ORV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C34 | O32 | sing | 1.45Å | 1.38Å | |
| O33 | C30 | doub | 1.21Å | 1.21Å | |
| C30 | O32 | sing | 1.35Å | 1.40Å | |
| C30 | N29 | sing | 1.35Å | 1.46Å | |
| C14 | C15 | doub | 1.38Å | 1.52Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.52Å | Aromatic |
| O10 | C05 | sing | 1.43Å | 1.39Å | |
| C15 | C16 | sing | 1.38Å | 1.52Å | Aromatic |
| N29 | C09 | sing | 1.47Å | 1.42Å | |
| C11 | C13 | sing | 1.51Å | 1.55Å | |
| C11 | C06 | sing | 1.53Å | 1.50Å | |
| N07 | C06 | sing | 1.46Å | 1.49Å | |
| N07 | C08 | sing | 1.35Å | 1.45Å | |
| C09 | C08 | sing | 1.51Å | 1.55Å | |
| C09 | C31 | sing | 1.53Å | 1.52Å | |
| C13 | C18 | doub | 1.38Å | 1.52Å | Aromatic |
| C05 | C06 | sing | 1.53Å | 1.53Å | |
| C05 | C03 | sing | 1.53Å | 1.51Å | |
| C16 | C17 | doub | 1.38Å | 1.53Å | Aromatic |
| C08 | O12 | doub | 1.21Å | 1.19Å | |
| C03 | C02 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.38Å | 1.52Å | Aromatic |
| C02 | N01 | sing | 1.46Å | 1.42Å | |
| C02 | C04 | sing | 1.53Å | 1.53Å | |
| N01 | C19 | sing | 1.35Å | 1.43Å | |
| C04 | C23 | sing | 1.51Å | 1.54Å | |
| C19 | O21 | sing | 1.35Å | 1.42Å | |
| C19 | O20 | doub | 1.21Å | 1.20Å | |
| O21 | C22 | sing | 1.45Å | 1.43Å | |
| C23 | C24 | doub | 1.38Å | 1.51Å | Aromatic |
| C23 | C28 | sing | 1.38Å | 1.53Å | Aromatic |
| O36 | C35 | sing | 1.44Å | 1.36Å | |
| O36 | C37 | sing | 1.44Å | 1.54Å | |
| C35 | C22 | sing | 1.54Å | 1.66Å | |
| C24 | C25 | sing | 1.38Å | 1.51Å | Aromatic |
| C22 | C38 | sing | 1.54Å | 1.30Å | |
| O39 | C40 | sing | 1.44Å | 1.62Å | |
| O39 | C37 | sing | 1.43Å | 1.29Å | |
| C40 | C41 | sing | 1.55Å | 1.34Å | |
| C28 | C27 | doub | 1.38Å | 1.51Å | Aromatic |
| C37 | C38 | sing | 1.55Å | 1.59Å | |
| C38 | C41 | sing | 1.55Å | 1.51Å | |
| C25 | C26 | doub | 1.38Å | 1.51Å | Aromatic |
| C27 | C26 | sing | 1.38Å | 1.52Å | Aromatic |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C31 | H313 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | 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 | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C37 | H371 | sing | 1.09Å | 1.10Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| C40 | H401 | sing | 1.09Å | 1.10Å | |
| C40 | H402 | sing | 1.09Å | 1.10Å | |
| C41 | H412 | sing | 1.09Å | 1.10Å | |
| C41 | H411 | sing | 1.09Å | 1.10Å | |
| N01 | H011 | sing | 0.97Å | 1.00Å | |
| N07 | H071 | sing | 0.97Å | 1.00Å | |
| N29 | H291 | sing | 0.97Å | 1.00Å | |
| O10 | H101 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C34 | O32 | C30 | 112.5° | 117.0° |
| O32 | C34 | H343 | 109.5° | 109.5° |
| O32 | C34 | H342 | 109.5° | 109.5° |
