V7G
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O19 | C18 | doub | 1.21Å | 1.18Å | |
| N17 | C18 | sing | 1.35Å | 1.57Å | |
| N17 | C16 | sing | 1.47Å | 1.34Å | |
| C18 | C14 | sing | 1.51Å | 1.61Å | |
| C16 | C15 | sing | 1.54Å | 1.71Å | |
| O01 | C02 | sing | 1.43Å | 1.39Å | |
| C15 | C14 | sing | 1.55Å | 1.28Å | |
| C13 | C14 | sing | 1.53Å | 1.57Å | |
| C13 | C12 | sing | 1.53Å | 1.51Å | |
| C02 | C12 | sing | 1.53Å | 1.53Å | |
| C02 | C03 | sing | 1.51Å | 1.53Å | |
| C12 | N20 | sing | 1.47Å | 1.44Å | |
| C03 | N04 | doub | 1.28Å | 1.37Å | Aromatic |
| C03 | S11 | sing | 1.71Å | 1.69Å | Aromatic |
| N20 | C21 | sing | 1.35Å | 1.43Å | |
| N04 | C05 | sing | 1.35Å | 1.44Å | Aromatic |
| S11 | C10 | sing | 1.76Å | 1.68Å | Aromatic |
| O40 | C28 | doub | 1.22Å | 1.20Å | |
| C21 | O41 | doub | 1.21Å | 1.19Å | |
| C21 | C22 | sing | 1.51Å | 1.52Å | |
| C05 | C10 | doub | 1.40Å | 1.39Å | Aromatic |
| C05 | C06 | sing | 1.41Å | 1.41Å | Aromatic |
| C10 | C09 | sing | 1.39Å | 1.41Å | Aromatic |
| C06 | C07 | doub | 1.36Å | 1.39Å | Aromatic |
| C28 | C29 | sing | 1.47Å | 1.51Å | |
| C28 | N27 | sing | 1.35Å | 1.43Å | |
| N39 | C29 | sing | 1.38Å | 1.33Å | Aromatic |
| N39 | C38 | sing | 1.37Å | 1.37Å | Aromatic |
| C22 | N27 | sing | 1.47Å | 1.44Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| C29 | C30 | doub | 1.36Å | 1.39Å | Aromatic |
| C37 | C38 | doub | 1.39Å | 1.41Å | Aromatic |
| C37 | C36 | sing | 1.38Å | 1.40Å | Aromatic |
| C38 | C31 | sing | 1.41Å | 1.37Å | Aromatic |
| C09 | C08 | doub | 1.38Å | 1.40Å | Aromatic |
| C07 | C08 | sing | 1.39Å | 1.40Å | Aromatic |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C30 | C31 | sing | 1.41Å | 1.41Å | Aromatic |
| C36 | C35 | doub | 1.39Å | 1.40Å | Aromatic |
| C26 | C24 | sing | 1.53Å | 1.53Å | |
| C31 | C32 | doub | 1.41Å | 1.42Å | Aromatic |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C35 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C32 | O33 | sing | 1.36Å | 1.40Å | |
| O33 | C34 | sing | 1.43Å | 1.40Å | |
| C02 | H1 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C34 | H343 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C35 | H351 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| N17 | H171 | sing | 0.97Å | 1.00Å | |
| N20 | H201 | sing | 0.97Å | 1.00Å | |
| N27 | H271 | sing | 0.97Å | 1.00Å | |
| N39 | H391 | sing | 0.97Å | 1.00Å | |
| O01 | H011 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O19 | C18 | N17 | 126.9° | 125.1° |
| O19 | C18 | C14 | 127.5° | 124.9° |
