 | H252 | 120.2° | 120.0° |
| C24 | C25 | H251 | H252 | 119.4° | 120.0° |
| C24 | C25 | C26 | C27 | 161.7° | 180.0° |
| C24 | C25 | C26 | H261 | 40.8° | 60.0° |
| C24 | C25 | C26 | H262 | 77.4° | 60.1° |
| H241 | C24 | C25 | C26 | 5.9° | 60.0° |
| H241 | C24 | C25 | H251 | 114.3° | 180.0° |
| H241 | C24 | C25 | H252 | 126.1° | 60.0° |
| H242 | C24 | C25 | C26 | 125.6° | 60.0° |
| H242 | C24 | C25 | H251 | 5.4° | 60.0° |
| H242 | C24 | C25 | H252 | 114.2° | 180.0° |
| C26 | C25 | H251 | H252 | 119.4° | 120.0° |
| C25 | C26 | C27 | H261 | 120.9° | 120.0° |
| C25 | C26 | C27 | H262 | 120.9° | 120.0° |
| C25 | C26 | H261 | H262 | 117.1° | 120.1° |
| C25 | C26 | C27 | C28 | 170.4° | 180.0° |
| C25 | C26 | C27 | H271 | 69.3° | 60.0° |
| C25 | C26 | C27 | H272 | 50.1° | 60.0° |
| H251 | C25 | C26 | C27 | 78.1° | 60.0° |
| H251 | C25 | C26 | H261 | 161.0° | 179.9° |
| H251 | C25 | C26 | H262 | 42.9° | 59.9° |
| H252 | C25 | C26 | C27 | 41.5° | 60.0° |
| H252 | C25 | C26 | H261 | 79.4° | 60.0° |
| H252 | C25 | C26 | H262 | 162.5° | 179.9° |
| C27 | C26 | H261 | H262 | 117.1° | 120.0° |
| C26 | C27 | C28 | H271 | 120.3° | 120.0° |
| C26 | C27 | C28 | H272 | 120.3° | 120.0° |
| C26 | C27 | H271 | H272 | 119.0° | 120.0° |
| C26 | C27 | C28 | C29 | 138.3° | 127.6° |
| C26 | C27 | C28 | H281 | 41.7° | 52.4° |
| H261 | C26 | C27 | C28 | 49.5° | 60.0° |
| H261 | C26 | C27 | H271 | 169.8° | 180.0° |
| H261 | C26 | C27 | H272 | 70.8° | 60.0° |
| H262 | C26 | C27 | C28 | 68.6° | 60.0° |
| H262 | C26 | C27 | H271 | 51.7° | 60.0° |
| H262 | C26 | C27 | H272 | 171.0° | 180.0° |
| C28 | C27 | H271 | H272 | 119.0° | 120.0° |
| C27 | C28 | C29 | H281 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 2.9° | 7.6° |
| C27 | C28 | C29 | H291 | 177.1° | 172.5° |
| H271 | C27 | C28 | C29 | 101.4° | 7.6° |
| H271 | C27 | C28 | H281 | 78.6° | 172.4° |
| H272 | C27 | C28 | C29 | 18.0° | 112.4° |
| H272 | C27 | C28 | H281 | 162.0° | 67.6° |
| C28 | C29 | C30 | H291 | 180.0° | 179.9° |
| C28 | C29 | C30 | C31 | 173.0° | 126.3° |
| C28 | C29 | C30 | H301 | 66.6° | 113.7° |
| C28 | C29 | C30 | H302 | 52.7° | 6.3° |
| H281 | C28 | C29 | C30 | 177.1° | 172.4° |
| H281 | C28 | C29 | H291 | 2.9° | 7.5° |
| C29 | C30 | C31 | H301 | 120.4° | 119.9° |
| C29 | C30 | C31 | H302 | 120.4° | 120.1° |
| C29 | C30 | H301 | H302 | 118.9° | 120.0° |
| C29 | C30 | C31 | C32 | 166.7° | 180.0° |
| C29 | C30 | C31 | H311 | 72.4° | 60.1° |
| C29 | C30 | C31 | H312 | 45.9° | 60.0° |
| H291 | C29 | C30 | C31 | 7.0° | 53.6° |
| H291 | C29 | C30 | H301 | 113.4° | 66.4° |
| H291 | C29 | C30 | H302 | 127.3° | 173.6° |
| C31 | C30 | H301 | H302 | 118.9° | 120.0° |
| C30 | C31 | C32 | H311 | 120.9° | 119.9° |
| C30 | C31 | C32 | H312 | 120.9° | 120.0° |
| C30 | C31 | H311 | H312 | 117.3° | 120.1° |
| C30 | C31 | C32 | C33 | 1.4° | 180.0° |
| C30 | C31 | C32 | H321 | 119.2° | 60.0° |
| C30 | C31 | C32 | H322 | 121.9° | 59.9° |
| H301 | C30 | C31 | C32 | 46.4° | 60.1° |
| H301 | C30 | C31 | H311 | 167.3° | 180.0° |
| H301 | C30 | C31 | H312 | 74.5° | 60.0° |
| H302 | C30 | C31 | C32 | 72.9° | 59.9° |
| H302 | C30 | C31 | H311 | 48.0° | 60.0° |
| H302 | C30 | C31 | H312 | 166.3° | 179.9° |
| C32 | C31 | H311 | H312 | 117.3° | 120.0° |
| C31 | C32 | C33 | H321 | 120.6° | 119.9° |
