XKJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C28 | C27 | sing | 1.53Å | 1.55Å | |
| C28 | C29 | sing | 1.53Å | 1.55Å | |
| C32 | C31 | sing | 1.53Å | 1.55Å | |
| C32 | C33 | sing | 1.53Å | 1.54Å | |
| C26 | C27 | sing | 1.53Å | 1.56Å | |
| C26 | C25 | sing | 1.53Å | 1.55Å | |
| C31 | C30 | sing | 1.53Å | 1.55Å | |
| C29 | C30 | sing | 1.53Å | 1.55Å | |
| C24 | C25 | sing | 1.53Å | 1.56Å | |
| C24 | C23 | sing | 1.53Å | 1.55Å | |
| C33 | C34 | sing | 1.53Å | 1.53Å | |
| C23 | O1 | sing | 1.43Å | 1.44Å | |
| O2 | C2 | sing | 1.43Å | 1.39Å | |
| O1 | C1 | sing | 1.43Å | 1.42Å | |
| C1 | C2 | sing | 1.53Å | 1.55Å | |
| C1 | O5 | sing | 1.43Å | 1.40Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C3 | O3 | sing | 1.43Å | 1.40Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| O5 | C5 | sing | 1.43Å | 1.42Å | |
| C4 | C5 | sing | 1.53Å | 1.56Å | |
| C4 | O4 | sing | 1.43Å | 1.40Å | |
| C5 | C6 | sing | 1.53Å | 1.59Å | |
| C6 | O6 | sing | 1.43Å | 1.44Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C34 | H343 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | C28 | C29 | 114.5° | 109.5° |
| C28 | C27 | C26 | 115.0° | 109.5° |
| C27 | C28 | H281 | 108.2° | 109.5° |
| C27 | C28 | H282 | 108.2° | 109.5° |
| C28 | C27 | H271 | 108.1° | 109.5° |
| C28 | C27 | H272 | 108.1° | 109.5° |
| C28 | C29 | C30 | 113.7° | 109.5° |
| C29 | C28 | H281 | 108.2° | 109.5° |
| C29 | C28 | H282 | 108.2° | 109.4° |
| C28 | C29 | H291 | 108.4° | 109.5° |
| C28 | C29 | H292 | 108.4° | 109.5° |
| C31 | C32 | C33 | 113.6° | 109.4° |
| C32 | C31 | C30 | 115.0° | 109.5° |
| C32 | C31 | H312 | 108.1° | 109.5° |
| C32 | C31 | H311 | 108.1° | 109.5° |
| C31 | C32 | H322 | 108.4° | 109.5° |
| C31 | C32 | H321 | 108.4° | 109.5° |
| C32 | C33 | C34 | 113.5° | 109.5° |
| C33 | C32 | H322 | 108.4° | 109.5° |
| C33 | C32 | H321 | 108.4° | 109.5° |
| C32 | C33 | H331 | 108.4° | 109.5° |
| C32 | C33 | H332 | 108.5° | 109.5° |
| C27 | C26 | C25 | 114.6° | 109.5° |
| C27 | C26 | H262 | 108.2° | 109.5° |
| C27 | C26 | H261 | 108.2° | 109.5° |
| C26 | C27 | H271 | 108.1° | 109.5° |
| C26 | C27 | H272 | 108.1° | 109.4° |
| C26 | C25 | C24 | 115.5° | 109.5° |
| C25 | C26 | H262 | 108.2° | 109.5° |
| C25 | C26 | H261 | 108.2° | 109.5° |
| C26 | C25 | H252 | 107.9° | 109.5° |
| C26 | C25 | H251 | 108.0° | 109.5° |
| C31 | C30 | C29 | 115.6° | 109.5° |
| C31 | C30 | H302 | 107.9° | 109.5° |
| C31 | C30 | H301 | 107.9° | 109.5° |
| C30 | C31 | H312 | 108.1° | 109.5° |
| C30 | C31 | H311 | 108.1° | 109.4° |
| C30 | C29 | H291 | 108.4° | 109.5° |
| C30 | C29 | H292 | 108.4° | 109.5° |