| C18 | N17 | C16 | 106.4° | 111.3° |
| N17 | C18 | C14 | 105.5° | 110.0° |
| C18 | N17 | H171 | 126.8° | 124.3° |
| N17 | C16 | C15 | 107.0° | 105.5° |
| N17 | C16 | H162 | 110.1° | 110.2° |
| N17 | C16 | H161 | 110.1° | 110.3° |
| C16 | N17 | H171 | 126.8° | 124.3° |
| C18 | C14 | C15 | 106.2° | 104.3° |
| C18 | C14 | C13 | 108.1° | 110.5° |
| C18 | C14 | H141 | 107.1° | 110.5° |
| C16 | C15 | C14 | 105.6° | 101.8° |
| C16 | C15 | H151 | 110.4° | 111.0° |
| C16 | C15 | H152 | 110.4° | 111.0° |
| C15 | C16 | H162 | 110.1° | 110.2° |
| C15 | C16 | H161 | 110.1° | 110.2° |
| O01 | C02 | C12 | 112.8° | 109.5° |
| O01 | C02 | C03 | 108.3° | 109.5° |
| O01 | C02 | H1 | 110.6° | 109.5° |
| C02 | O01 | H011 | 109.5° | 114.0° |
| C15 | C14 | C13 | 115.8° | 110.5° |
| C15 | C14 | H141 | 111.7° | 110.4° |
| C14 | C15 | H151 | 110.4° | 110.9° |
| C14 | C15 | H152 | 110.5° | 111.0° |
| C14 | C13 | C12 | 111.3° | 109.4° |
| C14 | C13 | H131 | 109.0° | 109.4° |
| C14 | C13 | H132 | 109.0° | 109.5° |
| C13 | C14 | H141 | 107.5° | 110.4° |
| C13 | C12 | C02 | 110.9° | 109.5° |
| C13 | C12 | N20 | 109.6° | 109.5° |
| C13 | C12 | H121 | 109.7° | 109.4° |
| C12 | C13 | H131 | 109.0° | 109.4° |
| C12 | C13 | H132 | 109.0° | 109.5° |
| C12 | C02 | C03 | 107.8° | 109.5° |
| C02 | C12 | N20 | 106.6° | 109.4° |
| C12 | C02 | H1 | 108.6° | 109.4° |
| C02 | C12 | H121 | 109.4° | 109.5° |
| C02 | C03 | N04 | 119.9° | 124.2° |
| C02 | C03 | S11 | 127.9° | 124.3° |
| C03 | C02 | H1 | 108.6° | 109.5° |
| C12 | N20 | C21 | 121.5° | 120.0° |
| N20 | C12 | H121 | 110.7° | 109.5° |
| C12 | N20 | H201 | 119.2° | 120.0° |
| N04 | C03 | S11 | 112.1° | 111.5° |
| C03 | N04 | C05 | 108.2° | 117.9° |
| C03 | S11 | C10 | 95.9° | 90.8° |
| N20 | C21 | O41 | 119.5° | 120.0° |
| N20 | C21 | C22 | 117.8° | 120.0° |
| C21 | N20 | H201 | 119.3° | 120.0° |
| N04 | C05 | C10 | 117.0° | 111.8° |
| N04 | C05 | C06 | 121.8° | 129.7° |
| S11 | C10 | C05 | 106.8° | 108.0° |
| S11 | C10 | C09 | 134.1° | 131.7° |
| O40 | C28 | C29 | 121.2° | 120.0° |
| O40 | C28 | N27 | 119.4° | 120.0° |
| O41 | C21 | C22 | 122.7° | 119.9° |
| C21 | C22 | N27 | 110.9° | 109.5° |
| C21 | C22 | C23 | 109.7° | 109.5° |
| C21 | C22 | H221 | 108.4° | 109.5° |
| C10 | C05 | C06 | 121.2° | 118.5° |
| C05 | C10 | C09 | 119.1° | 120.2° |
| C05 | C06 | C07 | 119.2° | 120.4° |
| C05 | C06 | H061 | 120.4° | 119.8° |
| C10 | C09 | C08 | 119.9° | 120.0° |
| C10 | C09 | H091 | 120.1° | 120.0° |
| C06 | C07 | C08 | 120.0° | 120.8° |
| C07 | C06 | H061 | 120.4° | 119.8° |
| C06 | C07 | H071 | 120.0° | 119.6° |