| C31 | C32 | C33 | H322 | 120.6° | 120.0° |
| C31 | C32 | H321 | H322 | 118.3° | 120.0° |
| C31 | C32 | C33 | C34 | 158.2° | 180.0° |
| C31 | C32 | C33 | H331 | 81.4° | 60.0° |
| C31 | C32 | C33 | H332 | 37.8° | 60.0° |
| H311 | C31 | C32 | C33 | 122.2° | 60.1° |
| H311 | C31 | C32 | H321 | 1.7° | 179.9° |
| H311 | C31 | C32 | H322 | 117.2° | 60.0° |
| H312 | C31 | C32 | C33 | 119.5° | 60.0° |
| H312 | C31 | C32 | H321 | 120.0° | 60.0° |
| H312 | C31 | C32 | H322 | 1.1° | 180.0° |
| C33 | C32 | H321 | H322 | 118.3° | 120.1° |
| C32 | C33 | C34 | H331 | 120.4° | 120.0° |
| C32 | C33 | C34 | H332 | 120.4° | 120.0° |
| C32 | C33 | H331 | H332 | 118.8° | 120.0° |
| C32 | C33 | C34 | C35 | 150.7° | 180.0° |
| C32 | C33 | C34 | H341 | 89.0° | 60.0° |
| C32 | C33 | C34 | H342 | 30.4° | 60.0° |
| H321 | C32 | C33 | C34 | 37.6° | 60.0° |
| H321 | C32 | C33 | H331 | 158.0° | 180.0° |
| H321 | C32 | C33 | H332 | 82.8° | 60.0° |
| H322 | C32 | C33 | C34 | 81.2° | 60.0° |
| H322 | C32 | C33 | H331 | 39.2° | 60.0° |
| H322 | C32 | C33 | H332 | 158.4° | 180.0° |
| C34 | C33 | H331 | H332 | 118.8° | 120.0° |
| C33 | C34 | C35 | H341 | 120.3° | 120.0° |
| C33 | C34 | C35 | H342 | 120.3° | 120.0° |
| C33 | C34 | H341 | H342 | 119.1° | 120.1° |
| C33 | C34 | C35 | C36 | 128.4° | 180.0° |
| C33 | C34 | C35 | H351 | 111.1° | 60.0° |
| C33 | C34 | C35 | H352 | 7.8° | 60.0° |
| H331 | C33 | C34 | C35 | 30.3° | 60.0° |
| H331 | C33 | C34 | H341 | 150.6° | 179.9° |
| H331 | C33 | C34 | H342 | 90.0° | 60.0° |
| H332 | C33 | C34 | C35 | 88.9° | 60.0° |
| H332 | C33 | C34 | H341 | 31.4° | 60.0° |
| H332 | C33 | C34 | H342 | 150.8° | 180.0° |
| C35 | C34 | H341 | H342 | 119.2° | 119.9° |
| C34 | C35 | C36 | H351 | 120.5° | 119.9° |
| C34 | C35 | C36 | H352 | 120.5° | 120.0° |
| C34 | C35 | H351 | H352 | 118.4° | 119.9° |
| C34 | C35 | C36 | C37 | 100.4° | 180.0° |
| C34 | C35 | C36 | H361 | 20.1° | 60.0° |
| C34 | C35 | C36 | H362 | 139.0° | 60.0° |
| H341 | C34 | C35 | C36 | 8.0° | 60.0° |
| H341 | C34 | C35 | H351 | 128.6° | 180.0° |
| H341 | C34 | C35 | H352 | 112.5° | 60.1° |
| H342 | C34 | C35 | C36 | 111.4° | 60.0° |
| H342 | C34 | C35 | H351 | 9.2° | 60.1° |
| H342 | C34 | C35 | H352 | 128.1° | 180.0° |
| C36 | C35 | H351 | H352 | 118.4° | 120.1° |
| C35 | C36 | C37 | H361 | 120.6° | 120.0° |
| C35 | C36 | C37 | H362 | 120.5° | 120.0° |
| C35 | C36 | H361 | H362 | 118.3° | 120.0° |
| C35 | C36 | C37 | H371 | 180.0° | 60.0° |
| C35 | C36 | C37 | H372 | 60.0° | 60.0° |
| C35 | C36 | C37 | H373 | 60.0° | 180.0° |
| H351 | C35 | C36 | C37 | 139.0° | 60.0° |
| H351 | C35 | C36 | H361 | 100.4° | 180.0° |
| H351 | C35 | C36 | H362 | 18.5° | 59.9° |
| H352 | C35 | C36 | C37 | 20.1° | 60.0° |
| H352 | C35 | C36 | H361 | 140.7° | 60.0° |
| H352 | C35 | C36 | H362 | 100.4° | 180.0° |
| C37 | C36 | H361 | H362 | 118.3° | 120.0° |
| C36 | C37 | H371 | H372 | 120.0° | 120.0° |
| C36 | C37 | H371 | H373 | 120.0° | 120.0° |
| C36 | C37 | H372 | H373 | 120.0° | 120.0° |
| H361 | C36 | C37 | H371 | 59.5° | NaN° |
| H361 | C36 | C37 | H372 | 179.5° | 60.0° |
| H361 | C36 | C37 | H373 | 60.6° | 60.0° |
| H362 | C36 | C37 | H371 | 59.5° | 60.0° |
| H362 | C36 | C37 | H372 | 60.6° | 180.0° |
| H362 | C36 | C37 | H373 | 179.5° | 60.1° |
| H371 | C37 | H372 | H373 | 120.0° | 120.0° |
