BIM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C3 | sing | 1.49Å | 1.47Å | |
| C1 | N2 | sing | 1.36Å | 1.38Å | |
| C1 | O25 | doub | 1.22Å | 1.22Å | |
| C3 | C11 | sing | 1.42Å | 1.49Å | |
| C3 | C5 | doub | 1.34Å | 1.35Å | |
| C4 | C5 | sing | 1.49Å | 1.47Å | |
| C4 | O24 | doub | 1.22Å | 1.21Å | |
| C4 | N2 | sing | 1.36Å | 1.37Å | |
| C5 | C6 | sing | 1.42Å | 1.50Å | |
| C6 | C7 | sing | 1.43Å | 1.39Å | |
| C6 | C8 | doub | 1.38Å | 1.38Å | |
| C7 | C9 | doub | 1.40Å | 1.38Å | Aromatic |
| C7 | C16 | sing | 1.41Å | 1.39Å | Aromatic |
| C8 | N10 | sing | 1.37Å | 1.36Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| N10 | C35 | sing | 1.46Å | 1.48Å | |
| N10 | C9 | sing | 1.38Å | 1.35Å | |
| C11 | C12 | doub | 1.38Å | 1.38Å | |
| C11 | C13 | sing | 1.43Å | 1.38Å | |
| C12 | N14 | sing | 1.37Å | 1.35Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C15 | N14 | sing | 1.38Å | 1.34Å | |
| C15 | C22 | doub | 1.40Å | 1.39Å | Aromatic |
| C15 | C13 | sing | 1.40Å | 1.37Å | Aromatic |
| C16 | C17 | doub | 1.40Å | 1.39Å | Aromatic |
| C16 | H16 | sing | 1.09Å | 1.08Å | |
| C17 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| C17 | H17 | sing | 1.09Å | 1.08Å | |
| C18 | C19 | doub | 1.40Å | 1.40Å | Aromatic |
| C18 | C9 | sing | 1.40Å | 1.39Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.09Å | 1.08Å | |
| C21 | C23 | doub | 1.39Å | 1.39Å | Aromatic |
| C21 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
| C21 | H21 | sing | 1.09Å | 1.08Å | |
| C23 | C22 | sing | 1.40Å | 1.39Å | Aromatic |
| C23 | H23 | sing | 1.09Å | 1.08Å | |
| C27 | C28 | sing | 1.53Å | 1.54Å | |
| C27 | C26 | sing | 1.53Å | 1.55Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.10Å | 1.10Å | |
| C30 | C29 | doub | 1.39Å | 1.37Å | Aromatic |
| C30 | C32 | sing | 1.39Å | 1.37Å | Aromatic |
| C30 | H30 | sing | 1.09Å | 1.08Å | |
| C32 | C34 | doub | 1.40Å | 1.39Å | Aromatic |
| C32 | H32 | sing | 1.09Å | 1.08Å | |
| C33 | N39 | sing | 1.42Å | 1.43Å | |
| C33 | N31 | doub | 1.35Å | 1.39Å | Aromatic |
| C33 | C34 | sing | 1.39Å | 1.41Å | Aromatic |
| C34 | C37 | sing | 1.51Å | 1.53Å | |
| C35 | C36 | sing | 1.53Å | 1.55Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.10Å | 1.10Å | |
| C36 | C38 | sing | 1.53Å | 1.53Å | |
| C36 | H361 | sing | 1.10Å | 1.10Å | |
| C36 | H362 | sing | 1.10Å | 1.10Å | |
| C37 | C38 | sing | 1.53Å | 1.55Å | |
| C37 | H371 | sing | 1.10Å | 1.10Å | |
| C37 | H372 | sing | 1.10Å | 1.10Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| C38 | H382 | sing | 1.10Å | 1.10Å | |
| C40 | N39 | sing | 1.45Å | 1.48Å | |
