OR1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C42 | C37 | doub | 1.38Å | 1.52Å | Aromatic |
| C42 | C41 | sing | 1.38Å | 1.52Å | Aromatic |
| C37 | C38 | sing | 1.38Å | 1.52Å | Aromatic |
| C44 | C41 | sing | 1.51Å | 1.53Å | |
| C41 | C40 | doub | 1.39Å | 1.53Å | Aromatic |
| C38 | C39 | doub | 1.38Å | 1.52Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.52Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.51Å | Aromatic |
| C40 | C39 | sing | 1.39Å | 1.52Å | Aromatic |
| C40 | O36 | sing | 1.36Å | 1.39Å | |
| C13 | C12 | sing | 1.38Å | 1.52Å | Aromatic |
| C39 | C43 | sing | 1.51Å | 1.53Å | |
| O36 | C35 | sing | 1.43Å | 1.41Å | |
| C15 | C16 | doub | 1.38Å | 1.54Å | Aromatic |
| O09 | C05 | sing | 1.43Å | 1.40Å | |
| C12 | C10 | sing | 1.51Å | 1.53Å | |
| C12 | C17 | doub | 1.38Å | 1.53Å | Aromatic |
| C10 | C06 | sing | 1.53Å | 1.54Å | |
| N07 | C06 | sing | 1.46Å | 1.45Å | |
| N07 | C08 | sing | 1.35Å | 1.45Å | |
| C35 | C08 | sing | 1.51Å | 1.53Å | |
| C06 | C05 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.38Å | 1.53Å | Aromatic |
| C05 | C03 | sing | 1.53Å | 1.53Å | |
| C08 | O11 | doub | 1.21Å | 1.19Å | |
| C03 | C02 | sing | 1.53Å | 1.54Å | |
| C02 | N01 | sing | 1.47Å | 1.46Å | |
| C02 | C04 | sing | 1.53Å | 1.54Å | |
| N01 | C18 | sing | 1.35Å | 1.46Å | |
| C04 | C22 | sing | 1.51Å | 1.53Å | |
| C18 | O20 | sing | 1.35Å | 1.39Å | |
| C18 | O19 | doub | 1.22Å | 1.18Å | |
| O20 | C21 | sing | 1.45Å | 1.49Å | |
| C28 | C21 | sing | 1.54Å | 1.22Å | |
| C28 | O29 | sing | 1.44Å | 1.50Å | |
| C22 | C27 | doub | 1.38Å | 1.52Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.52Å | Aromatic |
| C21 | C31 | sing | 1.54Å | 1.63Å | |
| O29 | C30 | sing | 1.44Å | 1.52Å | |
| C27 | C26 | sing | 1.38Å | 1.52Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.52Å | Aromatic |
| O32 | C30 | sing | 1.43Å | 1.61Å | |
| O32 | C33 | sing | 1.44Å | 1.30Å | |
| C30 | C31 | sing | 1.55Å | 1.18Å | |
| C33 | C34 | sing | 1.55Å | 1.47Å | |
| C31 | C34 | sing | 1.55Å | 1.59Å | |
| C26 | C25 | doub | 1.38Å | 1.53Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.52Å | Aromatic |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| C38 | H381 | sing | 1.08Å | 1.08Å | |
| C42 | H421 | sing | 1.08Å | 1.08Å | |
| C43 | H432 | sing | 1.09Å | 1.10Å | |
| C43 | H433 | sing | 1.09Å | 1.10Å | |
| C43 | H431 | sing | 1.09Å | 1.10Å | |
| C44 | H442 | sing | 1.09Å | 1.10Å | |
| C44 | H443 | sing | 1.09Å | 1.10Å | |
| C44 | H441 | sing | 1.09Å | 1.10Å | |
| N01 | H011 | sing | 0.97Å | 1.00Å | |
| N07 | H071 | sing | 0.97Å | 1.00Å | |
| O09 | H091 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C37 | C42 | C41 | 120.1° | 120.1° |
| C42 | C37 | C38 | 120.2° | 120.1° |
| C42 | C37 | H371 | 119.9° | 120.0° |
| C37 | C42 | H421 | 120.0° | 120.0° |
| C42 | C41 | C44 | 121.9° | 120.0° |