| C29 | C28 | N27 | 119.4° | 120.0° |
| C28 | C29 | N39 | 126.2° | 125.5° |
| C28 | C29 | C30 | 125.3° | 125.5° |
| C28 | N27 | C22 | 118.6° | 120.0° |
| C28 | N27 | H271 | 120.7° | 120.0° |
| C29 | N39 | C38 | 109.7° | 108.8° |
| N39 | C29 | C30 | 108.5° | 109.1° |
| C29 | N39 | H391 | 125.2° | 125.6° |
| N39 | C38 | C37 | 131.2° | 133.1° |
| N39 | C38 | C31 | 108.5° | 107.4° |
| C38 | N39 | H391 | 125.1° | 125.7° |
| N27 | C22 | C23 | 110.3° | 109.5° |
| N27 | C22 | H221 | 109.4° | 109.5° |
| C22 | N27 | H271 | 120.7° | 120.0° |
| C22 | C23 | C24 | 113.6° | 109.5° |
| C23 | C22 | H221 | 108.2° | 109.4° |
| C22 | C23 | H231 | 108.5° | 109.4° |
| C22 | C23 | H232 | 108.5° | 109.5° |
| C29 | C30 | C31 | 106.7° | 107.8° |
| C29 | C30 | H301 | 126.6° | 126.1° |
| C38 | C37 | C36 | 119.1° | 120.1° |
| C37 | C38 | C31 | 120.3° | 119.6° |
| C38 | C37 | H371 | 120.5° | 120.0° |
| C37 | C36 | C35 | 120.5° | 120.7° |
| C37 | C36 | H361 | 119.7° | 119.6° |
| C36 | C37 | H371 | 120.4° | 120.0° |
| C38 | C31 | C30 | 106.6° | 107.1° |
| C38 | C31 | C32 | 120.5° | 119.6° |
| C09 | C08 | C07 | 120.6° | 120.1° |
| C09 | C08 | H081 | 119.7° | 120.0° |
| C08 | C09 | H091 | 120.1° | 120.1° |
| C08 | C07 | H071 | 120.0° | 119.6° |
| C07 | C08 | H081 | 119.7° | 120.0° |
| C23 | C24 | C26 | 110.6° | 109.5° |
| C23 | C24 | C25 | 111.4° | 109.5° |
| C24 | C23 | H231 | 108.4° | 109.5° |
| C24 | C23 | H232 | 108.4° | 109.5° |
| C23 | C24 | H241 | 108.7° | 109.5° |
| C30 | C31 | C32 | 132.8° | 133.3° |
| C31 | C30 | H301 | 126.7° | 126.1° |
| C36 | C35 | C32 | 120.4° | 120.4° |
| C36 | C35 | H351 | 119.8° | 119.8° |
| C35 | C36 | H361 | 119.8° | 119.7° |
| C26 | C24 | C25 | 109.0° | 109.5° |
| C26 | C24 | H241 | 108.5° | 109.4° |
| C24 | C26 | H262 | 109.5° | 109.5° |
| C24 | C26 | H263 | 109.5° | 109.5° |
| C24 | C26 | H261 | 109.4° | 109.5° |
| C31 | C32 | C35 | 119.1° | 119.6° |
| C31 | C32 | O33 | 117.3° | 120.2° |
| C25 | C24 | H241 | 108.6° | 109.5° |
| C24 | C25 | H253 | 109.5° | 109.5° |
| C24 | C25 | H251 | 109.5° | 109.4° |
| C24 | C25 | H252 | 109.5° | 109.5° |
| C35 | C32 | O33 | 123.6° | 120.2° |
| C32 | C35 | H351 | 119.8° | 119.8° |
| C32 | O33 | C34 | 116.2° | 117.0° |
| O33 | C34 | H343 | 109.5° | 109.5° |
| O33 | C34 | H342 | 109.5° | 109.5° |
| O33 | C34 | H341 | 109.5° | 109.5° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H151 | C15 | H152 | 109.5° | 110.8° |
| H162 | C16 | H161 | 109.4° | 110.3° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| H253 | C25 | H251 | 109.5° | 109.4° |