| C29 | C30 | H302 | 107.9° | 109.5° |
| C29 | C30 | H301 | 107.9° | 109.5° |
| C25 | C24 | C23 | 114.7° | 109.5° |
| C25 | C24 | H241 | 108.1° | 109.5° |
| C25 | C24 | H242 | 108.2° | 109.4° |
| C24 | C25 | H252 | 108.0° | 109.5° |
| C24 | C25 | H251 | 107.9° | 109.5° |
| C24 | C23 | O1 | 110.9° | 109.5° |
| C23 | C24 | H241 | 108.2° | 109.5° |
| C23 | C24 | H242 | 108.1° | 109.5° |
| C24 | C23 | H232 | 109.1° | 109.5° |
| C24 | C23 | H231 | 109.1° | 109.5° |
| C34 | C33 | H331 | 108.5° | 109.4° |
| C34 | C33 | H332 | 108.4° | 109.4° |
| C33 | C34 | H343 | 109.5° | 109.4° |
| C33 | C34 | H342 | 109.5° | 109.5° |
| C33 | C34 | H341 | 109.5° | 109.5° |
| C23 | O1 | C1 | 115.6° | 114.0° |
| O1 | C23 | H232 | 109.1° | 109.5° |
| O1 | C23 | H231 | 109.1° | 109.5° |
| O2 | C2 | C1 | 108.1° | 109.5° |
| O2 | C2 | C3 | 109.3° | 109.5° |
| O2 | C2 | H2 | 111.9° | 109.5° |
| C2 | O2 | HO2 | 109.5° | 114.0° |
| O1 | C1 | C2 | 112.1° | 109.5° |
| O1 | C1 | O5 | 108.8° | 109.5° |
| O1 | C1 | H1 | 108.8° | 109.5° |
| C2 | C1 | O5 | 110.8° | 109.4° |
| C1 | C2 | C3 | 107.9° | 109.2° |
| C2 | C1 | H1 | 107.2° | 109.5° |
| C1 | C2 | H2 | 109.7° | 109.5° |
| C1 | O5 | C5 | 122.1° | 114.1° |
| O5 | C1 | H1 | 109.1° | 109.5° |
| C2 | C3 | O3 | 107.3° | 109.5° |
| C2 | C3 | C4 | 109.4° | 109.0° |
| C2 | C3 | H3 | 110.5° | 109.6° |
| C3 | C2 | H2 | 109.8° | 109.5° |
| O3 | C3 | C4 | 106.6° | 109.5° |
| O3 | C3 | H3 | 112.6° | 109.5° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| C3 | C4 | C5 | 112.1° | 109.2° |
| C3 | C4 | O4 | 108.5° | 109.5° |
| C4 | C3 | H3 | 110.2° | 109.5° |
| C3 | C4 | H4 | 109.1° | 109.5° |
| O5 | C5 | C4 | 116.3° | 109.4° |
| O5 | C5 | C6 | 104.4° | 109.4° |
| O5 | C5 | H5 | 109.7° | 109.5° |
| C5 | C4 | O4 | 106.8° | 109.5° |
| C4 | C5 | C6 | 110.8° | 109.5° |
| C4 | C5 | H5 | 107.8° | 109.5° |
| C5 | C4 | H4 | 109.1° | 109.5° |
| O4 | C4 | H4 | 111.3° | 109.6° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| C5 | C6 | O6 | 110.2° | 109.5° |
| C5 | C6 | H61 | 109.3° | 109.4° |
| C5 | C6 | H62 | 109.3° | 109.5° |
| C6 | C5 | H5 | 107.5° | 109.5° |
| O6 | C6 | H61 | 109.3° | 109.5° |
| O6 | C6 | H62 | 109.3° | 109.5° |
| C6 | O6 | HO6 | 109.5° | 114.0° |
| H61 | C6 | H62 | 109.4° | 109.5° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H262 | C26 | H261 | 109.5° | 109.5° |
| H281 | C28 | H282 | 109.5° | 109.5° |
| H232 | C23 | H231 | 109.5° | 109.5° |
| H252 | C25 | H251 | 109.5° | 109.5° |
| H271 | C27 | H272 | 109.5° | 109.5° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H302 | C30 | H301 | 109.4° | 109.5° |
| H312 | C31 | H311 | 109.4° | 109.5° |