| O32 | C34 | H341 | 109.5° | 109.5° |
| O33 | C30 | O32 | 122.5° | 120.0° |
| O33 | C30 | N29 | 121.7° | 120.0° |
| O32 | C30 | N29 | 115.8° | 120.0° |
| C30 | N29 | C09 | 122.7° | 120.0° |
| C30 | N29 | H291 | 118.6° | 120.0° |
| C15 | C14 | C13 | 121.1° | 120.0° |
| C14 | C15 | C16 | 118.4° | 120.0° |
| C14 | C15 | H151 | 120.8° | 120.0° |
| C15 | C14 | H141 | 119.4° | 120.0° |
| C14 | C13 | C11 | 119.3° | 120.0° |
| C14 | C13 | C18 | 120.8° | 120.0° |
| C13 | C14 | H141 | 119.5° | 120.0° |
| O10 | C05 | C06 | 106.8° | 109.5° |
| O10 | C05 | C03 | 107.8° | 109.5° |
| O10 | C05 | H051 | 111.7° | 109.5° |
| C05 | O10 | H101 | 109.5° | 114.0° |
| C15 | C16 | C17 | 120.1° | 120.0° |
| C16 | C15 | H151 | 120.8° | 120.0° |
| C15 | C16 | H161 | 119.9° | 120.0° |
| N29 | C09 | C08 | 105.6° | 109.5° |
| N29 | C09 | C31 | 108.5° | 109.4° |
| N29 | C09 | H091 | 111.9° | 109.5° |
| C09 | N29 | H291 | 118.7° | 120.0° |
| C13 | C11 | C06 | 107.1° | 109.5° |
| C11 | C13 | C18 | 119.9° | 120.0° |
| C13 | C11 | H111 | 110.0° | 109.5° |
| C13 | C11 | H112 | 110.0° | 109.5° |
| C11 | C06 | N07 | 107.8° | 109.5° |
| C11 | C06 | C05 | 107.3° | 109.5° |
| C11 | C06 | H061 | 110.7° | 109.5° |
| C06 | C11 | H111 | 110.0° | 109.5° |
| C06 | C11 | H112 | 110.1° | 109.4° |
| C06 | N07 | C08 | 122.0° | 120.0° |
| N07 | C06 | C05 | 109.6° | 109.5° |
| N07 | C06 | H061 | 111.0° | 109.4° |
| C06 | N07 | H071 | 119.0° | 120.0° |
| N07 | C08 | C09 | 116.9° | 120.0° |
| N07 | C08 | O12 | 121.9° | 120.0° |
| C08 | N07 | H071 | 119.1° | 120.0° |
| C08 | C09 | C31 | 110.4° | 109.5° |
| C09 | C08 | O12 | 121.1° | 120.0° |
| C08 | C09 | H091 | 110.0° | 109.5° |
| C31 | C09 | H091 | 110.3° | 109.5° |
| C09 | C31 | H313 | 109.5° | 109.4° |
| C09 | C31 | H312 | 109.4° | 109.4° |
| C09 | C31 | H311 | 109.5° | 109.5° |
| C13 | C18 | C17 | 117.7° | 120.0° |
| C13 | C18 | H181 | 121.1° | 120.0° |
| C06 | C05 | C03 | 111.1° | 109.4° |
| C06 | C05 | H051 | 109.6° | 109.4° |
| C05 | C06 | H061 | 110.4° | 109.5° |
| C05 | C03 | C02 | 112.3° | 109.4° |
| C05 | C03 | H032 | 108.8° | 109.5° |
| C05 | C03 | H031 | 108.8° | 109.5° |
| C03 | C05 | H051 | 109.9° | 109.5° |
| C16 | C17 | C18 | 121.8° | 120.0° |
| C16 | C17 | H171 | 119.1° | 120.0° |
| C17 | C16 | H161 | 119.9° | 120.0° |
| C03 | C02 | N01 | 110.1° | 109.5° |
| C03 | C02 | C04 | 101.3° | 109.5° |
| C03 | C02 | H021 | 110.3° | 109.5° |
| C02 | C03 | H032 | 108.8° | 109.4° |
| C02 | C03 | H031 | 108.8° | 109.5° |
| C18 | C17 | H171 | 119.1° | 120.0° |
| C17 | C18 | H181 | 121.2° | 120.0° |
| N01 | C02 | C04 | 112.3° | 109.4° |
| C02 | N01 | C19 | 119.9° | 120.0° |
| N01 | C02 | H021 | 111.9° | 109.5° |
| C02 | N01 | H011 | 120.0° | 120.1° |