| H253 | C25 | H252 | 109.4° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.5° |
| H262 | C26 | H263 | 109.5° | 109.5° |
| H262 | C26 | H261 | 109.5° | 109.4° |
| H263 | C26 | H261 | 109.5° | 109.4° |
| H343 | C34 | H342 | 109.4° | 109.5° |
| H343 | C34 | H341 | 109.5° | 109.5° |
| H342 | C34 | H341 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O19 | C18 | N17 | C14 | 179.7° | 180.0° |
| O19 | C18 | N17 | C16 | 179.3° | 179.4° |
| O19 | C18 | C14 | C15 | 159.5° | 163.9° |
| O19 | C18 | C14 | C13 | 34.6° | 45.1° |
| O19 | C18 | C14 | H141 | 81.0° | 77.4° |
| O19 | C18 | N17 | H171 | 0.7° | 0.4° |
| C18 | N17 | C16 | H171 | 180.0° | 179.8° |
| C18 | N17 | C16 | C15 | 16.0° | 17.1° |
| N17 | C18 | C14 | C15 | 20.8° | 16.1° |
| N17 | C18 | C14 | C13 | 145.7° | 134.8° |
| N17 | C18 | C14 | H141 | 98.7° | 102.6° |
| C18 | N17 | C16 | H162 | 103.6° | 136.1° |
| C18 | N17 | C16 | H161 | 135.7° | 101.9° |
| C16 | N17 | C18 | C14 | 0.4° | 0.6° |
| N17 | C16 | C15 | H162 | 119.6° | 118.9° |
| N17 | C16 | C15 | H161 | 119.6° | 119.1° |
| N17 | C16 | C15 | C14 | 31.4° | 25.4° |
| N17 | C16 | C15 | H151 | 150.7° | 92.7° |
| N17 | C16 | C15 | H152 | 88.1° | 143.6° |
| N17 | C16 | H162 | H161 | 121.2° | 122.1° |
| C18 | C14 | C15 | C16 | 28.9° | 24.7° |
| C18 | C14 | C15 | C13 | 120.0° | 118.8° |
| C18 | C14 | C15 | H141 | 116.4° | 118.7° |
| C18 | C14 | C13 | H141 | 115.3° | 122.6° |
| C18 | C14 | C13 | C12 | 178.2° | 82.2° |
| C18 | C14 | C13 | H131 | 61.5° | 37.7° |
| C18 | C14 | C13 | H132 | 57.9° | 157.7° |
| C18 | C14 | C15 | H151 | 148.3° | 93.4° |
| C18 | C14 | C15 | H152 | 90.5° | 142.9° |
| C14 | C18 | N17 | H171 | 179.6° | 179.6° |
| C16 | C15 | C14 | H151 | 119.4° | 118.1° |
| C16 | C15 | C14 | H152 | 119.4° | 118.2° |
| C16 | C15 | C14 | C13 | 148.9° | 143.5° |
| C16 | C15 | C14 | H141 | 87.5° | 94.0° |
| C16 | C15 | H151 | H152 | 121.8° | 123.8° |
| C15 | C16 | H162 | H161 | 121.2° | 121.9° |
| C15 | C16 | N17 | H171 | 164.0° | 163.1° |
| O01 | C02 | C12 | C13 | 61.2° | 55.0° |
| O01 | C02 | C12 | C03 | 119.5° | 120.0° |
| O01 | C02 | C12 | H1 | 123.0° | 120.0° |
| O01 | C02 | C03 | H1 | 120.1° | 120.0° |
| O01 | C02 | C12 | N20 | 179.5° | 65.0° |
| O01 | C02 | C03 | N04 | 55.5° | 135.0° |
| O01 | C02 | C03 | S11 | 126.3° | 45.3° |
| O01 | C02 | C12 | H121 | 59.9° | 175.0° |
| C15 | C14 | C13 | H141 | 125.7° | 122.5° |
| C15 | C14 | C13 | C12 | 62.8° | 162.9° |
| C15 | C14 | C13 | H131 | 57.4° | 77.2° |
| C15 | C14 | C13 | H132 | 176.9° | 42.8° |
| C14 | C15 | H151 | H152 | 121.8° | 123.8° |