| C42 | C41 | C40 | 119.5° | 120.0° |
| C41 | C42 | H421 | 120.0° | 119.9° |
| C37 | C38 | C39 | 120.3° | 120.0° |
| C38 | C37 | H371 | 119.9° | 119.9° |
| C37 | C38 | H381 | 119.9° | 120.0° |
| C44 | C41 | C40 | 118.5° | 120.0° |
| C41 | C44 | H442 | 109.5° | 109.4° |
| C41 | C44 | H443 | 109.5° | 109.5° |
| C41 | C44 | H441 | 109.5° | 109.5° |
| C41 | C40 | C39 | 120.8° | 119.9° |
| C41 | C40 | O36 | 120.2° | 120.1° |
| C38 | C39 | C40 | 119.1° | 119.9° |
| C38 | C39 | C43 | 121.4° | 120.0° |
| C39 | C38 | H381 | 119.9° | 119.9° |
| C13 | C14 | C15 | 119.7° | 120.0° |
| C14 | C13 | C12 | 120.8° | 120.0° |
| C14 | C13 | H131 | 119.6° | 120.0° |
| C13 | C14 | H141 | 120.1° | 120.0° |
| C14 | C15 | C16 | 120.1° | 120.0° |
| C14 | C15 | H151 | 120.0° | 120.0° |
| C15 | C14 | H141 | 120.2° | 120.0° |
| C39 | C40 | O36 | 118.9° | 120.0° |
| C40 | C39 | C43 | 119.5° | 120.1° |
| C40 | O36 | C35 | 112.6° | 117.0° |
| C13 | C12 | C10 | 120.4° | 120.0° |
| C13 | C12 | C17 | 119.8° | 120.0° |
| C12 | C13 | H131 | 119.6° | 120.0° |
| C39 | C43 | H432 | 109.5° | 109.5° |
| C39 | C43 | H433 | 109.5° | 109.4° |
| C39 | C43 | H431 | 109.4° | 109.5° |
| O36 | C35 | C08 | 107.3° | 109.4° |
| O36 | C35 | H351 | 110.0° | 109.4° |
| O36 | C35 | H352 | 110.0° | 109.5° |
| C15 | C16 | C17 | 120.2° | 120.0° |
| C16 | C15 | H151 | 119.9° | 120.0° |
| C15 | C16 | H161 | 119.9° | 120.0° |
| O09 | C05 | C06 | 112.6° | 109.5° |
| O09 | C05 | C03 | 109.2° | 109.5° |
| O09 | C05 | H051 | 108.8° | 109.5° |
| C05 | O09 | H091 | 109.5° | 113.9° |
| C10 | C12 | C17 | 119.8° | 120.0° |
| C12 | C10 | C06 | 106.6° | 109.4° |
| C12 | C10 | H101 | 110.2° | 109.5° |
| C12 | C10 | H102 | 110.2° | 109.5° |
| C12 | C17 | C16 | 119.5° | 120.0° |
| C12 | C17 | H171 | 120.3° | 120.0° |
| C10 | C06 | N07 | 110.2° | 109.5° |
| C10 | C06 | C05 | 108.2° | 109.5° |
| C06 | C10 | H101 | 110.2° | 109.5° |
| C06 | C10 | H102 | 110.2° | 109.5° |
| C10 | C06 | H061 | 107.1° | 109.5° |
| C06 | N07 | C08 | 120.4° | 120.0° |
| N07 | C06 | C05 | 115.7° | 109.4° |
| N07 | C06 | H061 | 108.2° | 109.5° |
| C06 | N07 | H071 | 119.8° | 120.0° |
| N07 | C08 | C35 | 117.8° | 120.0° |
| N07 | C08 | O11 | 122.1° | 120.1° |
| C08 | N07 | H071 | 119.8° | 120.0° |
| C35 | C08 | O11 | 120.1° | 120.0° |
| C08 | C35 | H351 | 110.0° | 109.5° |
| C08 | C35 | H352 | 110.0° | 109.5° |
| C06 | C05 | C03 | 111.8° | 109.5° |
| C06 | C05 | H051 | 107.1° | 109.5° |
| C05 | C06 | H061 | 107.2° | 109.4° |
| C16 | C17 | H171 | 120.3° | 120.0° |
| C17 | C16 | H161 | 119.9° | 119.9° |
| C05 | C03 | C02 | 111.6° | 109.5° |
| C05 | C03 | H032 | 108.9° | 109.5° |
| C05 | C03 | H031 | 108.9° | 109.5° |
| C03 | C05 | H051 | 107.2° | 109.4° |
| C03 | C02 | N01 | 108.8° | 109.4° |
| C03 | C02 | C04 | 106.3° | 109.5° |
| C03 | C02 | H021 | 108.4° | 109.4° |
| C02 | C03 | H032 | 108.9° | 109.5° |
| C02 | C03 | H031 | 108.9° | 109.4° |