| C02 | C04 | C23 | 111.3° | 109.5° |
| C04 | C02 | H021 | 110.4° | 109.5° |
| C02 | C04 | H041 | 109.0° | 109.5° |
| C02 | C04 | H042 | 109.0° | 109.5° |
| N01 | C19 | O21 | 112.0° | 120.0° |
| N01 | C19 | O20 | 124.5° | 120.0° |
| C19 | N01 | H011 | 120.1° | 119.9° |
| C04 | C23 | C24 | 119.5° | 120.0° |
| C04 | C23 | C28 | 118.8° | 120.0° |
| C23 | C04 | H041 | 109.0° | 109.5° |
| C23 | C04 | H042 | 109.0° | 109.5° |
| O21 | C19 | O20 | 123.5° | 120.0° |
| C19 | O21 | C22 | 119.2° | 117.0° |
| O21 | C22 | C35 | 102.3° | 110.6° |
| O21 | C22 | C38 | 113.3° | 110.5° |
| O21 | C22 | H221 | 111.7° | 110.5° |
| C24 | C23 | C28 | 121.6° | 120.0° |
| C23 | C24 | C25 | 119.1° | 120.1° |
| C23 | C24 | H241 | 120.5° | 120.0° |
| C23 | C28 | C27 | 118.1° | 120.0° |
| C23 | C28 | H281 | 121.0° | 120.0° |
| C35 | O36 | C37 | 107.2° | 106.0° |
| O36 | C35 | C22 | 101.9° | 104.8° |
| O36 | C35 | H351 | 111.3° | 110.4° |
| O36 | C35 | H352 | 111.3° | 110.4° |
| O36 | C37 | O39 | 109.1° | 109.1° |
| O36 | C37 | C38 | 104.1° | 104.9° |
| O36 | C37 | H371 | 110.0° | 111.8° |
| C35 | C22 | C38 | 106.0° | 104.1° |
| C35 | C22 | H221 | 108.6° | 110.5° |
| C22 | C35 | H351 | 111.3° | 110.4° |
| C22 | C35 | H352 | 111.3° | 110.4° |
| C24 | C25 | C26 | 120.3° | 120.0° |
| C25 | C24 | H241 | 120.5° | 119.9° |
| C24 | C25 | H251 | 119.8° | 120.0° |
| C22 | C38 | C37 | 105.7° | 104.4° |
| C22 | C38 | C41 | 116.6° | 109.1° |
| C38 | C22 | H221 | 113.9° | 110.5° |
| C22 | C38 | H381 | 112.8° | 113.0° |
| C40 | O39 | C37 | 106.7° | 110.3° |
| O39 | C40 | C41 | 108.5° | 105.5° |
| O39 | C40 | H401 | 109.7° | 110.8° |
| O39 | C40 | H402 | 109.7° | 109.5° |
| O39 | C37 | C38 | 109.8° | 107.1° |
| O39 | C37 | H371 | 114.2° | 111.7° |
| C40 | C41 | C38 | 107.7° | 101.0° |
| C41 | C40 | H401 | 109.7° | 110.3° |
| C41 | C40 | H402 | 109.7° | 110.4° |
| C40 | C41 | H412 | 109.9° | 111.1° |
| C40 | C41 | H411 | 109.9° | 111.1° |
| C28 | C27 | C26 | 120.8° | 120.0° |
| C27 | C28 | H281 | 121.0° | 120.0° |
| C28 | C27 | H271 | 119.6° | 120.0° |
| C37 | C38 | C41 | 102.6° | 102.2° |
| C38 | C37 | H371 | 109.3° | 111.9° |
| C37 | C38 | H381 | 108.6° | 113.4° |
| C41 | C38 | H381 | 109.7° | 113.8° |
| C38 | C41 | H412 | 109.9° | 111.1° |
| C38 | C41 | H411 | 109.9° | 111.1° |
| C25 | C26 | C27 | 120.1° | 120.0° |
| C25 | C26 | H261 | 120.0° | 120.0° |
| C26 | C25 | H251 | 119.8° | 120.0° |
| C27 | C26 | H261 | 119.9° | 120.0° |
| C26 | C27 | H271 | 119.6° | 120.0° |
| H032 | C03 | H031 | 109.5° | 109.5° |
| H041 | C04 | H042 | 109.5° | 109.5° |
| H111 | C11 | H112 | 109.5° | 109.5° |
| H313 | C31 | H312 | 109.5° | 109.5° |
| H313 | C31 | H311 | 109.5° | 109.5° |