| C14 | C15 | C16 | H162 | 88.3° | 144.4° |
| C14 | C15 | C16 | H161 | 151.0° | 93.7° |
| C14 | C13 | C12 | H131 | 120.3° | 119.9° |
| C14 | C13 | C12 | H132 | 120.3° | 120.1° |
| C14 | C13 | C12 | C02 | 164.8° | 172.9° |
| C14 | C13 | C12 | N20 | 77.8° | 67.2° |
| C14 | C13 | C12 | H121 | 43.9° | 52.9° |
| C14 | C13 | H131 | H132 | 119.2° | 120.1° |
| C13 | C14 | C15 | H151 | 91.7° | 25.4° |
| C13 | C14 | C15 | H152 | 29.6° | 98.3° |
| C13 | C12 | C02 | N20 | 119.3° | 120.0° |
| C13 | C12 | C02 | H121 | 121.1° | 119.9° |
| C13 | C12 | C02 | C03 | 179.3° | 65.0° |
| C13 | C12 | N20 | H121 | 121.1° | 120.0° |
| C13 | C12 | N20 | C21 | 119.1° | 114.6° |
| C13 | C12 | C02 | H1 | 61.8° | 175.0° |
| C12 | C13 | H131 | H132 | 119.2° | 120.0° |
| C12 | C13 | C14 | H141 | 62.9° | 40.4° |
| C13 | C12 | N20 | H201 | 61.0° | 65.4° |
| C12 | C02 | C03 | H1 | 117.6° | 120.0° |
| C02 | C12 | N20 | H121 | 118.8° | 120.0° |
| C12 | C02 | C03 | N04 | 66.9° | 105.0° |
| C12 | C02 | C03 | S11 | 111.4° | 74.7° |
| C02 | C12 | N20 | C21 | 120.9° | 125.4° |
| C02 | C12 | C13 | H131 | 44.5° | 67.2° |
| C02 | C12 | C13 | H132 | 75.0° | 52.8° |
| C02 | C12 | N20 | H201 | 59.1° | 54.6° |
| C12 | C02 | O01 | H011 | 180.0° | 60.0° |
| C03 | C02 | C12 | N20 | 60.0° | 175.0° |
| C02 | C03 | N04 | S11 | 178.5° | 179.7° |
| C02 | C03 | N04 | C05 | 179.9° | 180.0° |
| C02 | C03 | S11 | C10 | 179.6° | 180.0° |
| C03 | C02 | C12 | H121 | 59.6° | 55.0° |
| C03 | C02 | O01 | H011 | 60.8° | 60.0° |
| C12 | N20 | C21 | H201 | 180.0° | 180.0° |
| C12 | N20 | C21 | O41 | 2.6° | 5.5° |
| C12 | N20 | C21 | C22 | 178.5° | 174.5° |
| N20 | C12 | C02 | H1 | 57.5° | 55.0° |
| N20 | C12 | C13 | H131 | 161.9° | 52.8° |
| N20 | C12 | C13 | H132 | 42.4° | 172.8° |
| N04 | C03 | S11 | C10 | 1.3° | 0.3° |
| C03 | N04 | C05 | C10 | 1.2° | 0.1° |
| C03 | N04 | C05 | C06 | 179.9° | 179.8° |
| N04 | C03 | C02 | H1 | 175.6° | 15.0° |
| S11 | C03 | N04 | C05 | 1.5° | 0.3° |
| C03 | S11 | C10 | C05 | 0.5° | 0.2° |
| C03 | S11 | C10 | C09 | 179.5° | 179.8° |
| S11 | C03 | C02 | H1 | 6.2° | 165.4° |
| N20 | C21 | O41 | C22 | 178.9° | 180.0° |
| N20 | C21 | C22 | N27 | 140.7° | 180.0° |
| N20 | C21 | C22 | C23 | 97.3° | 60.0° |
| C21 | N20 | C12 | H121 | 2.0° | 5.4° |
| N20 | C21 | C22 | H221 | 20.6° | 59.9° |
| N04 | C05 | C10 | S11 | 0.3° | 0.1° |
| N04 | C05 | C10 | C06 | 178.7° | 179.9° |
| N04 | C05 | C10 | C09 | 179.7° | 179.9° |
| N04 | C05 | C06 | C07 | 179.7° | 179.9° |
| N04 | C05 | C06 | H061 | 0.3° | 0.1° |
| S11 | C10 | C05 | C09 | 180.0° | 179.9° |