| N01 | C02 | C04 | 115.0° | 109.5° |
| C02 | N01 | C18 | 122.6° | 120.0° |
| N01 | C02 | H021 | 109.5° | 109.5° |
| C02 | N01 | H011 | 118.7° | 120.0° |
| C02 | C04 | C22 | 108.7° | 109.5° |
| C04 | C02 | H021 | 108.5° | 109.5° |
| C02 | C04 | H042 | 109.7° | 109.5° |
| C02 | C04 | H041 | 109.7° | 109.5° |
| N01 | C18 | O20 | 117.1° | 120.0° |
| N01 | C18 | O19 | 123.3° | 120.0° |
| C18 | N01 | H011 | 118.7° | 120.0° |
| C04 | C22 | C27 | 119.7° | 120.0° |
| C04 | C22 | C23 | 119.9° | 120.0° |
| C22 | C04 | H042 | 109.7° | 109.5° |
| C22 | C04 | H041 | 109.6° | 109.5° |
| O20 | C18 | O19 | 119.5° | 120.0° |
| C18 | O20 | C21 | 115.4° | 117.0° |
| O20 | C21 | C28 | 108.7° | 110.6° |
| O20 | C21 | C31 | 105.9° | 110.5° |
| O20 | C21 | H211 | 110.6° | 110.5° |
| C21 | C28 | O29 | 102.8° | 104.8° |
| C28 | C21 | C31 | 107.3° | 104.1° |
| C28 | C21 | H211 | 115.3° | 110.5° |
| C21 | C28 | H281 | 111.1° | 110.4° |
| C21 | C28 | H282 | 111.1° | 110.4° |
| C28 | O29 | C30 | 105.0° | 106.0° |
| O29 | C28 | H281 | 111.1° | 110.4° |
| O29 | C28 | H282 | 111.1° | 110.4° |
| C27 | C22 | C23 | 120.4° | 120.0° |
| C22 | C27 | C26 | 119.3° | 120.0° |
| C22 | C27 | H271 | 120.4° | 120.0° |
| C22 | C23 | C24 | 120.6° | 120.0° |
| C22 | C23 | H231 | 119.7° | 120.0° |
| C21 | C31 | C30 | 106.6° | 104.4° |
| C21 | C31 | C34 | 112.5° | 109.1° |
| C31 | C21 | H211 | 108.7° | 110.5° |
| C21 | C31 | H311 | 108.2° | 113.0° |
| O29 | C30 | O32 | 105.5° | 109.1° |
| O29 | C30 | C31 | 108.4° | 104.9° |
| O29 | C30 | H301 | 108.7° | 111.8° |
| C27 | C26 | C25 | 120.6° | 120.0° |
| C27 | C26 | H261 | 119.7° | 120.0° |
| C26 | C27 | H271 | 120.3° | 120.0° |
| C23 | C24 | C25 | 119.5° | 120.0° |
| C23 | C24 | H241 | 120.3° | 120.0° |
| C24 | C23 | H231 | 119.7° | 120.0° |
| C30 | O32 | C33 | 106.4° | 110.2° |
| O32 | C30 | C31 | 111.7° | 107.1° |
| O32 | C30 | H301 | 107.6° | 111.8° |
| O32 | C33 | C34 | 106.9° | 105.5° |
| O32 | C33 | H331 | 110.1° | 110.8° |
| O32 | C33 | H332 | 110.1° | 109.6° |
| C30 | C31 | C34 | 105.4° | 102.3° |
| C31 | C30 | H301 | 114.5° | 111.8° |
| C30 | C31 | H311 | 115.6° | 113.3° |
| C33 | C34 | C31 | 106.4° | 101.0° |
| C34 | C33 | H331 | 110.1° | 110.3° |
| C34 | C33 | H332 | 110.1° | 110.3° |
| C33 | C34 | H341 | 110.2° | 111.1° |
| C33 | C34 | H342 | 110.2° | 111.1° |
| C34 | C31 | H311 | 108.7° | 113.8° |
| C31 | C34 | H341 | 110.2° | 111.1° |
| C31 | C34 | H342 | 110.2° | 111.2° |
| C26 | C25 | C24 | 119.7° | 120.0° |
| C25 | C26 | H261 | 119.7° | 120.0° |
| C26 | C25 | H251 | 120.2° | 120.0° |
| C25 | C24 | H241 | 120.3° | 120.0° |
| C24 | C25 | H251 | 120.1° | 120.0° |
| H101 | C10 | H102 | 109.5° | 109.5° |
| H281 | C28 | H282 | 109.5° | 110.4° |
| H032 | C03 | H031 | 109.5° | 109.4° |
| H042 | C04 | H041 | 109.4° | 109.4° |
| H331 | C33 | H332 | 109.4° | 110.3° |