| H322 | C32 | H321 | 109.5° | 109.5° |
| H331 | C33 | H332 | 109.5° | 109.5° |
| H343 | C34 | H342 | 109.5° | 109.5° |
| H343 | C34 | H341 | 109.5° | 109.4° |
| H342 | C34 | H341 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | C28 | C29 | H281 | 120.7° | 120.0° |
| C27 | C28 | C29 | H282 | 120.8° | 120.0° |
| C28 | C27 | C26 | H271 | 120.8° | 120.0° |
| C28 | C27 | C26 | H272 | 120.8° | 120.0° |
| C28 | C27 | C26 | C25 | 160.4° | 180.0° |
| C27 | C28 | C29 | C30 | 79.9° | 180.0° |
| C28 | C27 | C26 | H262 | 78.8° | 60.0° |
| C28 | C27 | C26 | H261 | 39.7° | 60.0° |
| C27 | C28 | H281 | H282 | 117.7° | 120.0° |
| C28 | C27 | H271 | H272 | 117.5° | 120.1° |
| C27 | C28 | C29 | H291 | 40.7° | 60.0° |
| C27 | C28 | C29 | H292 | 159.5° | 60.0° |
| C29 | C28 | C27 | C26 | 107.8° | 180.0° |
| C28 | C29 | C30 | C31 | 85.7° | 180.0° |
| C28 | C29 | C30 | H291 | 120.6° | 120.0° |
| C28 | C29 | C30 | H292 | 120.6° | 120.0° |
| C29 | C28 | H281 | H282 | 117.7° | 120.0° |
| C29 | C28 | C27 | H271 | 13.0° | 60.0° |
| C29 | C28 | C27 | H272 | 131.4° | 60.0° |
| C28 | C29 | H291 | H292 | 118.1° | 120.0° |
| C28 | C29 | C30 | H302 | 153.4° | 60.0° |
| C28 | C29 | C30 | H301 | 35.2° | 60.0° |
| C31 | C32 | C33 | H322 | 120.6° | 120.0° |
| C31 | C32 | C33 | H321 | 120.6° | 120.0° |
| C32 | C31 | C30 | H312 | 120.8° | 120.0° |
| C32 | C31 | C30 | H311 | 120.8° | 120.0° |
| C32 | C31 | C30 | C29 | 46.0° | 180.0° |
| C31 | C32 | C33 | C34 | 48.4° | 180.0° |
| C32 | C31 | C30 | H302 | 75.0° | 60.0° |
| C32 | C31 | C30 | H301 | 166.8° | 60.0° |
| C32 | C31 | H312 | H311 | 117.5° | 120.1° |
| C31 | C32 | H322 | H321 | 118.1° | 120.0° |
| C31 | C32 | C33 | H331 | 72.2° | 60.0° |
| C31 | C32 | C33 | H332 | 168.9° | 60.0° |
| C33 | C32 | C31 | C30 | 48.7° | 180.0° |
| C32 | C33 | C34 | H331 | 120.6° | 120.0° |
| C32 | C33 | C34 | H332 | 120.6° | 120.0° |
| C33 | C32 | C31 | H312 | 72.1° | 60.0° |
| C33 | C32 | C31 | H311 | 169.5° | 60.0° |
| C33 | C32 | H322 | H321 | 118.1° | 120.1° |
| C32 | C33 | H331 | H332 | 118.2° | 120.1° |
| C32 | C33 | C34 | H343 | 180.0° | 60.0° |
| C32 | C33 | C34 | H342 | 60.0° | 60.0° |
| C32 | C33 | C34 | H341 | 60.0° | 180.0° |
| C27 | C26 | C25 | H262 | 120.7° | 120.0° |
| C27 | C26 | C25 | H261 | 120.8° | 120.0° |
| C27 | C26 | C25 | C24 | 55.6° | 180.0° |
| C27 | C26 | H262 | H261 | 117.7° | 120.0° |
| C26 | C27 | C28 | H281 | 12.9° | 60.0° |
| C26 | C27 | C28 | H282 | 131.4° | 60.0° |
| C27 | C26 | C25 | H252 | 176.4° | 60.0° |
| C27 | C26 | C25 | H251 | 65.3° | 60.0° |
| C26 | C27 | H271 | H272 | 117.5° | 120.0° |
| C26 | C25 | C24 | H252 | 120.9° | 120.0° |