| H312 | C31 | H311 | 109.5° | 109.5° |
| H343 | C34 | H342 | 109.5° | 109.5° |
| H343 | C34 | H341 | 109.5° | 109.5° |
| H342 | C34 | H341 | 109.5° | 109.4° |
| H351 | C35 | H352 | 109.5° | 110.4° |
| H401 | C40 | H402 | 109.5° | 110.3° |
| H412 | C41 | H411 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C34 | O32 | C30 | O33 | 5.7° | 0.0° |
| C34 | O32 | C30 | N29 | 175.1° | 180.0° |
| O32 | C34 | H343 | H342 | 120.0° | 120.1° |
| O32 | C34 | H343 | H341 | 120.0° | 120.0° |
| O32 | C34 | H342 | H341 | 120.0° | 120.0° |
| O33 | C30 | O32 | N29 | 179.2° | 180.0° |
| O33 | C30 | N29 | C09 | 0.7° | 0.0° |
| O33 | C30 | N29 | H291 | 179.3° | 180.0° |
| O32 | C30 | N29 | C09 | 178.5° | 180.0° |
| C30 | O32 | C34 | H343 | 180.0° | 180.0° |
| C30 | O32 | C34 | H342 | 60.0° | 60.0° |
| C30 | O32 | C34 | H341 | 60.0° | 60.0° |
| O32 | C30 | N29 | H291 | 1.5° | 0.1° |
| C30 | N29 | C09 | H291 | 180.0° | 179.9° |
| C30 | N29 | C09 | C08 | 125.5° | 155.0° |
| C30 | N29 | C09 | C31 | 116.1° | 85.0° |
| C30 | N29 | C09 | H091 | 5.9° | 35.0° |
| C15 | C14 | C13 | H141 | 180.0° | 179.9° |
| C14 | C15 | C16 | H151 | 180.0° | 179.8° |
| C15 | C14 | C13 | C11 | 179.3° | 179.7° |
| C15 | C14 | C13 | C18 | 0.3° | 0.0° |
| C14 | C15 | C16 | C17 | 0.2° | 0.2° |
| C14 | C15 | C16 | H161 | 179.8° | 179.7° |
| C13 | C14 | C15 | C16 | 0.3° | 0.0° |
| C14 | C13 | C11 | C18 | 179.6° | 179.7° |
| C14 | C13 | C11 | C06 | 104.6° | 89.7° |
| C14 | C13 | C18 | C17 | 1.1° | 0.2° |
| C13 | C14 | C15 | H151 | 179.7° | 179.7° |
| C14 | C13 | C11 | H111 | 135.8° | 30.3° |
| C14 | C13 | C11 | H112 | 15.0° | 150.3° |
| C14 | C13 | C18 | H181 | 178.9° | 179.7° |
| O10 | C05 | C06 | C11 | 63.0° | 60.0° |
| O10 | C05 | C06 | N07 | 53.8° | 60.0° |
| O10 | C05 | C06 | C03 | 117.2° | 120.0° |
| O10 | C05 | C06 | H051 | 121.1° | 120.0° |
| O10 | C05 | C03 | H051 | 121.9° | 120.1° |
| O10 | C05 | C03 | C02 | 165.6° | 65.0° |
| O10 | C05 | C03 | H032 | 45.2° | 175.0° |
| O10 | C05 | C03 | H031 | 74.0° | 54.9° |
| O10 | C05 | C06 | H061 | 176.3° | 180.0° |
| C15 | C16 | C17 | H161 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 0.6° | 0.5° |
| C15 | C16 | C17 | H171 | 179.4° | 180.0° |
| C16 | C15 | C14 | H141 | 179.7° | 180.0° |
| N29 | C09 | C08 | N07 | 98.9° | 180.0° |
| N29 | C09 | C08 | C31 | 117.1° | 119.9° |
| N29 | C09 | C08 | H091 | 120.9° | 120.0° |
| N29 | C09 | C31 | H091 | 122.9° | 120.0° |
| N29 | C09 | C08 | O12 | 79.4° | 0.0° |
| N29 | C09 | C31 | H313 | 180.0° | 180.0° |
| N29 | C09 | C31 | H312 | 60.0° | 60.0° |
| N29 | C09 | C31 | H311 | 60.0° | 60.0° |
| C13 | C11 | C06 | H111 | 119.6° | 120.0° |
| C13 | C11 | C06 | H112 | 119.6° | 120.0° |