| S11 | C10 | C05 | C06 | 179.0° | 180.0° |
| S11 | C10 | C09 | C08 | 179.2° | 180.0° |
| S11 | C10 | C09 | H091 | 0.8° | 0.1° |
| O40 | C28 | C29 | N27 | 177.7° | 179.9° |
| O40 | C28 | C29 | N39 | 4.9° | 179.7° |
| O40 | C28 | N27 | C22 | 2.9° | 0.1° |
| O40 | C28 | C29 | C30 | 175.5° | 0.1° |
| O40 | C28 | N27 | H271 | 177.1° | 180.0° |
| O41 | C21 | C22 | N27 | 38.2° | 0.0° |
| O41 | C21 | C22 | C23 | 83.8° | 120.0° |
| O41 | C21 | C22 | H221 | 158.3° | 120.1° |
| O41 | C21 | N20 | H201 | 177.4° | 174.5° |
| C21 | C22 | N27 | C28 | 72.0° | 155.0° |
| C21 | C22 | N27 | C23 | 121.7° | 120.0° |
| C21 | C22 | N27 | H221 | 119.5° | 120.1° |
| C21 | C22 | C23 | H221 | 118.1° | 120.0° |
| C21 | C22 | C23 | C24 | 176.1° | 175.0° |
| C21 | C22 | C23 | H231 | 63.4° | 65.0° |
| C21 | C22 | C23 | H232 | 55.5° | 55.0° |
| C22 | C21 | N20 | H201 | 1.5° | 5.5° |
| C21 | C22 | N27 | H271 | 108.0° | 25.0° |
| C10 | C05 | C06 | C07 | 1.0° | 0.0° |
| C05 | C10 | C09 | C08 | 0.8° | 0.0° |
| C10 | C05 | C06 | H061 | 179.0° | 180.0° |
| C05 | C10 | C09 | H091 | 179.2° | 180.0° |
| C06 | C05 | C10 | C09 | 1.0° | 0.0° |
| C05 | C06 | C07 | H061 | 180.0° | 180.0° |
| C05 | C06 | C07 | C08 | 0.8° | 0.0° |
| C05 | C06 | C07 | H071 | 179.2° | 179.9° |
| C10 | C09 | C08 | H091 | 180.0° | 180.0° |
| C10 | C09 | C08 | C07 | 0.6° | 0.0° |
| C10 | C09 | C08 | H081 | 179.4° | 179.9° |
| C06 | C07 | C08 | C09 | 0.6° | 0.0° |
| C06 | C07 | C08 | H071 | 180.0° | 179.9° |
| C06 | C07 | C08 | H081 | 179.4° | 179.9° |
| C28 | C29 | N39 | C30 | 179.7° | 179.7° |
| C28 | C29 | N39 | C38 | 179.9° | 179.8° |
| C29 | C28 | N27 | C22 | 179.4° | 180.0° |
| C28 | C29 | C30 | C31 | 179.7° | 180.0° |
| C28 | C29 | C30 | H301 | 0.3° | 0.0° |
| C29 | C28 | N27 | H271 | 0.6° | 0.0° |
| C28 | C29 | N39 | H391 | 0.1° | 0.1° |
| N27 | C28 | C29 | N39 | 177.5° | 0.4° |
| C28 | N27 | C22 | H271 | 180.0° | 180.0° |
| C28 | N27 | C22 | C23 | 166.4° | 85.0° |
| N27 | C28 | C29 | C30 | 2.2° | 180.0° |
| C28 | N27 | C22 | H221 | 47.5° | 34.9° |
| C29 | N39 | C38 | H391 | 180.0° | 179.8° |
| C29 | N39 | C38 | C37 | 179.7° | 179.9° |
| C29 | N39 | C38 | C31 | 0.7° | 0.5° |
| N39 | C29 | C30 | C31 | 0.0° | 0.3° |
| N39 | C29 | C30 | H301 | 180.0° | 179.7° |
| C38 | N39 | C29 | C30 | 0.4° | 0.5° |
| N39 | C38 | C37 | C31 | 179.6° | 179.6° |
| N39 | C38 | C37 | C36 | 180.0° | 179.5° |
| N39 | C38 | C31 | C30 | 0.7° | 0.3° |
| N39 | C38 | C31 | C32 | 179.3° | 179.7° |
| N39 | C38 | C37 | H371 | 0.0° | 0.3° |
| N27 | C22 | C23 | H221 | 119.6° | 120.0° |