| H341 | C34 | H342 | 109.5° | 111.0° |
| H351 | C35 | H352 | 109.5° | 109.5° |
| H432 | C43 | H433 | 109.4° | 109.5° |
| H432 | C43 | H431 | 109.5° | 109.5° |
| H433 | C43 | H431 | 109.5° | 109.5° |
| H442 | C44 | H443 | 109.5° | 109.5° |
| H442 | C44 | H441 | 109.5° | 109.4° |
| H443 | C44 | H441 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C37 | C42 | C41 | H421 | 180.0° | 179.5° |
| C42 | C37 | C38 | H371 | 180.0° | 179.7° |
| C37 | C42 | C41 | C44 | 180.0° | 179.7° |
| C37 | C42 | C41 | C40 | 0.7° | 0.5° |
| C42 | C37 | C38 | C39 | 0.1° | 0.3° |
| C42 | C37 | C38 | H381 | 179.9° | 179.8° |
| C41 | C42 | C37 | C38 | 0.2° | 0.6° |
| C42 | C41 | C44 | C40 | 179.3° | 179.8° |
| C42 | C41 | C40 | C39 | 1.2° | 0.3° |
| C42 | C41 | C40 | O36 | 180.0° | 179.8° |
| C41 | C42 | C37 | H371 | 179.8° | 179.7° |
| C42 | C41 | C44 | H442 | 89.6° | 89.8° |
| C42 | C41 | C44 | H443 | 150.4° | 30.2° |
| C42 | C41 | C44 | H441 | 30.4° | 150.3° |
| C37 | C38 | C39 | H381 | 180.0° | 179.9° |
| C37 | C38 | C39 | C40 | 0.6° | 0.0° |
| C37 | C38 | C39 | C43 | 179.9° | 180.0° |
| C38 | C37 | C42 | H421 | 179.8° | 180.0° |
| C44 | C41 | C40 | C39 | 179.5° | 180.0° |
| C44 | C41 | C40 | O36 | 0.7° | 0.0° |
| C44 | C41 | C42 | H421 | 0.0° | 0.2° |
| C41 | C44 | H442 | H443 | 120.0° | 120.0° |
| C41 | C44 | H442 | H441 | 120.0° | 119.9° |
| C41 | C44 | H443 | H441 | 120.0° | 120.0° |
| C41 | C40 | C39 | C38 | 1.2° | 0.0° |
| C41 | C40 | C39 | O36 | 178.7° | 180.0° |
| C41 | C40 | C39 | C43 | 179.5° | 180.0° |
| C41 | C40 | O36 | C35 | 95.5° | 90.0° |
| C40 | C41 | C42 | H421 | 179.3° | 180.0° |
| C40 | C41 | C44 | H442 | 89.7° | 90.0° |
| C40 | C41 | C44 | H443 | 30.3° | 150.0° |
| C40 | C41 | C44 | H441 | 150.3° | 29.9° |
| C38 | C39 | C40 | C43 | 179.4° | 180.0° |
| C38 | C39 | C40 | O36 | 179.9° | 180.0° |
| C39 | C38 | C37 | H371 | 179.9° | 180.0° |
| C38 | C39 | C43 | H432 | 90.3° | 90.0° |
| C38 | C39 | C43 | H433 | 149.7° | 150.0° |
| C38 | C39 | C43 | H431 | 29.7° | 30.0° |
| C13 | C14 | C15 | H141 | 180.0° | 179.9° |
| C14 | C13 | C12 | H131 | 180.0° | 179.6° |
| C13 | C14 | C15 | C16 | 0.9° | 0.0° |
| C14 | C13 | C12 | C10 | 179.1° | 179.7° |
| C14 | C13 | C12 | C17 | 0.4° | 0.4° |
| C13 | C14 | C15 | H151 | 179.1° | 179.8° |
| C15 | C14 | C13 | C12 | 0.6° | 0.1° |
| C14 | C15 | C16 | H151 | 180.0° | 179.7° |
| C14 | C15 | C16 | C17 | 1.0° | 0.2° |
| C15 | C14 | C13 | H131 | 179.4° | 179.7° |
| C14 | C15 | C16 | H161 | 179.0° | 179.7° |
| C39 | C40 | O36 | C35 | 83.2° | 90.0° |
| C40 | C39 | C38 | H381 | 179.4° | 180.0° |
| C40 | C39 | C43 | H432 | 90.3° | 90.0° |
| C40 | C39 | C43 | H433 | 29.7° | 30.0° |
| C40 | C39 | C43 | H431 | 149.7° | 150.0° |
| O36 | C40 | C39 | C43 | 0.7° | 0.0° |
| C40 | O36 | C35 | C08 | 169.0° | 180.0° |
| C40 | O36 | C35 | H351 | 71.3° | 60.0° |
| C40 | O36 | C35 | H352 | 49.3° | 60.0° |