| C13 | C11 | C06 | N07 | 57.8° | 65.0° |
| C13 | C11 | C06 | C05 | 175.7° | 175.0° |
| C11 | C13 | C18 | C17 | 178.5° | 179.9° |
| C13 | C11 | C06 | H061 | 63.7° | 55.0° |
| C13 | C11 | H111 | H112 | 121.1° | 120.0° |
| C11 | C13 | C14 | H141 | 0.7° | 0.3° |
| C11 | C13 | C18 | H181 | 1.5° | 0.0° |
| C11 | C06 | N07 | C05 | 116.4° | 120.0° |
| C11 | C06 | N07 | H061 | 121.4° | 120.0° |
| C11 | C06 | N07 | C08 | 124.9° | 85.0° |
| C06 | C11 | C13 | C18 | 75.0° | 90.0° |
| C11 | C06 | C05 | H061 | 120.7° | 120.0° |
| C11 | C06 | C05 | C03 | 179.8° | 180.0° |
| C11 | C06 | C05 | H051 | 58.1° | 60.0° |
| C06 | C11 | H111 | H112 | 121.1° | 119.9° |
| C11 | C06 | N07 | H071 | 55.1° | 95.0° |
| C06 | N07 | C08 | H071 | 180.0° | 179.9° |
| C06 | N07 | C08 | C09 | 179.7° | 180.0° |
| N07 | C06 | C05 | H061 | 122.5° | 120.0° |
| N07 | C06 | C05 | C03 | 63.5° | 60.0° |
| C06 | N07 | C08 | O12 | 1.4° | 0.0° |
| N07 | C06 | C05 | H051 | 174.9° | 179.9° |
| N07 | C06 | C11 | H111 | 177.4° | 175.0° |
| N07 | C06 | C11 | H112 | 61.8° | 55.0° |
| N07 | C08 | C09 | O12 | 178.4° | 180.0° |
| N07 | C08 | C09 | C31 | 143.9° | 60.0° |
| C08 | N07 | C06 | C05 | 118.7° | 155.0° |
| C08 | N07 | C06 | H061 | 3.5° | 35.0° |
| N07 | C08 | C09 | H091 | 22.0° | 60.0° |
| C08 | C09 | C31 | H091 | 121.8° | 120.0° |
| C08 | C09 | C31 | H313 | 64.7° | 60.1° |
| C08 | C09 | C31 | H312 | 175.3° | 180.0° |
| C08 | C09 | C31 | H311 | 55.3° | 59.9° |
| C09 | C08 | N07 | H071 | 0.3° | 0.0° |
| C08 | C09 | N29 | H291 | 54.5° | 24.9° |
| C31 | C09 | C08 | O12 | 37.7° | 120.0° |
| C09 | C31 | H313 | H312 | 120.0° | 119.9° |
| C09 | C31 | H313 | H311 | 120.0° | 120.0° |
| C09 | C31 | H312 | H311 | 120.0° | 120.0° |
| C31 | C09 | N29 | H291 | 63.9° | 95.0° |
| C13 | C18 | C17 | C16 | 1.2° | 0.5° |
| C13 | C18 | C17 | H181 | 180.0° | 179.9° |
| C13 | C18 | C17 | H171 | 178.8° | 180.0° |
| C18 | C13 | C11 | H111 | 44.6° | 150.0° |
| C18 | C13 | C11 | H112 | 165.3° | 30.0° |
| C18 | C13 | C14 | H141 | 179.7° | 180.0° |
| C06 | C05 | C03 | H051 | 121.5° | 119.9° |
| C06 | C05 | C03 | C02 | 77.8° | 175.0° |
| C06 | C05 | C03 | H032 | 161.8° | 55.0° |
| C06 | C05 | C03 | H031 | 42.6° | 65.0° |
| C05 | C06 | C11 | H111 | 64.7° | 55.0° |
| C05 | C06 | C11 | H112 | 56.1° | 65.0° |
| C05 | C06 | N07 | H071 | 61.3° | 25.0° |
| C06 | C05 | O10 | H101 | 180.0° | 60.0° |
| C05 | C03 | C02 | H032 | 120.4° | 120.0° |
| C05 | C03 | C02 | H031 | 120.4° | 120.0° |
| C05 | C03 | C02 | N01 | 48.9° | 65.0° |
| C05 | C03 | C02 | C04 | 167.9° | 175.0° |
| C05 | C03 | C02 | H021 | 75.2° | 55.0° |
| C05 | C03 | H032 | H031 | 118.7° | 120.1° |
| C03 | C05 | C06 | H061 | 59.1° | 60.0° |