| C40 | H401 | sing | 1.09Å | 1.10Å | |
| C40 | H402 | sing | 1.09Å | 1.10Å | |
| C40 | H403 | sing | 1.09Å | 1.10Å | |
| C13 | C20 | doub | 1.41Å | 1.39Å | Aromatic |
| C20 | H20 | sing | 1.09Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| N14 | C26 | sing | 1.45Å | 1.48Å | |
| C26 | H261 | sing | 1.10Å | 1.10Å | |
| C26 | H262 | sing | 1.10Å | 1.10Å | |
| C28 | C29 | sing | 1.51Å | 1.51Å | |
| C28 | H281 | sing | 1.10Å | 1.10Å | |
| C28 | H282 | sing | 1.10Å | 1.10Å | |
| C29 | N31 | sing | 1.36Å | 1.38Å | Aromatic |
| N39 | C41 | sing | 1.45Å | 1.48Å | |
| C41 | H411 | sing | 1.09Å | 1.10Å | |
| C41 | H412 | sing | 1.09Å | 1.10Å | |
| C41 | H413 | sing | 1.09Å | 1.10Å | |
| N2 | HN2 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | C1 | N2 | 111.5° | 106.4° |
| C3 | C1 | O25 | 124.7° | 125.4° |
| C1 | C3 | C11 | 120.9° | 120.9° |
| C1 | C3 | C5 | 106.5° | 107.9° |
| N2 | C1 | O25 | 123.8° | 128.1° |
| C1 | N2 | C4 | 104.3° | 111.4° |
| C1 | N2 | HN2 | 127.8° | 124.3° |
| C11 | C3 | C5 | 132.6° | 131.1° |
| C3 | C11 | C12 | 129.0° | 123.7° |
| C3 | C11 | C13 | 125.0° | 128.2° |
| C3 | C5 | C4 | 105.9° | 107.6° |
| C3 | C5 | C6 | 134.7° | 130.7° |
| C5 | C4 | O24 | 124.8° | 125.6° |
| C5 | C4 | N2 | 111.7° | 106.5° |
| C4 | C5 | C6 | 119.4° | 121.7° |
| O24 | C4 | N2 | 123.6° | 127.9° |
| C4 | N2 | HN2 | 127.8° | 124.3° |
| C5 | C6 | C7 | 126.3° | 127.6° |
| C5 | C6 | C8 | 128.5° | 124.9° |
| C7 | C6 | C8 | 105.2° | 107.4° |
| C6 | C7 | C9 | 108.5° | 107.3° |
| C6 | C7 | C16 | 130.2° | 134.1° |
| C6 | C8 | N10 | 110.1° | 108.2° |
| C6 | C8 | H8 | 125.0° | 131.6° |
| C9 | C7 | C16 | 121.3° | 118.6° |
| C7 | C9 | N10 | 108.3° | 106.8° |
| C7 | C9 | C18 | 120.0° | 121.8° |
| C7 | C16 | C17 | 119.1° | 119.7° |
| C7 | C16 | H16 | 120.4° | 120.7° |
| N10 | C8 | H8 | 124.9° | 120.2° |
| C8 | N10 | C35 | 121.4° | 122.9° |
| C8 | N10 | C9 | 107.9° | 110.2° |
| C35 | N10 | C9 | 130.7° | 126.9° |
| N10 | C35 | C36 | 122.1° | 112.3° |
| N10 | C35 | H351 | 105.5° | 109.0° |
| N10 | C35 | H352 | 102.5° | 106.4° |
| N10 | C9 | C18 | 131.7° | 131.3° |
| C12 | C11 | C13 | 106.1° | 107.8° |
| C11 | C12 | N14 | 109.0° | 108.1° |
| C11 | C12 | H12 | 125.5° | 130.9° |
| C11 | C13 | C15 | 107.8° | 107.0° |
| C11 | C13 | C20 | 131.0° | 134.3° |
| N14 | C12 | H12 | 125.5° | 120.8° |
| C12 | N14 | C15 | 108.3° | 110.0° |
| C12 | N14 | C26 | 126.2° | 123.4° |
| N14 | C15 | C22 | 130.6° | 131.1° |
| N14 | C15 | C13 | 108.8° | 107.1° |
| C15 | N14 | C26 | 125.5° | 125.8° |
| C22 | C15 | C13 | 120.6° | 121.8° |
| C15 | C22 | C23 | 118.8° | 118.3° |