| C26 | C25 | C24 | H251 | 120.9° | 120.0° |
| C26 | C25 | C24 | C23 | 168.1° | 180.0° |
| C26 | C25 | C24 | H241 | 47.3° | 60.0° |
| C26 | C25 | C24 | H242 | 71.2° | 60.0° |
| C25 | C26 | H262 | H261 | 117.7° | 120.0° |
| C26 | C25 | H252 | H251 | 117.3° | 120.0° |
| C25 | C26 | C27 | H271 | 39.6° | 60.0° |
| C25 | C26 | C27 | H272 | 78.8° | 60.0° |
| C31 | C30 | C29 | H302 | 120.9° | 120.0° |
| C31 | C30 | C29 | H301 | 120.9° | 120.0° |
| C31 | C30 | C29 | H291 | 153.7° | 60.0° |
| C31 | C30 | C29 | H292 | 34.9° | 60.0° |
| C31 | C30 | H302 | H301 | 117.2° | 120.0° |
| C30 | C31 | H312 | H311 | 117.5° | 120.0° |
| C30 | C31 | C32 | H322 | 71.9° | 60.0° |
| C30 | C31 | C32 | H321 | 169.3° | 60.0° |
| C30 | C29 | C28 | H281 | 159.4° | 60.0° |
| C30 | C29 | C28 | H282 | 40.9° | 60.0° |
| C30 | C29 | H291 | H292 | 118.1° | 120.0° |
| C29 | C30 | H302 | H301 | 117.2° | 120.0° |
| C29 | C30 | C31 | H312 | 166.8° | 60.0° |
| C29 | C30 | C31 | H311 | 74.9° | 60.0° |
| C25 | C24 | C23 | H241 | 120.7° | 120.0° |
| C25 | C24 | C23 | H242 | 120.8° | 120.0° |
| C25 | C24 | C23 | O1 | 115.2° | 180.0° |
| C25 | C24 | H241 | H242 | 117.6° | 120.0° |
| C24 | C25 | C26 | H262 | 65.2° | 60.0° |
| C24 | C25 | C26 | H261 | 176.3° | 60.0° |
| C25 | C24 | C23 | H232 | 124.6° | 60.0° |
| C25 | C24 | C23 | H231 | 5.0° | 60.0° |
| C24 | C25 | H252 | H251 | 117.3° | 120.0° |
| C24 | C23 | O1 | H232 | 120.2° | 120.0° |
| C24 | C23 | O1 | H231 | 120.2° | 120.0° |
| C24 | C23 | O1 | C1 | 65.9° | 180.0° |
| C23 | C24 | H241 | H242 | 117.6° | 120.1° |
| C24 | C23 | H232 | H231 | 119.4° | 120.0° |
| C23 | C24 | C25 | H252 | 71.0° | 60.0° |
| C23 | C24 | C25 | H251 | 47.2° | 60.0° |
| C34 | C33 | C32 | H322 | 169.0° | 60.0° |
| C34 | C33 | C32 | H321 | 72.3° | 60.0° |
| C34 | C33 | H331 | H332 | 118.1° | 119.9° |
| C33 | C34 | H343 | H342 | 120.0° | 120.0° |
| C33 | C34 | H343 | H341 | 120.0° | 120.0° |
| C33 | C34 | H342 | H341 | 120.0° | 120.0° |
| C23 | O1 | C1 | C2 | 151.1° | 175.0° |
| C23 | O1 | C1 | O5 | 86.0° | 65.1° |
| O1 | C23 | C24 | H241 | 5.6° | 60.1° |
| O1 | C23 | C24 | H242 | 124.0° | 60.0° |
| C23 | O1 | C1 | H1 | 32.8° | 55.0° |
| O1 | C23 | H232 | H231 | 119.4° | 120.0° |
| O2 | C2 | C1 | O1 | 59.9° | 62.5° |
| O2 | C2 | C1 | C3 | 118.1° | 119.9° |
| O2 | C2 | C1 | H2 | 122.3° | 120.1° |
| O2 | C2 | C1 | O5 | 178.3° | 177.6° |
| O2 | C2 | C3 | H2 | 123.1° | 120.2° |
| O2 | C2 | C3 | O3 | 65.4° | 63.2° |
| O2 | C2 | C3 | C4 | 179.3° | 176.9° |
| O2 | C2 | C3 | H3 | 57.7° | 57.0° |
| O2 | C2 | C1 | H1 | 59.4° | 57.6° |
| O1 | C1 | C2 | O5 | 121.7° | 120.0° |