| C03 | C05 | O10 | H101 | 60.6° | 59.9° |
| C16 | C17 | C18 | H171 | 180.0° | 179.5° |
| C17 | C16 | C15 | H151 | 179.8° | 180.0° |
| C16 | C17 | C18 | H181 | 178.8° | 179.4° |
| O12 | C08 | C09 | H091 | 159.7° | 119.9° |
| O12 | C08 | N07 | H071 | 178.6° | 179.9° |
| C03 | C02 | N01 | C04 | 112.1° | 119.9° |
| C03 | C02 | N01 | H021 | 123.1° | 120.1° |
| C03 | C02 | C04 | H021 | 116.9° | 120.1° |
| C03 | C02 | N01 | C19 | 124.7° | 155.0° |
| C03 | C02 | C04 | C23 | 173.6° | 175.0° |
| C02 | C03 | H032 | H031 | 118.7° | 120.0° |
| C03 | C02 | C04 | H041 | 53.3° | 64.9° |
| C03 | C02 | C04 | H042 | 66.2° | 55.0° |
| C02 | C03 | C05 | H051 | 43.7° | 55.0° |
| C03 | C02 | N01 | H011 | 55.3° | 24.9° |
| C18 | C17 | C16 | H161 | 179.4° | 179.5° |
| N01 | C02 | C04 | H021 | 125.7° | 120.0° |
| C02 | N01 | C19 | H011 | 180.0° | 179.9° |
| N01 | C02 | C04 | C23 | 56.1° | 65.0° |
| C02 | N01 | C19 | O21 | 172.6° | 180.0° |
| C02 | N01 | C19 | O20 | 5.9° | 0.1° |
| N01 | C02 | C03 | H032 | 71.5° | 175.0° |
| N01 | C02 | C03 | H031 | 169.3° | 54.9° |
| N01 | C02 | C04 | H041 | 64.2° | 55.0° |
| N01 | C02 | C04 | H042 | 176.4° | 175.0° |
| C04 | C02 | N01 | C19 | 123.2° | 85.1° |
| C02 | C04 | C23 | H041 | 120.3° | 120.0° |
| C02 | C04 | C23 | H042 | 120.3° | 120.0° |
| C02 | C04 | C23 | C24 | 106.9° | 90.0° |
| C02 | C04 | C23 | C28 | 74.2° | 90.0° |
| C04 | C02 | C03 | H032 | 47.5° | 55.1° |
| C04 | C02 | C03 | H031 | 71.7° | 65.0° |
| C02 | C04 | H041 | H042 | 119.2° | 120.0° |
| C04 | C02 | N01 | H011 | 56.8° | 95.1° |
| N01 | C19 | O21 | O20 | 178.5° | 179.9° |
| N01 | C19 | O21 | C22 | 160.0° | 179.9° |
| C19 | N01 | C02 | H021 | 1.6° | 34.9° |
| C04 | C23 | C24 | C28 | 178.9° | 180.0° |
| C04 | C23 | C24 | C25 | 179.8° | 180.0° |
| C04 | C23 | C28 | C27 | 179.5° | 179.4° |
| C04 | C23 | C24 | H241 | 0.2° | 0.3° |
| C04 | C23 | C28 | H281 | 0.5° | 0.3° |
| C23 | C04 | C02 | H021 | 69.6° | 55.0° |
| C23 | C04 | H041 | H042 | 119.2° | 120.0° |
| C19 | O21 | C22 | C35 | 139.1° | 95.2° |
| C19 | O21 | C22 | C38 | 107.2° | 150.0° |
| C19 | O21 | C22 | H221 | 23.1° | 27.4° |
| O21 | C19 | N01 | H011 | 7.4° | 0.1° |
| O20 | C19 | O21 | C22 | 18.5° | 0.0° |
| O20 | C19 | N01 | H011 | 174.1° | 180.0° |
| O21 | C22 | C35 | O36 | 77.9° | 93.1° |
| O21 | C22 | C35 | C38 | 119.0° | 118.7° |
| O21 | C22 | C35 | H221 | 118.3° | 122.6° |
| O21 | C22 | C38 | H221 | 129.2° | 122.6° |
| O21 | C22 | C38 | C37 | 81.3° | 115.8° |
| O21 | C22 | C38 | C41 | 32.0° | 7.1° |
| O21 | C22 | C35 | H351 | 40.9° | 148.0° |
| O21 | C22 | C35 | H352 | 163.4° | 25.8° |
| O21 | C22 | C38 | H381 | 160.2° | 120.6° |
| C23 | C24 | C25 | H241 | 180.0° | 179.7° |
| C24 | C23 | C28 | C27 | 1.6° | 0.5° |