| C15 | C22 | H22 | 120.6° | 121.5° |
| C15 | C13 | C20 | 121.2° | 118.6° |
| C17 | C16 | H16 | 120.4° | 119.6° |
| C16 | C17 | C19 | 120.1° | 120.6° |
| C16 | C17 | H17 | 119.9° | 119.6° |
| C19 | C17 | H17 | 120.0° | 119.8° |
| C17 | C19 | C18 | 120.4° | 120.9° |
| C17 | C19 | H19 | 119.8° | 119.6° |
| C19 | C18 | C9 | 119.1° | 118.3° |
| C19 | C18 | H18 | 120.5° | 120.1° |
| C18 | C19 | H19 | 119.8° | 119.5° |
| C9 | C18 | H18 | 120.4° | 121.5° |
| C23 | C21 | C20 | 120.0° | 120.6° |
| C23 | C21 | H21 | 120.0° | 119.8° |
| C21 | C23 | C22 | 120.6° | 120.9° |
| C21 | C23 | H23 | 119.8° | 119.6° |
| C20 | C21 | H21 | 120.0° | 119.6° |
| C21 | C20 | C13 | 118.8° | 119.8° |
| C21 | C20 | H20 | 120.6° | 119.5° |
| C22 | C23 | H23 | 119.7° | 119.5° |
| C23 | C22 | H22 | 120.6° | 120.1° |
| C28 | C27 | C26 | 112.6° | 114.3° |
| C28 | C27 | H271 | 108.4° | 111.7° |
| C28 | C27 | H272 | 107.7° | 107.3° |
| C27 | C28 | C29 | 108.8° | 115.4° |
| C27 | C28 | H281 | 109.7° | 108.3° |
| C27 | C28 | H282 | 109.8° | 109.5° |
| C26 | C27 | H271 | 108.4° | 110.8° |
| C26 | C27 | H272 | 107.7° | 106.3° |
| C27 | C26 | N14 | 114.1° | 116.6° |
| C27 | C26 | H261 | 107.9° | 109.4° |
| C27 | C26 | H262 | 106.9° | 109.7° |
| H271 | C27 | H272 | 112.0° | 105.8° |
| C29 | C30 | C32 | 119.7° | 118.7° |
| C29 | C30 | H30 | 120.1° | 121.4° |
| C30 | C29 | C28 | 119.0° | 119.5° |
| C30 | C29 | N31 | 118.9° | 122.2° |
| C32 | C30 | H30 | 120.2° | 119.9° |
| C30 | C32 | C34 | 122.7° | 120.4° |
| C30 | C32 | H32 | 118.7° | 119.0° |
| C34 | C32 | H32 | 118.7° | 120.7° |
| C32 | C34 | C33 | 118.2° | 116.7° |
| C32 | C34 | C37 | 119.0° | 121.7° |
| N39 | C33 | N31 | 115.6° | 116.3° |
| N39 | C33 | C34 | 126.6° | 119.3° |
| C33 | N39 | C40 | 132.1° | 120.3° |
| C33 | N39 | C41 | 120.5° | 120.2° |
| N31 | C33 | C34 | 117.8° | 124.4° |
| C33 | N31 | C29 | 122.7° | 117.7° |
| C33 | C34 | C37 | 122.8° | 121.5° |
| C34 | C37 | C38 | 119.1° | 113.4° |
| C34 | C37 | H371 | 106.4° | 107.8° |
| C34 | C37 | H372 | 104.1° | 110.2° |
| C36 | C35 | H351 | 105.4° | 112.0° |
| C36 | C35 | H352 | 102.5° | 109.8° |
| C35 | C36 | C38 | 108.6° | 112.4° |
| C35 | C36 | H361 | 109.8° | 108.7° |
| C35 | C36 | H362 | 110.0° | 109.7° |
| H351 | C35 | H352 | 120.1° | 107.1° |
| C38 | C36 | H361 | 109.8° | 108.3° |
| C38 | C36 | H362 | 110.0° | 110.9° |
| C36 | C38 | C37 | 115.3° | 112.6° |
| C36 | C38 | H381 | 107.6° | 111.0° |
| C36 | C38 | H382 | 106.2° | 108.2° |
| H361 | C36 | H362 | 108.8° | 106.6° |
| C38 | C37 | H371 | 106.4° | 109.2° |
| C38 | C37 | H372 | 104.1° | 109.7° |