| O1 | C1 | C2 | H1 | 119.3° | 120.0° |
| O1 | C1 | O5 | H1 | 118.6° | 120.0° |
| O1 | C1 | C2 | C3 | 178.1° | 177.6° |
| O1 | C1 | O5 | C5 | 170.3° | 178.9° |
| O1 | C1 | C2 | H2 | 62.4° | 57.7° |
| C1 | O1 | C23 | H232 | 173.8° | 60.0° |
| C1 | O1 | C23 | H231 | 54.3° | 60.0° |
| C2 | C1 | O5 | H1 | 117.8° | 120.0° |
| C1 | C2 | C3 | H2 | 119.5° | 119.9° |
| C1 | C2 | C3 | O3 | 177.2° | 176.9° |
| C1 | C2 | C3 | C4 | 61.9° | 57.0° |
| C2 | C1 | O5 | C5 | 46.7° | 61.2° |
| C1 | C2 | C3 | H3 | 59.7° | 62.9° |
| C1 | C2 | O2 | HO2 | 180.0° | 59.9° |
| O5 | C1 | C2 | C3 | 60.2° | 57.6° |
| C1 | O5 | C5 | C4 | 32.6° | 61.2° |
| C1 | O5 | C5 | C6 | 155.1° | 178.8° |
| C1 | O5 | C5 | H5 | 90.0° | 58.8° |
| O5 | C1 | C2 | H2 | 59.4° | 62.3° |
| C2 | C3 | O3 | C4 | 117.1° | 119.6° |
| C2 | C3 | O3 | H3 | 121.9° | 120.2° |
| C2 | C3 | C4 | H3 | 121.8° | 119.9° |
| C2 | C3 | C4 | C5 | 47.9° | 57.0° |
| C2 | C3 | C4 | O4 | 165.6° | 176.9° |
| C2 | C3 | C4 | H4 | 73.0° | 62.9° |
| C3 | C2 | C1 | H1 | 58.7° | 62.4° |
| C3 | C2 | O2 | HO2 | 62.8° | 179.6° |
| C2 | C3 | O3 | HO3 | 180.0° | 60.5° |
| O3 | C3 | C4 | H3 | 122.5° | 120.2° |
| O3 | C3 | C4 | C5 | 163.7° | 176.9° |
| O3 | C3 | C4 | O4 | 78.7° | 63.2° |
| O3 | C3 | C4 | H4 | 42.8° | 57.0° |
| O3 | C3 | C2 | H2 | 57.7° | 56.9° |
| C3 | C4 | C5 | O5 | 31.8° | 57.6° |
| C3 | C4 | C5 | O4 | 118.7° | 119.9° |
| C3 | C4 | C5 | H4 | 120.9° | 119.9° |
| C3 | C4 | O4 | H4 | 120.0° | 120.1° |
| C3 | C4 | C5 | C6 | 150.8° | 177.6° |
| C3 | C4 | C5 | H5 | 91.8° | 62.3° |
| C4 | C3 | C2 | H2 | 57.6° | 62.9° |
| C3 | C4 | O4 | HO4 | 180.0° | 60.0° |
| C4 | C3 | O3 | HO3 | 62.8° | 180.0° |
| O5 | C5 | C4 | C6 | 119.0° | 119.9° |
| O5 | C5 | C4 | H5 | 123.6° | 120.0° |
| O5 | C5 | C4 | O4 | 150.5° | 177.5° |
| O5 | C5 | C6 | H5 | 116.4° | 120.0° |
| O5 | C5 | C6 | O6 | 85.7° | 65.1° |
| O5 | C5 | C6 | H61 | 34.4° | 174.9° |
| O5 | C5 | C6 | H62 | 154.2° | 55.0° |
| O5 | C5 | C4 | H4 | 89.1° | 62.3° |
| C5 | O5 | C1 | H1 | 71.1° | 58.8° |
| C5 | C4 | O4 | H4 | 118.9° | 120.2° |
| C4 | C5 | C6 | H5 | 117.6° | 120.1° |
| C4 | C5 | C6 | O6 | 40.3° | 175.0° |
| C4 | C5 | C6 | H61 | 160.4° | 55.0° |
| C4 | C5 | C6 | H62 | 79.9° | 64.9° |
| C5 | C4 | C3 | H3 | 73.9° | 63.0° |
| C5 | C4 | O4 | HO4 | 58.9° | 179.7° |
| O4 | C4 | C5 | C6 | 90.5° | 62.5° |
| O4 | C4 | C3 | H3 | 43.8° | 56.9° |
| O4 | C4 | C5 | H5 | 26.9° | 57.6° |
| C5 | C6 | O6 | H61 | 120.1° | 120.0° |
| C5 | C6 | O6 | H62 | 120.1° | 120.1° |
| C5 | C6 | H61 | H62 | 119.6° | 120.0° |
| C6 | C5 | C4 | H4 | 29.9° | 57.7° |
| C5 | C6 | O6 | HO6 | 180.0° | 180.0° |