| N27 | C22 | C23 | C24 | 61.6° | 65.0° |
| N27 | C22 | C23 | H231 | 59.0° | 55.0° |
| N27 | C22 | C23 | H232 | 177.8° | 175.0° |
| C22 | C23 | C24 | H231 | 120.6° | 120.0° |
| C22 | C23 | C24 | H232 | 120.6° | 120.1° |
| C22 | C23 | C24 | C26 | 68.6° | 65.0° |
| C22 | C23 | C24 | C25 | 169.9° | 175.0° |
| C22 | C23 | H231 | H232 | 118.2° | 120.0° |
| C22 | C23 | C24 | H241 | 50.4° | 55.0° |
| C23 | C22 | N27 | H271 | 13.6° | 95.0° |
| C29 | C30 | C31 | C38 | 0.4° | 0.0° |
| C29 | C30 | C31 | H301 | 180.0° | 180.0° |
| C29 | C30 | C31 | C32 | 178.8° | 180.0° |
| C30 | C29 | N39 | H391 | 179.6° | 179.8° |
| C38 | C37 | C36 | H371 | 180.0° | 179.9° |
| C37 | C38 | C31 | C30 | 179.6° | 180.0° |
| C38 | C37 | C36 | C35 | 0.3° | 0.1° |
| C37 | C38 | C31 | C32 | 1.0° | 0.0° |
| C38 | C37 | C36 | H361 | 179.7° | 180.0° |
| C37 | C38 | N39 | H391 | 0.3° | 0.1° |
| C36 | C37 | C38 | C31 | 0.4° | 0.1° |
| C37 | C36 | C35 | H361 | 180.0° | 179.9° |
| C37 | C36 | C35 | C32 | 0.3° | 0.0° |
| C37 | C36 | C35 | H351 | 179.7° | 179.9° |
| C38 | C31 | C30 | C32 | 178.4° | 180.0° |
| C38 | C31 | C32 | C35 | 1.0° | 0.0° |
| C38 | C31 | C32 | O33 | 179.9° | 180.0° |
| C38 | C31 | C30 | H301 | 179.6° | 180.0° |
| C31 | C38 | C37 | H371 | 179.6° | 180.0° |
| C31 | C38 | N39 | H391 | 179.3° | 179.8° |
| C09 | C08 | C07 | H081 | 180.0° | 179.9° |
| C09 | C08 | C07 | H071 | 179.4° | 179.9° |
| C08 | C07 | C06 | H061 | 179.2° | 180.0° |
| C07 | C08 | C09 | H091 | 179.4° | 180.0° |
| C23 | C24 | C26 | C25 | 122.8° | 120.0° |
| C23 | C24 | C26 | H241 | 119.1° | 120.0° |
| C23 | C24 | C25 | H241 | 119.6° | 120.0° |
| C24 | C23 | C22 | H221 | 58.0° | 55.0° |
| C24 | C23 | H231 | H232 | 118.1° | 120.0° |
| C23 | C24 | C25 | H253 | 180.0° | 60.0° |
| C23 | C24 | C25 | H251 | 60.0° | 180.0° |
| C23 | C24 | C25 | H252 | 60.0° | 60.0° |
| C23 | C24 | C26 | H262 | 180.0° | 60.0° |
| C23 | C24 | C26 | H263 | 60.0° | 180.0° |
| C23 | C24 | C26 | H261 | 60.0° | 60.0° |
| C30 | C31 | C32 | C35 | 179.2° | 180.0° |
| C30 | C31 | C32 | O33 | 1.9° | 0.1° |
| C36 | C35 | C32 | C31 | 0.3° | 0.0° |
| C36 | C35 | C32 | H351 | 180.0° | 180.0° |
| C36 | C35 | C32 | O33 | 179.2° | 180.0° |
| C35 | C36 | C37 | H371 | 179.7° | 180.0° |
| C26 | C24 | C25 | H241 | 118.0° | 120.0° |
| C26 | C24 | C23 | H231 | 170.8° | 175.0° |
| C26 | C24 | C23 | H232 | 52.0° | 55.0° |
| C26 | C24 | C25 | H253 | 57.6° | 60.0° |
| C26 | C24 | C25 | H251 | 177.6° | 60.0° |
| C26 | C24 | C25 | H252 | 62.4° | 180.0° |
| C24 | C26 | H262 | H263 | 120.0° | 120.1° |