| C37 | C38 | H381 | 107.6° | 109.7° |
| C37 | C38 | H382 | 106.2° | 108.7° |
| H371 | C37 | H372 | 117.4° | 106.3° |
| H381 | C38 | H382 | 114.2° | 106.3° |
| N39 | C40 | H401 | 109.5° | 110.1° |
| N39 | C40 | H402 | 109.5° | 110.2° |
| N39 | C40 | H403 | 109.4° | 110.2° |
| C40 | N39 | C41 | 107.4° | 119.5° |
| H401 | C40 | H402 | 109.5° | 108.8° |
| H401 | C40 | H403 | 109.5° | 108.8° |
| H402 | C40 | H403 | 109.5° | 108.7° |
| C13 | C20 | H20 | 120.6° | 120.7° |
| N14 | C26 | H261 | 107.9° | 106.5° |
| N14 | C26 | H262 | 106.9° | 107.8° |
| H261 | C26 | H262 | 113.2° | 106.3° |
| C29 | C28 | H281 | 109.7° | 106.3° |
| C29 | C28 | H282 | 109.8° | 110.3° |
| C28 | C29 | N31 | 122.1° | 117.9° |
| H281 | C28 | H282 | 109.0° | 106.6° |
| N39 | C41 | H411 | 109.5° | 110.1° |
| N39 | C41 | H412 | 109.5° | 110.2° |
| N39 | C41 | H413 | 109.4° | 110.3° |
| H411 | C41 | H412 | 109.5° | 108.7° |
| H411 | C41 | H413 | 109.5° | 108.8° |
| H412 | C41 | H413 | 109.5° | 108.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | C1 | N2 | O25 | 180.0° | 179.8° |
| C1 | C3 | C11 | C5 | 179.8° | 178.4° |
| C1 | C3 | C5 | C4 | 0.1° | 0.6° |
| C3 | C1 | N2 | C4 | 0.3° | 0.5° |
| C1 | C3 | C5 | C6 | 179.3° | 179.2° |
| C1 | C3 | C11 | C12 | 131.9° | 72.4° |
| C1 | C3 | C11 | C13 | 49.7° | 100.9° |
| C3 | C1 | N2 | HN2 | 179.7° | 179.6° |
| N2 | C1 | C3 | C11 | 179.7° | 178.8° |
| N2 | C1 | C3 | C5 | 0.1° | 0.1° |
| C1 | N2 | C4 | C5 | 0.4° | 0.8° |
| C1 | N2 | C4 | O24 | 179.3° | 178.3° |
| C1 | N2 | C4 | HN2 | 180.0° | 179.1° |
| O25 | C1 | C3 | C11 | 0.2° | 1.4° |
| O25 | C1 | C3 | C5 | 179.9° | 179.9° |
| O25 | C1 | N2 | C4 | 179.7° | 179.3° |
| O25 | C1 | N2 | HN2 | 0.3° | 0.2° |
| C11 | C3 | C5 | C4 | 180.0° | 179.1° |
| C11 | C3 | C5 | C6 | 0.5° | 0.6° |
| C3 | C11 | C12 | C13 | 178.6° | 174.4° |
| C3 | C11 | C12 | N14 | 179.4° | 172.2° |
| C3 | C11 | C12 | H12 | 0.6° | 3.1° |
| C3 | C11 | C13 | C15 | 179.2° | 173.4° |
| C3 | C11 | C13 | C20 | 1.0° | 3.8° |
| C3 | C5 | C4 | C6 | 179.5° | 179.7° |
| C3 | C5 | C4 | O24 | 179.4° | 178.3° |
| C3 | C5 | C4 | N2 | 0.3° | 0.8° |
| C3 | C5 | C6 | C7 | 35.6° | 124.0° |
| C3 | C5 | C6 | C8 | 146.1° | 59.3° |
| C5 | C3 | C11 | C12 | 48.3° | 106.0° |
| C5 | C3 | C11 | C13 | 130.1° | 80.7° |
| C5 | C4 | O24 | N2 | 179.7° | 179.0° |
| C4 | C5 | C6 | C7 | 143.7° | 55.7° |
| C4 | C5 | C6 | C8 | 34.5° | 121.0° |
| C5 | C4 | N2 | HN2 | 179.6° | 179.9° |
| O24 | C4 | C5 | C6 | 1.1° | 1.9° |
| O24 | C4 | N2 | HN2 | 0.7° | 0.8° |
| N2 | C4 | C5 | C6 | 179.2° | 178.9° |
| C5 | C6 | C7 | C8 | 178.6° | 177.1° |