| C23 | C24 | C25 | C26 | 0.4° | 0.3° |
| C24 | C23 | C28 | H281 | 178.4° | 179.7° |
| C24 | C23 | C04 | H041 | 13.4° | 30.0° |
| C24 | C23 | C04 | H042 | 132.9° | 150.0° |
| C23 | C24 | C25 | H251 | 179.6° | 179.7° |
| C28 | C23 | C24 | C25 | 1.3° | 0.0° |
| C23 | C28 | C27 | H281 | 180.0° | 179.2° |
| C23 | C28 | C27 | C26 | 1.0° | 0.8° |
| C28 | C23 | C24 | H241 | 178.7° | 179.7° |
| C28 | C23 | C04 | H041 | 165.5° | 150.0° |
| C28 | C23 | C04 | H042 | 46.1° | 30.0° |
| C23 | C28 | C27 | H271 | 179.0° | 179.2° |
| O36 | C35 | C22 | H351 | 118.8° | 118.8° |
| O36 | C35 | C22 | H352 | 118.8° | 118.9° |
| O36 | C35 | C22 | C38 | 41.1° | 25.6° |
| C35 | O36 | C37 | O39 | 132.3° | 152.4° |
| C35 | O36 | C37 | C38 | 15.2° | 38.0° |
| O36 | C35 | C22 | H221 | 163.9° | 144.3° |
| O36 | C35 | H351 | H352 | 123.5° | 122.3° |
| C35 | O36 | C37 | H371 | 101.7° | 83.5° |
| C37 | O36 | C35 | C22 | 30.9° | 40.1° |
| O36 | C37 | C38 | C22 | 12.3° | 20.5° |
| O36 | C37 | O39 | C40 | 121.4° | 112.9° |
| O36 | C37 | O39 | C38 | 113.4° | 113.0° |
| O36 | C37 | O39 | H371 | 123.5° | 124.2° |
| O36 | C37 | C38 | H371 | 117.4° | 121.4° |
| O36 | C37 | C38 | C41 | 134.9° | 93.2° |
| C37 | O36 | C35 | H351 | 149.7° | 78.8° |
| C37 | O36 | C35 | H352 | 87.8° | 159.0° |
| O36 | C37 | C38 | H381 | 109.1° | 143.9° |
| C35 | C22 | C38 | H221 | 119.4° | 118.7° |
| C35 | C22 | C38 | C37 | 30.2° | 3.0° |
| C35 | C22 | C38 | C41 | 143.4° | 111.7° |
| C22 | C35 | H351 | H352 | 123.5° | 122.3° |
| C35 | C22 | C38 | H381 | 88.3° | 120.7° |
| C24 | C25 | C26 | H251 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.2° | 0.0° |
| C24 | C25 | C26 | H261 | 179.7° | 180.0° |
| C22 | C38 | C37 | O39 | 104.3° | 136.3° |
| C22 | C38 | C41 | C40 | 93.1° | 144.7° |
| C22 | C38 | C37 | C41 | 122.6° | 113.7° |
| C22 | C38 | C37 | H381 | 121.3° | 123.5° |
| C22 | C38 | C41 | H381 | 129.8° | 127.2° |
| C38 | C22 | C35 | H351 | 159.9° | 93.3° |
| C38 | C22 | C35 | H352 | 77.7° | 144.5° |
| C22 | C38 | C37 | H371 | 129.7° | 100.9° |
| C22 | C38 | C41 | H412 | 147.2° | 26.7° |
| C22 | C38 | C41 | H411 | 26.6° | 97.4° |
| O39 | C40 | C41 | H401 | 119.9° | 119.7° |
| O39 | C40 | C41 | H402 | 119.8° | 118.2° |
| C40 | O39 | C37 | C38 | 8.0° | 0.1° |
| O39 | C40 | C41 | C38 | 18.2° | 35.8° |
| C40 | O39 | C37 | H371 | 115.1° | 122.9° |
| O39 | C40 | H401 | H402 | 120.5° | 121.4° |
| O39 | C40 | C41 | H412 | 101.5° | 82.1° |
| O39 | C40 | C41 | H411 | 137.9° | 153.8° |
| C37 | O39 | C40 | C41 | 6.4° | 22.8° |
| O39 | C37 | C38 | H371 | 126.0° | 122.7° |
| O39 | C37 | C38 | C41 | 18.3° | 22.7° |
| O39 | C37 | C38 | H381 | 134.3° | 100.2° |
| C37 | O39 | C40 | H401 | 126.2° | 142.2° |