| C24 | C26 | H262 | H261 | 120.0° | 120.0° |
| C24 | C26 | H263 | H261 | 120.0° | 120.0° |
| C31 | C32 | C35 | O33 | 178.8° | 180.0° |
| C31 | C32 | O33 | C34 | 177.6° | 180.0° |
| C32 | C31 | C30 | H301 | 1.1° | 0.0° |
| C31 | C32 | C35 | H351 | 179.7° | 180.0° |
| C25 | C24 | C23 | H231 | 49.3° | 55.0° |
| C25 | C24 | C23 | H232 | 69.4° | 64.9° |
| C24 | C25 | H253 | H251 | 120.0° | 120.0° |
| C24 | C25 | H253 | H252 | 120.0° | 120.0° |
| C24 | C25 | H251 | H252 | 120.0° | 120.0° |
| C25 | C24 | C26 | H262 | 57.2° | 180.0° |
| C25 | C24 | C26 | H263 | 62.8° | 60.0° |
| C25 | C24 | C26 | H261 | 177.2° | 60.0° |
| C35 | C32 | O33 | C34 | 1.3° | 0.0° |
| C32 | C35 | C36 | H361 | 179.7° | 179.9° |
| C32 | O33 | C34 | H343 | 180.0° | 180.0° |
| C32 | O33 | C34 | H342 | 60.0° | 60.0° |
| C32 | O33 | C34 | H341 | 60.0° | 60.0° |
| O33 | C32 | C35 | H351 | 0.8° | 0.0° |
| O33 | C34 | H343 | H342 | 120.0° | 120.0° |
| O33 | C34 | H343 | H341 | 120.0° | 120.0° |
| O33 | C34 | H342 | H341 | 120.0° | 120.0° |
| H1 | C02 | C12 | H121 | 177.2° | 65.0° |
| H1 | C02 | O01 | H011 | 58.1° | 180.0° |
| H061 | C06 | C07 | H071 | 0.8° | 0.1° |
| H071 | C07 | C08 | H081 | 0.6° | 0.0° |
| H081 | C08 | C09 | H091 | 0.7° | 0.1° |
| H121 | C12 | C13 | H131 | 76.4° | 172.8° |
| H121 | C12 | C13 | H132 | 164.1° | 67.1° |
| H121 | C12 | N20 | H201 | 177.9° | 174.6° |
| H131 | C13 | C14 | H141 | 176.8° | 160.3° |
| H132 | C13 | C14 | H141 | 57.4° | 79.7° |
| H141 | C14 | C15 | H151 | 31.9° | 147.9° |
| H141 | C14 | C15 | H152 | 153.1° | 24.2° |
| H151 | C15 | C16 | H162 | 31.1° | 26.3° |
| H151 | C15 | C16 | H161 | 89.7° | 148.2° |
| H152 | C15 | C16 | H162 | 152.3° | 97.5° |
| H152 | C15 | C16 | H161 | 31.6° | 24.5° |
| H162 | C16 | N17 | H171 | 76.4° | 44.1° |
| H161 | C16 | N17 | H171 | 44.4° | 77.9° |
| H221 | C22 | C23 | H231 | 178.6° | 175.0° |
| H221 | C22 | C23 | H232 | 62.6° | 65.0° |
| H221 | C22 | N27 | H271 | 132.4° | 145.0° |
| H231 | C23 | C24 | H241 | 70.3° | 65.0° |
| H232 | C23 | C24 | H241 | 171.0° | 175.0° |
| H241 | C24 | C25 | H253 | 60.4° | 179.9° |
| H241 | C24 | C25 | H251 | 59.6° | 60.0° |
| H241 | C24 | C25 | H252 | 179.6° | 60.0° |
| H241 | C24 | C26 | H262 | 60.9° | 60.0° |
| H241 | C24 | C26 | H263 | 179.1° | 60.0° |
| H241 | C24 | C26 | H261 | 59.1° | 180.0° |
| H253 | C25 | H251 | H252 | 119.9° | 120.0° |
| H262 | C26 | H263 | H261 | 120.0° | 119.9° |
| H343 | C34 | H342 | H341 | 120.0° | 120.0° |
| H351 | C35 | C36 | H361 | 0.3° | 0.1° |
| H361 | C36 | C37 | H371 | 0.2° | 0.2° |