| C5 | C6 | C7 | C9 | 179.4° | 176.5° |
| C5 | C6 | C7 | C16 | 1.4° | 3.0° |
| C5 | C6 | C8 | N10 | 179.6° | 177.7° |
| C5 | C6 | C8 | H8 | 0.4° | 1.2° |
| C6 | C7 | C9 | C16 | 179.3° | 179.6° |
| C7 | C6 | C8 | N10 | 1.1° | 0.4° |
| C7 | C6 | C8 | H8 | 178.9° | 178.4° |
| C6 | C7 | C9 | N10 | 0.3° | 1.5° |
| C6 | C7 | C16 | C17 | 179.1° | 179.1° |
| C6 | C7 | C16 | H16 | 0.9° | 1.0° |
| C6 | C7 | C9 | C18 | 179.4° | 178.8° |
| C8 | C6 | C7 | C9 | 0.8° | 0.7° |
| C8 | C6 | C7 | C16 | 180.0° | 179.8° |
| C6 | C8 | N10 | H8 | 180.0° | 179.0° |
| C6 | C8 | N10 | C35 | 179.1° | 179.1° |
| C6 | C8 | N10 | C9 | 0.9° | 1.4° |
| C7 | C9 | N10 | C8 | 0.4° | 1.9° |
| C7 | C9 | N10 | C35 | 178.4° | 178.7° |
| C7 | C9 | N10 | C18 | 179.7° | 179.6° |
| C9 | C7 | C16 | C17 | 0.0° | 0.4° |
| C9 | C7 | C16 | H16 | 180.0° | 179.6° |
| C7 | C9 | C18 | C19 | 0.0° | 0.6° |
| C7 | C9 | C18 | H18 | 180.0° | 179.9° |
| C16 | C7 | C9 | N10 | 179.6° | 178.9° |
| C7 | C16 | C17 | H16 | 180.0° | 180.0° |
| C7 | C16 | C17 | C19 | 0.2° | 0.1° |
| C7 | C16 | C17 | H17 | 179.8° | 180.0° |
| C16 | C7 | C9 | C18 | 0.1° | 0.8° |
| C8 | N10 | C35 | C9 | 177.8° | 179.4° |
| C8 | N10 | C9 | C18 | 180.0° | 178.5° |
| C8 | N10 | C35 | C36 | 141.5° | 79.9° |
| C8 | N10 | C35 | H351 | 98.5° | 155.4° |
| C8 | N10 | C35 | H352 | 27.9° | 40.2° |
| H8 | C8 | N10 | C35 | 0.9° | 1.9° |
| H8 | C8 | N10 | C9 | 179.1° | 177.6° |
| C35 | N10 | C9 | C18 | 2.0° | 0.9° |
| N10 | C35 | C36 | H351 | 120.0° | 123.1° |
| N10 | C35 | C36 | H352 | 113.6° | 118.1° |
| N10 | C35 | H351 | H352 | 114.8° | 114.7° |
| N10 | C35 | C36 | C38 | 71.5° | 79.3° |
| N10 | C35 | C36 | H361 | 48.5° | 160.9° |
| N10 | C35 | C36 | H362 | 168.2° | 44.6° |
| N10 | C9 | C18 | C19 | 179.6° | 178.9° |
| N10 | C9 | C18 | H18 | 0.4° | 0.5° |
| C9 | N10 | C35 | C36 | 40.7° | 100.7° |
| C9 | N10 | C35 | H351 | 79.3° | 24.0° |
| C9 | N10 | C35 | H352 | 154.3° | 139.2° |
| C11 | C12 | N14 | H12 | 180.0° | 175.8° |
| C11 | C12 | N14 | C15 | 0.7° | 3.0° |
| C12 | C11 | C13 | C15 | 0.6° | 0.8° |
| C12 | C11 | C13 | C20 | 179.7° | 177.9° |
| C11 | C12 | N14 | C26 | 179.6° | 167.3° |
| C13 | C11 | C12 | N14 | 0.8° | 2.3° |
| C13 | C11 | C12 | H12 | 179.2° | 177.5° |
| C11 | C13 | C15 | N14 | 0.1° | 1.0° |
| C11 | C13 | C15 | C22 | 179.5° | 178.8° |
| C11 | C13 | C15 | C20 | 179.8° | 177.7° |
| C11 | C13 | C20 | C21 | 179.3° | 178.8° |
| C11 | C13 | C20 | H20 | 0.7° | 1.2° |
| C12 | N14 | C15 | C26 | 179.7° | 170.0° |
| C12 | N14 | C15 | C22 | 179.9° | 180.0° |
| C12 | N14 | C15 | C13 | 0.4° | 2.5° |