| C13 | C12 | C10 | C17 | 178.7° | 179.9° |
| C13 | C12 | C10 | C06 | 108.7° | 90.1° |
| C13 | C12 | C17 | C16 | 0.5° | 0.6° |
| C13 | C12 | C10 | H101 | 131.7° | 30.0° |
| C13 | C12 | C10 | H102 | 10.8° | 150.0° |
| C13 | C12 | C17 | H171 | 179.5° | 179.9° |
| C12 | C13 | C14 | H141 | 179.4° | 180.0° |
| C43 | C39 | C38 | H381 | 0.1° | 0.0° |
| C39 | C43 | H432 | H433 | 120.0° | 120.0° |
| C39 | C43 | H432 | H431 | 120.0° | 120.0° |
| C39 | C43 | H433 | H431 | 120.0° | 120.0° |
| O36 | C35 | C08 | N07 | 11.8° | 180.0° |
| O36 | C35 | C08 | H351 | 119.7° | 120.0° |
| O36 | C35 | C08 | H352 | 119.6° | 120.0° |
| O36 | C35 | C08 | O11 | 167.0° | 0.0° |
| O36 | C35 | H351 | H352 | 121.0° | 120.0° |
| C15 | C16 | C17 | C12 | 0.8° | 0.5° |
| C15 | C16 | C17 | H161 | 180.0° | 179.9° |
| C15 | C16 | C17 | H171 | 179.2° | 180.0° |
| C16 | C15 | C14 | H141 | 179.1° | 180.0° |
| O09 | C05 | C06 | C10 | 49.8° | 60.0° |
| O09 | C05 | C06 | N07 | 74.3° | 60.0° |
| O09 | C05 | C06 | C03 | 123.4° | 120.0° |
| O09 | C05 | C06 | H051 | 119.5° | 120.0° |
| O09 | C05 | C03 | H051 | 117.6° | 120.0° |
| O09 | C05 | C03 | C02 | 149.1° | 64.9° |
| O09 | C05 | C03 | H032 | 28.8° | 175.0° |
| O09 | C05 | C03 | H031 | 90.5° | 55.1° |
| O09 | C05 | C06 | H061 | 165.0° | 180.0° |
| C12 | C10 | C06 | H101 | 119.6° | 120.0° |
| C12 | C10 | C06 | H102 | 119.5° | 120.0° |
| C12 | C10 | C06 | N07 | 54.9° | 65.0° |
| C12 | C10 | C06 | C05 | 177.7° | 175.0° |
| C10 | C12 | C17 | C16 | 179.2° | 179.5° |
| C12 | C10 | H101 | H102 | 121.3° | 120.0° |
| C10 | C12 | C13 | H131 | 0.9° | 0.1° |
| C10 | C12 | C17 | H171 | 0.8° | 0.0° |
| C12 | C10 | C06 | H061 | 62.5° | 55.0° |
| C17 | C12 | C10 | C06 | 70.0° | 90.0° |
| C12 | C17 | C16 | H171 | 180.0° | 179.5° |
| C17 | C12 | C10 | H101 | 49.6° | 150.0° |
| C17 | C12 | C10 | H102 | 170.5° | 30.0° |
| C17 | C12 | C13 | H131 | 179.6° | 180.0° |
| C12 | C17 | C16 | H161 | 179.2° | 179.4° |
| C10 | C06 | N07 | C05 | 123.1° | 120.0° |
| C10 | C06 | N07 | H061 | 116.7° | 120.1° |
| C10 | C06 | N07 | C08 | 130.9° | 85.0° |
| C10 | C06 | C05 | H061 | 115.1° | 120.0° |
| C10 | C06 | C05 | C03 | 173.2° | 180.0° |
| C06 | C10 | H101 | H102 | 121.3° | 120.0° |
| C10 | C06 | C05 | H051 | 69.7° | 60.0° |
| C10 | C06 | N07 | H071 | 49.1° | 95.0° |
| C06 | N07 | C08 | H071 | 180.0° | 179.9° |
| C06 | N07 | C08 | C35 | 179.9° | 180.0° |
| N07 | C06 | C05 | H061 | 120.7° | 120.0° |
| N07 | C06 | C05 | C03 | 49.1° | 60.0° |
| C06 | N07 | C08 | O11 | 1.3° | 0.0° |
| N07 | C06 | C10 | H101 | 174.5° | 55.0° |
| N07 | C06 | C10 | H102 | 64.6° | 175.0° |
| N07 | C06 | C05 | H051 | 166.2° | 180.0° |
| N07 | C08 | C35 | O11 | 178.8° | 180.0° |
| C08 | N07 | C06 | C05 | 106.0° | 155.0° |
| C08 | N07 | C06 | H061 | 14.2° | 35.1° |
| N07 | C08 | C35 | H351 | 131.4° | 60.0° |
| N07 | C08 | C35 | H352 | 107.9° | 60.0° |