| C37 | O39 | C40 | H402 | 113.5° | 95.9° |
| C40 | C41 | C38 | C37 | 21.9° | 34.5° |
| C40 | C41 | C38 | H412 | 119.7° | 117.9° |
| C40 | C41 | C38 | H411 | 119.7° | 117.9° |
| C40 | C41 | C38 | H381 | 137.2° | 88.1° |
| C41 | C40 | H401 | H402 | 120.5° | 122.2° |
| C40 | C41 | H412 | H411 | 120.8° | 124.2° |
| C28 | C27 | C26 | C25 | 0.1° | 0.6° |
| C28 | C27 | C26 | H271 | 180.0° | 180.0° |
| C28 | C27 | C26 | H261 | 180.0° | 179.4° |
| C37 | C38 | C41 | H381 | 115.2° | 122.6° |
| C37 | C38 | C22 | H221 | 149.6° | 121.6° |
| C37 | C38 | C41 | H412 | 97.8° | 83.4° |
| C37 | C38 | C41 | H411 | 141.6° | 152.4° |
| C41 | C38 | C22 | H221 | 97.2° | 129.7° |
| C41 | C38 | C37 | H371 | 107.6° | 145.4° |
| C38 | C41 | C40 | H401 | 138.0° | 155.5° |
| C38 | C41 | C40 | H402 | 101.7° | 82.4° |
| C38 | C41 | H412 | H411 | 120.8° | 124.2° |
| C25 | C26 | C27 | H261 | 180.0° | 180.0° |
| C26 | C25 | C24 | H241 | 179.6° | 180.0° |
| C25 | C26 | C27 | H271 | 179.9° | 179.5° |
| C26 | C27 | C28 | H281 | 179.0° | 180.0° |
| C27 | C26 | C25 | H251 | 179.7° | 180.0° |
| H151 | C15 | C14 | H141 | 0.4° | 0.2° |
| H151 | C15 | C16 | H161 | 0.2° | 0.0° |
| H171 | C17 | C16 | H161 | 0.6° | 0.0° |
| H171 | C17 | C18 | H181 | 1.2° | 0.1° |
| H221 | C22 | C35 | H351 | 77.4° | 25.4° |
| H221 | C22 | C35 | H352 | 45.1° | 96.8° |
| H221 | C22 | C38 | H381 | 31.0° | 2.0° |
| H241 | C24 | C25 | H251 | 0.4° | 0.0° |
| H261 | C26 | C25 | H251 | 0.3° | 0.1° |
| H261 | C26 | C27 | H271 | 0.0° | 0.6° |
| H281 | C28 | C27 | H271 | 1.0° | 0.0° |
| H021 | C02 | C03 | H032 | 164.4° | 65.0° |
| H021 | C02 | C03 | H031 | 45.2° | 175.0° |
| H021 | C02 | C04 | H041 | 170.1° | 175.0° |
| H021 | C02 | C04 | H042 | 50.7° | 65.0° |
| H021 | C02 | N01 | H011 | 178.4° | 144.9° |
| H032 | C03 | C05 | H051 | 76.7° | 64.9° |
| H031 | C03 | C05 | H051 | 164.1° | 175.0° |
| H051 | C05 | C06 | H061 | 62.6° | 60.0° |
| H051 | C05 | O10 | H101 | 60.2° | 180.0° |
| H061 | C06 | C11 | H111 | 55.9° | 65.0° |
| H061 | C06 | C11 | H112 | 176.6° | 175.0° |
| H061 | C06 | N07 | H071 | 176.5° | 145.0° |
| H091 | C09 | C31 | H313 | 57.1° | 60.0° |
| H091 | C09 | C31 | H312 | 62.9° | 60.0° |
| H091 | C09 | C31 | H311 | 177.1° | 180.0° |
| H091 | C09 | N29 | H291 | 174.1° | 144.9° |
| H313 | C31 | H312 | H311 | 120.0° | 120.1° |
| H343 | C34 | H342 | H341 | 120.0° | 120.0° |
| H371 | C37 | C38 | H381 | 8.4° | 22.5° |
| H381 | C38 | C41 | H412 | 17.4° | 153.9° |
| H381 | C38 | C41 | H411 | 103.1° | 29.8° |
| H401 | C40 | C41 | H412 | 18.3° | 37.6° |
| H401 | C40 | C41 | H411 | 102.2° | 86.5° |
| H402 | C40 | C41 | H412 | 138.7° | 159.7° |
| H402 | C40 | C41 | H411 | 18.1° | 35.6° |