| C12 | N14 | C26 | C27 | 54.2° | 115.1° |
| C12 | N14 | C26 | H261 | 174.2° | 122.4° |
| C12 | N14 | C26 | H262 | 63.7° | 8.7° |
| H12 | C12 | N14 | C15 | 179.3° | 178.8° |
| H12 | C12 | N14 | C26 | 0.4° | 8.6° |
| N14 | C15 | C22 | C13 | 179.5° | 177.2° |
| N14 | C15 | C22 | C23 | 179.7° | 177.5° |
| C15 | N14 | C26 | C27 | 125.4° | 76.2° |
| N14 | C15 | C13 | C20 | 179.9° | 176.7° |
| N14 | C15 | C22 | H22 | 0.3° | 1.9° |
| C15 | N14 | C26 | H261 | 5.4° | 46.3° |
| C15 | N14 | C26 | H262 | 116.7° | 160.0° |
| C15 | C22 | C23 | C21 | 0.2° | 1.0° |
| C15 | C22 | C23 | H22 | 180.0° | 179.4° |
| C15 | C22 | C23 | H23 | 179.8° | 179.8° |
| C22 | C15 | C13 | C20 | 0.3° | 1.1° |
| C22 | C15 | N14 | C26 | 0.4° | 10.0° |
| C15 | C13 | C20 | C21 | 0.4° | 1.9° |
| C13 | C15 | C22 | C23 | 0.2° | 0.3° |
| C15 | C13 | C20 | H20 | 179.6° | 178.1° |
| C13 | C15 | C22 | H22 | 179.8° | 179.1° |
| C13 | C15 | N14 | C26 | 179.9° | 167.5° |
| C16 | C17 | C19 | H17 | 180.0° | 179.8° |
| C16 | C17 | C19 | C18 | 0.3° | 0.3° |
| C16 | C17 | C19 | H19 | 179.7° | 179.9° |
| H16 | C16 | C17 | C19 | 179.8° | 179.9° |
| H16 | C16 | C17 | H17 | 0.2° | 0.1° |
| C17 | C19 | C18 | H19 | 180.0° | 179.8° |
| C17 | C19 | C18 | C9 | 0.2° | 0.1° |
| C17 | C19 | C18 | H18 | 179.8° | 179.5° |
| H17 | C17 | C19 | C18 | 179.7° | 179.9° |
| H17 | C17 | C19 | H19 | 0.3° | 0.1° |
| C19 | C18 | C9 | H18 | 180.0° | 179.4° |
| C9 | C18 | C19 | H19 | 179.8° | 179.8° |
| H18 | C18 | C19 | H19 | 0.2° | 0.3° |
| C23 | C21 | C20 | H21 | 180.0° | 179.4° |
| C21 | C23 | C22 | H23 | 180.0° | 179.2° |
| C23 | C21 | C20 | C13 | 0.4° | 1.2° |
| C23 | C21 | C20 | H20 | 179.6° | 178.7° |
| C21 | C23 | C22 | H22 | 179.8° | 178.4° |
| C20 | C21 | C23 | C22 | 0.3° | 0.3° |
| C20 | C21 | C23 | H23 | 179.7° | 179.5° |
| C21 | C20 | C13 | H20 | 180.0° | 180.0° |
| H21 | C21 | C23 | C22 | 179.7° | 179.1° |
| H21 | C21 | C23 | H23 | 0.3° | 0.1° |
| H21 | C21 | C20 | C13 | 179.6° | 179.4° |
| H21 | C21 | C20 | H20 | 0.4° | 0.6° |
| H23 | C23 | C22 | H22 | 0.2° | 0.8° |
| C28 | C27 | C26 | H271 | 120.0° | 127.3° |
| C28 | C27 | C26 | H272 | 118.6° | 118.2° |
| C28 | C27 | H271 | H272 | 118.7° | 116.4° |
| C27 | C28 | C29 | C30 | 93.2° | 150.5° |
| C28 | C27 | C26 | N14 | 115.3° | 63.9° |
| C28 | C27 | C26 | H261 | 124.7° | 175.2° |
| C28 | C27 | C26 | H262 | 2.6° | 59.0° |
| C27 | C28 | C29 | H281 | 120.0° | 120.0° |
| C27 | C28 | C29 | H282 | 120.2° | 124.8° |
| C27 | C28 | H281 | H282 | 120.3° | 117.8° |
| C27 | C28 | C29 | N31 | 85.5° | 36.5° |
| C26 | C27 | H271 | H272 | 118.7° | 114.9° |