| C08 | C35 | H351 | H352 | 121.0° | 120.0° |
| C35 | C08 | N07 | H071 | 0.1° | 0.0° |
| C06 | C05 | C03 | H051 | 117.1° | 120.0° |
| C06 | C05 | C03 | C02 | 85.6° | 175.0° |
| C05 | C06 | C10 | H101 | 58.2° | 65.0° |
| C05 | C06 | C10 | H102 | 62.8° | 55.0° |
| C06 | C05 | C03 | H032 | 154.0° | 54.9° |
| C06 | C05 | C03 | H031 | 34.7° | 65.0° |
| C05 | C06 | N07 | H071 | 74.0° | 25.1° |
| C06 | C05 | O09 | H091 | 180.0° | 60.0° |
| C17 | C16 | C15 | H151 | 179.0° | 180.0° |
| C05 | C03 | C02 | H032 | 120.3° | 120.0° |
| C05 | C03 | C02 | H031 | 120.3° | 120.0° |
| C05 | C03 | C02 | N01 | 48.8° | 64.9° |
| C05 | C03 | C02 | C04 | 173.2° | 175.0° |
| C05 | C03 | C02 | H021 | 70.2° | 55.0° |
| C05 | C03 | H032 | H031 | 119.0° | 120.0° |
| C03 | C05 | C06 | H061 | 71.7° | 60.0° |
| C03 | C05 | O09 | H091 | 55.2° | 60.1° |
| O11 | C08 | C35 | H351 | 47.4° | 120.0° |
| O11 | C08 | C35 | H352 | 73.3° | 120.0° |
| O11 | C08 | N07 | H071 | 178.7° | 180.0° |
| C03 | C02 | N01 | C04 | 119.1° | 120.1° |
| C03 | C02 | N01 | H021 | 118.4° | 119.9° |
| C03 | C02 | C04 | H021 | 116.5° | 119.9° |
| C03 | C02 | N01 | C18 | 124.5° | 155.0° |
| C03 | C02 | C04 | C22 | 169.7° | 175.0° |
| C02 | C03 | H032 | H031 | 119.0° | 120.0° |
| C03 | C02 | C04 | H042 | 49.8° | 54.9° |
| C03 | C02 | C04 | H041 | 70.4° | 65.0° |
| C02 | C03 | C05 | H051 | 31.5° | 55.0° |
| C03 | C02 | N01 | H011 | 55.5° | 25.1° |
| N01 | C02 | C04 | H021 | 123.1° | 120.0° |
| C02 | N01 | C18 | H011 | 180.0° | 179.9° |
| N01 | C02 | C04 | C22 | 49.2° | 65.0° |
| C02 | N01 | C18 | O20 | 174.9° | 180.0° |
| C02 | N01 | C18 | O19 | 7.2° | 0.1° |
| N01 | C02 | C03 | H032 | 71.5° | 175.0° |
| N01 | C02 | C03 | H031 | 169.1° | 55.1° |
| N01 | C02 | C04 | H042 | 70.7° | 175.0° |
| N01 | C02 | C04 | H041 | 169.1° | 55.0° |
| C04 | C02 | N01 | C18 | 116.4° | 84.9° |
| C02 | C04 | C22 | H042 | 119.9° | 120.0° |
| C02 | C04 | C22 | H041 | 119.9° | 120.0° |
| C02 | C04 | C22 | C27 | 105.6° | 90.0° |
| C02 | C04 | C22 | C23 | 74.8° | 89.7° |
| C04 | C02 | C03 | H032 | 52.9° | 55.0° |
| C04 | C02 | C03 | H031 | 66.4° | 65.0° |
| C02 | C04 | H042 | H041 | 120.4° | 120.0° |
| C04 | C02 | N01 | H011 | 63.6° | 95.0° |
| N01 | C18 | O20 | O19 | 178.1° | 180.0° |
| N01 | C18 | O20 | C21 | 170.3° | 180.0° |
| C18 | N01 | C02 | H021 | 6.1° | 35.1° |
| C04 | C22 | C27 | C23 | 179.6° | 179.7° |
| C04 | C22 | C27 | C26 | 180.0° | 179.7° |
| C04 | C22 | C23 | C24 | 179.8° | 179.7° |
| C22 | C04 | C02 | H021 | 73.8° | 55.1° |
| C22 | C04 | H042 | H041 | 120.3° | 120.0° |
| C04 | C22 | C23 | H231 | 0.1° | 0.3° |
| C04 | C22 | C27 | H271 | 0.0° | 0.3° |
| C18 | O20 | C21 | C28 | 141.4° | 95.3° |
| C18 | O20 | C21 | C31 | 103.6° | 150.0° |
| C18 | O20 | C21 | H211 | 14.0° | 27.4° |
| O20 | C18 | N01 | H011 | 5.1° | 0.1° |
| O19 | C18 | O20 | C21 | 7.7° | 0.0° |
| O19 | C18 | N01 | H011 | 172.9° | 180.0° |