| O6 | C6 | H61 | H62 | 119.7° | 120.0° |
| O6 | C6 | C5 | H5 | 157.9° | 54.9° |
| H61 | C6 | C5 | H5 | 82.0° | 65.0° |
| H61 | C6 | O6 | HO6 | 59.9° | 60.0° |
| H62 | C6 | C5 | H5 | 37.7° | 175.0° |
| H62 | C6 | O6 | HO6 | 59.9° | 59.9° |
| H3 | C3 | C4 | H4 | 165.3° | 177.1° |
| H3 | C3 | C2 | H2 | 179.2° | 177.2° |
| H3 | C3 | O3 | HO3 | 58.2° | 59.8° |
| H241 | C24 | C23 | H232 | 114.7° | 59.9° |
| H241 | C24 | C23 | H231 | 125.7° | 179.9° |
| H241 | C24 | C25 | H252 | 168.2° | 180.0° |
| H241 | C24 | C25 | H251 | 73.5° | 60.0° |
| H242 | C24 | C23 | H232 | 3.8° | 180.0° |
| H242 | C24 | C23 | H231 | 115.8° | 60.0° |
| H242 | C24 | C25 | H252 | 49.7° | 60.0° |
| H242 | C24 | C25 | H251 | 168.0° | 180.0° |
| H262 | C26 | C25 | H252 | 55.7° | NaN° |
| H262 | C26 | C25 | H251 | 174.0° | 60.0° |
| H262 | C26 | C27 | H271 | 160.4° | 180.0° |
| H262 | C26 | C27 | H272 | 42.0° | 60.0° |
| H261 | C26 | C25 | H252 | 62.8° | 60.0° |
| H261 | C26 | C25 | H251 | 55.5° | 180.0° |
| H261 | C26 | C27 | H271 | 81.1° | 60.0° |
| H261 | C26 | C27 | H272 | 160.5° | 180.0° |
| H281 | C28 | C27 | H271 | 133.7° | 179.9° |
| H281 | C28 | C27 | H272 | 107.9° | 60.0° |
| H281 | C28 | C29 | H291 | 80.0° | 180.0° |
| H281 | C28 | C29 | H292 | 38.8° | 60.0° |
| H282 | C28 | C27 | H271 | 107.8° | 59.9° |
| H282 | C28 | C27 | H272 | 10.6° | 180.0° |
| H282 | C28 | C29 | H291 | 161.5° | 60.0° |
| H282 | C28 | C29 | H292 | 79.7° | 180.0° |
| H5 | C5 | C4 | H4 | 147.3° | 177.8° |
| H4 | C4 | O4 | HO4 | 60.0° | 60.2° |
| H1 | C1 | C2 | H2 | 178.3° | 177.7° |
| H2 | C2 | O2 | HO2 | 59.1° | 60.2° |
| H291 | C29 | C30 | H302 | 32.7° | 180.0° |
| H291 | C29 | C30 | H301 | 85.5° | 60.0° |
| H292 | C29 | C30 | H302 | 86.0° | 60.0° |
| H292 | C29 | C30 | H301 | 155.8° | 180.0° |
| H302 | C30 | C31 | H312 | 45.9° | 180.0° |
| H302 | C30 | C31 | H311 | 164.2° | 60.0° |
| H301 | C30 | C31 | H312 | 72.3° | 60.0° |
| H301 | C30 | C31 | H311 | 46.0° | 180.0° |
| H312 | C31 | C32 | H322 | 167.3° | 179.9° |
| H312 | C31 | C32 | H321 | 48.5° | 60.0° |
| H311 | C31 | C32 | H322 | 48.9° | 60.0° |
| H311 | C31 | C32 | H321 | 69.9° | 180.0° |
| H322 | C32 | C33 | H331 | 48.4° | 180.0° |
| H322 | C32 | C33 | H332 | 70.5° | 60.0° |
| H321 | C32 | C33 | H331 | 167.2° | 59.9° |
| H321 | C32 | C33 | H332 | 48.3° | 180.0° |
| H331 | C33 | C34 | H343 | 59.4° | 179.9° |
| H331 | C33 | C34 | H342 | 179.4° | 60.1° |
| H331 | C33 | C34 | H341 | 60.6° | 60.0° |
| H332 | C33 | C34 | H343 | 59.4° | 60.0° |
| H332 | C33 | C34 | H342 | 60.6° | 180.0° |
| H332 | C33 | C34 | H341 | 179.4° | 59.9° |
| H343 | C34 | H342 | H341 | 120.0° | 120.0° |