| C27 | C26 | N14 | H261 | 120.0° | 122.4° |
| C27 | C26 | N14 | H262 | 117.9° | 123.8° |
| C27 | C26 | H261 | H262 | 118.1° | 118.4° |
| C26 | C27 | C28 | C29 | 132.0° | 89.5° |
| C26 | C27 | C28 | H281 | 12.0° | 151.6° |
| C26 | C27 | C28 | H282 | 107.8° | 35.7° |
| H271 | C27 | C26 | N14 | 4.7° | 63.4° |
| H271 | C27 | C26 | H261 | 115.3° | 57.5° |
| H271 | C27 | C26 | H262 | 122.6° | 173.7° |
| H271 | C27 | C28 | C29 | 12.0° | 37.4° |
| H271 | C27 | C28 | H281 | 108.0° | 81.6° |
| H271 | C27 | C28 | H282 | 132.2° | 162.5° |
| H272 | C27 | C26 | N14 | 126.1° | 177.9° |
| H272 | C27 | C26 | H261 | 6.1° | 57.0° |
| H272 | C27 | C26 | H262 | 116.0° | 59.2° |
| H272 | C27 | C28 | C29 | 109.4° | 152.9° |
| H272 | C27 | C28 | H281 | 130.6° | 33.9° |
| H272 | C27 | C28 | H282 | 10.8° | 82.0° |
| C29 | C30 | C32 | H30 | 180.0° | 178.1° |
| C29 | C30 | C32 | C34 | 0.6° | 0.1° |
| C29 | C30 | C32 | H32 | 179.4° | 178.5° |
| C30 | C29 | N31 | C33 | 0.2° | 0.4° |
| C30 | C29 | C28 | N31 | 178.7° | 173.0° |
| C30 | C29 | C28 | H281 | 26.8° | 89.5° |
| C30 | C29 | C28 | H282 | 146.5° | 25.7° |
| C30 | C32 | C34 | H32 | 180.0° | 178.6° |
| C30 | C32 | C34 | C33 | 0.4° | 0.3° |
| C30 | C32 | C34 | C37 | 179.8° | 177.9° |
| C32 | C30 | C29 | C28 | 179.3° | 172.6° |
| C32 | C30 | C29 | N31 | 0.5° | 0.1° |
| H30 | C30 | C32 | C34 | 179.4° | 178.2° |
| H30 | C30 | C32 | H32 | 0.6° | 0.4° |
| H30 | C30 | C29 | C28 | 0.7° | 5.5° |
| H30 | C30 | C29 | N31 | 179.5° | 178.2° |
| C32 | C34 | C33 | N39 | 179.6° | 178.0° |
| C32 | C34 | C33 | N31 | 0.0° | 0.8° |
| C32 | C34 | C33 | C37 | 179.4° | 178.2° |
| C32 | C34 | C37 | C38 | 27.0° | 60.9° |
| C32 | C34 | C37 | H371 | 93.0° | 60.1° |
| C32 | C34 | C37 | H372 | 142.4° | 175.7° |
| H32 | C32 | C34 | C33 | 179.6° | 178.9° |
| H32 | C32 | C34 | C37 | 0.2° | 0.7° |
| N39 | C33 | N31 | C34 | 179.6° | 177.3° |
| N39 | C33 | C34 | C37 | 0.2° | 0.2° |
| C33 | N39 | C40 | C41 | 179.3° | 179.4° |
| C33 | N39 | C40 | H401 | 34.1° | 52.7° |
| C33 | N39 | C40 | H402 | 86.0° | 67.3° |
| C33 | N39 | C40 | H403 | 154.1° | 172.7° |
| N39 | C33 | N31 | C29 | 179.7° | 178.1° |
| C33 | N39 | C41 | H411 | 144.4° | 19.6° |
| C33 | N39 | C41 | H412 | 24.4° | 139.6° |
| C33 | N39 | C41 | H413 | 95.6° | 100.4° |
| N31 | C33 | C34 | C37 | 179.4° | 177.4° |
| N31 | C33 | N39 | C40 | 156.6° | 87.4° |
| C33 | N31 | C29 | C28 | 179.0° | 173.2° |
| N31 | C33 | N39 | C41 | 22.6° | 91.9° |
| C33 | C34 | C37 | C38 | 153.6° | 121.0° |
| C33 | C34 | C37 | H371 | 86.4° | 118.0° |
| C33 | C34 | C37 | H372 | 38.2° | 2.4° |