| O20 | C21 | C28 | C31 | 114.0° | 118.7° |
| O20 | C21 | C28 | H211 | 124.7° | 122.7° |
| O20 | C21 | C28 | O29 | 83.1° | 93.1° |
| O20 | C21 | C31 | H211 | 118.8° | 122.6° |
| O20 | C21 | C31 | C30 | 87.0° | 115.7° |
| O20 | C21 | C31 | C34 | 28.0° | 7.0° |
| O20 | C21 | C28 | H281 | 158.0° | 148.0° |
| O20 | C21 | C28 | H282 | 35.8° | 25.7° |
| O20 | C21 | C31 | H311 | 148.1° | 120.6° |
| C21 | C28 | O29 | H281 | 118.9° | 118.9° |
| C21 | C28 | O29 | H282 | 118.9° | 118.8° |
| C28 | C21 | C31 | H211 | 125.3° | 118.6° |
| C21 | C28 | O29 | C30 | 26.2° | 40.1° |
| C28 | C21 | C31 | C30 | 28.9° | 3.0° |
| C28 | C21 | C31 | C34 | 144.0° | 111.7° |
| C21 | C28 | H281 | H282 | 123.1° | 122.3° |
| C28 | C21 | C31 | H311 | 96.0° | 120.6° |
| O29 | C28 | C21 | C31 | 30.9° | 25.6° |
| C28 | O29 | C30 | O32 | 127.4° | 152.4° |
| C28 | O29 | C30 | C31 | 7.6° | 37.9° |
| O29 | C28 | C21 | H211 | 152.2° | 144.2° |
| O29 | C28 | H281 | H282 | 123.1° | 122.3° |
| C28 | O29 | C30 | H301 | 117.4° | 83.5° |
| C22 | C27 | C26 | H271 | 180.0° | 180.0° |
| C27 | C22 | C23 | C24 | 0.2° | 0.1° |
| C22 | C27 | C26 | C25 | 0.0° | 0.1° |
| C22 | C27 | C26 | H261 | 180.0° | 179.9° |
| C27 | C22 | C04 | H042 | 14.3° | 150.0° |
| C27 | C22 | C04 | H041 | 134.5° | 30.1° |
| C27 | C22 | C23 | H231 | 179.7° | 180.0° |
| C23 | C22 | C27 | C26 | 0.4° | 0.1° |
| C22 | C23 | C24 | H231 | 180.0° | 179.9° |
| C22 | C23 | C24 | C25 | 0.3° | 0.1° |
| C22 | C23 | C24 | H241 | 179.6° | 179.9° |
| C23 | C22 | C04 | H042 | 165.3° | 30.3° |
| C23 | C22 | C04 | H041 | 45.1° | 150.3° |
| C23 | C22 | C27 | H271 | 179.6° | 179.9° |
| C21 | C31 | C30 | O29 | 9.6° | 20.5° |
| C21 | C31 | C30 | O32 | 106.2° | 136.3° |
| C21 | C31 | C30 | C34 | 119.7° | 113.6° |
| C21 | C31 | C30 | H311 | 120.3° | 123.4° |
| C21 | C31 | C34 | C33 | 111.0° | 144.7° |
| C21 | C31 | C34 | H311 | 119.8° | 127.2° |
| C31 | C21 | C28 | H281 | 88.0° | 93.3° |
| C31 | C21 | C28 | H282 | 149.9° | 144.4° |
| C21 | C31 | C30 | H301 | 131.1° | 100.9° |
| C21 | C31 | C34 | H341 | 129.5° | 26.8° |
| C21 | C31 | C34 | H342 | 8.5° | 97.5° |
| O29 | C30 | O32 | C31 | 117.5° | 113.1° |
| O29 | C30 | O32 | H301 | 116.0° | 124.1° |
| O29 | C30 | O32 | C33 | 137.4° | 113.0° |
| O29 | C30 | C31 | H301 | 121.5° | 121.4° |
| O29 | C30 | C31 | C34 | 129.3° | 93.2° |
| C30 | O29 | C28 | H281 | 92.7° | 78.8° |
| C30 | O29 | C28 | H282 | 145.1° | 158.9° |
| O29 | C30 | C31 | H311 | 110.7° | 143.9° |
| C27 | C26 | C25 | H261 | 180.0° | 179.8° |
| C27 | C26 | C25 | C24 | 0.6° | 0.1° |
| C27 | C26 | C25 | H251 | 179.4° | 179.9° |
| C23 | C24 | C25 | C26 | 0.7° | 0.1° |
| C23 | C24 | C25 | H241 | 180.0° | 179.8° |
| C23 | C24 | C25 | H251 | 179.2° | 179.9° |
| O32 | C30 | C31 | H301 | 122.7° | 122.8° |
| C30 | O32 | C33 | C34 | 14.7° | 22.9° |
| O32 | C30 | C31 | C34 | 13.5° | 22.7° |