| C34 | C33 | N39 | C40 | 23.0° | 90.0° |
| C34 | C33 | N31 | C29 | 0.0° | 0.8° |
| C34 | C33 | N39 | C41 | 157.8° | 90.7° |
| C34 | C37 | C38 | C36 | 104.1° | 73.2° |
| C34 | C37 | C38 | H371 | 120.0° | 120.3° |
| C34 | C37 | C38 | H372 | 115.4° | 123.7° |
| C34 | C37 | H371 | H372 | 116.0° | 118.1° |
| C34 | C37 | C38 | H381 | 135.9° | 51.0° |
| C34 | C37 | C38 | H382 | 13.2° | 166.9° |
| C36 | C35 | H351 | H352 | 114.7° | 120.4° |
| C35 | C36 | C38 | H361 | 120.0° | 120.1° |
| C35 | C36 | C38 | H362 | 120.4° | 123.2° |
| C35 | C36 | H361 | H362 | 120.4° | 118.3° |
| C35 | C36 | C38 | C37 | 132.1° | 165.3° |
| C35 | C36 | C38 | H381 | 107.9° | 41.8° |
| C35 | C36 | C38 | H382 | 14.7° | 74.5° |
| H351 | C35 | C36 | C38 | 168.5° | 43.8° |
| H351 | C35 | C36 | H361 | 71.5° | 76.0° |
| H351 | C35 | C36 | H362 | 48.2° | 167.6° |
| H352 | C35 | C36 | C38 | 42.1° | 162.6° |
| H352 | C35 | C36 | H361 | 162.1° | 42.8° |
| H352 | C35 | C36 | H362 | 78.2° | 73.5° |
| C38 | C36 | H361 | H362 | 120.3° | 119.4° |
| C36 | C38 | C37 | H381 | 120.0° | 124.2° |
| C36 | C38 | C37 | H382 | 117.3° | 119.9° |
| C36 | C38 | C37 | H371 | 135.9° | 166.6° |
| C36 | C38 | C37 | H372 | 11.3° | 50.5° |
| C36 | C38 | H381 | H382 | 117.6° | 117.5° |
| H361 | C36 | C38 | C37 | 12.1° | 74.6° |
| H361 | C36 | C38 | H381 | 132.1° | 161.9° |
| H361 | C36 | C38 | H382 | 105.3° | 45.6° |
| H362 | C36 | C38 | C37 | 107.5° | 42.0° |
| H362 | C36 | C38 | H381 | 12.5° | 81.4° |
| H362 | C36 | C38 | H382 | 135.1° | 162.3° |
| C38 | C37 | H371 | H372 | 116.0° | 118.2° |
| C37 | C38 | H381 | H382 | 117.6° | 117.4° |
| H371 | C37 | C38 | H381 | 15.9° | 69.2° |
| H371 | C37 | C38 | H382 | 106.8° | 46.7° |
| H372 | C37 | C38 | H381 | 108.7° | 174.7° |
| H372 | C37 | C38 | H382 | 128.6° | 69.4° |
| N39 | C40 | H401 | H402 | 120.0° | 120.8° |
| N39 | C40 | H401 | H403 | 120.0° | 120.9° |
| N39 | C40 | H402 | H403 | 120.0° | 120.9° |
| C40 | N39 | C41 | H411 | 35.0° | 159.7° |
| C40 | N39 | C41 | H412 | 155.0° | 39.8° |
| C40 | N39 | C41 | H413 | 85.0° | 80.2° |
| H401 | C40 | H402 | H403 | 120.0° | 118.4° |
| H401 | C40 | N39 | C41 | 146.6° | 126.6° |
| H402 | C40 | N39 | C41 | 93.4° | 113.4° |
| H403 | C40 | N39 | C41 | 26.6° | 6.6° |
| N14 | C26 | H261 | H262 | 118.1° | 114.8° |
| C29 | C28 | H281 | H282 | 120.3° | 117.7° |
| H281 | C28 | C29 | N31 | 154.5° | 83.5° |
| H282 | C28 | C29 | N31 | 34.7° | 161.3° |
| N39 | C41 | H411 | H412 | 120.0° | 120.9° |
| N39 | C41 | H411 | H413 | 120.0° | 120.9° |
| N39 | C41 | H412 | H413 | 120.0° | 120.9° |
| H411 | C41 | H412 | H413 | 120.0° | 118.3° |