| O32 | C30 | C31 | H311 | 133.5° | 100.3° |
| C30 | O32 | C33 | H331 | 104.9° | 142.2° |
| C30 | O32 | C33 | H332 | 134.3° | 95.9° |
| C33 | O32 | C30 | C31 | 19.9° | 0.1° |
| O32 | C33 | C34 | H331 | 119.6° | 119.7° |
| O32 | C33 | C34 | H332 | 119.6° | 118.3° |
| O32 | C33 | C34 | C31 | 8.0° | 35.9° |
| C33 | O32 | C30 | H301 | 106.6° | 122.9° |
| O32 | C33 | H331 | H332 | 121.2° | 121.5° |
| O32 | C33 | C34 | H341 | 127.5° | 82.1° |
| O32 | C33 | C34 | H342 | 111.5° | 153.8° |
| C30 | C31 | C34 | C33 | 4.8° | 34.5° |
| C30 | C31 | C34 | H311 | 124.5° | 122.6° |
| C30 | C31 | C21 | H211 | 154.2° | 121.6° |
| C30 | C31 | C34 | H341 | 114.7° | 83.4° |
| C30 | C31 | C34 | H342 | 124.3° | 152.4° |
| C33 | C34 | C31 | H341 | 119.5° | 117.9° |
| C33 | C34 | C31 | H342 | 119.5° | 117.9° |
| C33 | C34 | C31 | H311 | 129.2° | 88.1° |
| C34 | C33 | H331 | H332 | 121.2° | 122.1° |
| C33 | C34 | H341 | H342 | 121.4° | 124.1° |
| C34 | C31 | C21 | H211 | 90.8° | 129.7° |
| C34 | C31 | C30 | H301 | 109.2° | 145.5° |
| C31 | C34 | C33 | H331 | 111.6° | 155.5° |
| C31 | C34 | C33 | H332 | 127.6° | 82.4° |
| C31 | C34 | H341 | H342 | 121.4° | 124.3° |
| C26 | C25 | C24 | H251 | 180.0° | 180.0° |
| C26 | C25 | C24 | H241 | 179.2° | 180.0° |
| C25 | C26 | C27 | H271 | 180.0° | 179.9° |
| C24 | C25 | C26 | H261 | 179.4° | 180.0° |
| C25 | C24 | C23 | H231 | 179.7° | 180.0° |
| H101 | C10 | C06 | H061 | 57.1° | 175.0° |
| H102 | C10 | C06 | H061 | 178.0° | 65.0° |
| H131 | C13 | C14 | H141 | 0.6° | 0.3° |
| H151 | C15 | C14 | H141 | 0.9° | 0.3° |
| H151 | C15 | C16 | H161 | 1.0° | 0.1° |
| H171 | C17 | C16 | H161 | 0.8° | 0.1° |
| H211 | C21 | C28 | H281 | 33.3° | 25.4° |
| H211 | C21 | C28 | H282 | 88.9° | 96.9° |
| H211 | C21 | C31 | H311 | 29.3° | 2.0° |
| H241 | C24 | C23 | H231 | 0.3° | 0.1° |
| H241 | C24 | C25 | H251 | 0.8° | 0.1° |
| H261 | C26 | C25 | H251 | 0.6° | 0.1° |
| H261 | C26 | C27 | H271 | 0.0° | 0.1° |
| H021 | C02 | C03 | H032 | 169.5° | 65.0° |
| H021 | C02 | C03 | H031 | 50.1° | 175.1° |
| H021 | C02 | C04 | H042 | 166.3° | 65.0° |
| H021 | C02 | C04 | H041 | 46.0° | 175.1° |
| H021 | C02 | N01 | H011 | 173.8° | 145.0° |
| H032 | C03 | C05 | H051 | 88.9° | 65.0° |
| H031 | C03 | C05 | H051 | 151.8° | 175.0° |
| H051 | C05 | C06 | H061 | 45.4° | 60.0° |
| H051 | C05 | O09 | H091 | 61.5° | 180.0° |
| H061 | C06 | N07 | H071 | 165.8° | 145.0° |
| H301 | C30 | C31 | H311 | 10.8° | 22.5° |
| H311 | C31 | C34 | H341 | 9.7° | 154.0° |
| H311 | C31 | C34 | H342 | 111.3° | 29.8° |
| H331 | C33 | C34 | H341 | 7.9° | 37.6° |
| H331 | C33 | C34 | H342 | 128.9° | 86.5° |
| H332 | C33 | C34 | H341 | 112.9° | 159.7° |
| H332 | C33 | C34 | H342 | 8.1° | 35.5° |
| H371 | C37 | C38 | H381 | 0.1° | 0.1° |
| H371 | C37 | C42 | H421 | 0.2° | 0.3° |
| H432 | C43 | H433 | H431 | 120.0° | 120.0° |
| H442 | C44 | H443 | H441 | 120.0° | 120.0° |
