YGE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.50Å | 1.50Å | |
| N1 | C3 | sing | 1.49Å | 1.52Å | |
| N1 | C11 | sing | 1.35Å | 1.39Å | |
| C2 | C5 | sing | 1.51Å | 1.52Å | |
| C3 | C4 | sing | 1.49Å | 1.53Å | |
| C4 | C5 | sing | 1.58Å | 1.56Å | |
| C4 | C8 | sing | 1.50Å | 1.54Å | |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| C6 | N7 | sing | 1.50Å | 1.48Å | |
| N7 | C8 | sing | 1.49Å | 1.51Å | |
| N7 | C22 | sing | 1.35Å | 1.41Å | |
| C11 | C12 | sing | 1.48Å | 1.51Å | |
| C11 | O13 | doub | 1.22Å | 1.23Å | |
| C12 | C14 | doub | 1.40Å | 1.44Å | Aromatic |
| C12 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.36Å | 1.38Å | Aromatic |
| C15 | C18 | doub | 1.39Å | 1.40Å | Aromatic |
| C16 | C17 | doub | 1.40Å | 1.41Å | Aromatic |
| C17 | C18 | sing | 1.41Å | 1.44Å | Aromatic |
| C17 | N21 | sing | 1.35Å | 1.40Å | Aromatic |
| C18 | N19 | sing | 1.37Å | 1.41Å | Aromatic |
| N19 | N20 | sing | 1.40Å | 1.35Å | Aromatic |
| N20 | N21 | doub | 1.29Å | 1.31Å | Aromatic |
| C22 | O23 | doub | 1.22Å | 1.25Å | |
| C22 | O24 | sing | 1.35Å | 1.41Å | |
| O24 | C25 | sing | 1.45Å | 1.41Å | |
| C25 | C26 | sing | 1.51Å | 1.53Å | |
| C26 | C27 | doub | 1.39Å | 1.46Å | Aromatic |
| C26 | C31 | sing | 1.38Å | 1.40Å | Aromatic |
| C27 | C28 | sing | 1.39Å | 1.41Å | Aromatic |
| C27 | O32 | sing | 1.36Å | 1.38Å | |
| C28 | C29 | doub | 1.40Å | 1.40Å | Aromatic |
| C29 | C30 | sing | 1.40Å | 1.38Å | Aromatic |
| C29 | C35 | sing | 1.43Å | 1.40Å | |
| C30 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| O32 | C33 | sing | 1.43Å | 1.44Å | |
| C33 | C34 | sing | 1.53Å | 1.53Å | |
| C35 | N36 | trip | 1.14Å | 1.15Å | |
| C15 | H46 | sing | 1.08Å | 1.08Å | |
| C16 | H47 | sing | 1.08Å | 1.08Å | |
| C25 | H49 | sing | 1.09Å | 1.10Å | |
| C25 | H50 | sing | 1.09Å | 1.10Å | |
| C28 | H51 | sing | 1.08Å | 1.08Å | |
| C2 | H38 | sing | 1.09Å | 1.10Å | |
| C2 | H37 | sing | 1.09Å | 1.10Å | |
| C3 | H39 | sing | 1.09Å | 1.10Å | |
| C3 | H40 | sing | 1.09Å | 1.10Å | |
| C4 | H10 | sing | 1.09Å | 1.10Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H42 | sing | 1.09Å | 1.10Å | |
| C6 | H41 | sing | 1.09Å | 1.10Å | |
| C8 | H43 | sing | 1.09Å | 1.10Å | |
| C8 | H44 | sing | 1.09Å | 1.10Å | |
| C14 | H45 | sing | 1.08Å | 1.08Å | |
| N19 | H48 | sing | 0.97Å | 1.00Å | |
| C30 | H52 | sing | 1.08Å | 1.08Å | |
| C31 | H53 | sing | 1.08Å | 1.08Å | |
| C33 | H54 | sing | 1.09Å | 1.10Å | |
| C33 | H55 | sing | 1.09Å | 1.10Å | |
| C34 | H57 | sing | 1.09Å | 1.10Å | |
| C34 | H56 | sing | 1.09Å | 1.10Å | |
| C34 | H58 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C3 | 111.2° | 107.8° |
| C2 | N1 | C11 | 123.7° | 126.1° |
| N1 | C2 | C5 | 98.1° | 102.4° |
| N1 | C2 | H38 | 112.2° | 110.8° |
| N1 | C2 | H37 | 112.2° | 110.8° |
| C3 | N1 | C11 | 121.4° | 126.1° |
| N1 | C3 | C4 | 101.4° | 104.6° |
| N1 | C3 | H39 | 111.4° | 110.4° |
| N1 | C3 | H40 | 111.5° | 110.4° |
| N1 | C11 | C12 | 125.4° | 120.0° |
| N1 | C11 | O13 | 116.7° | 120.0° |
| C2 | C5 | C4 | 100.9° | 97.8° |
| C2 | C5 | C6 | 125.9° | 124.1° |
| C5 | C2 | H38 | 112.2° | 110.8° |
| C5 | C2 | H37 | 112.2° | 110.9° |
| C2 | C5 | H9 | 109.2° | 111.3° |
| C3 | C4 | C5 | 99.2° | 100.7° |
| C3 | C4 | C8 | 126.3° | 129.2° |
| C4 | C3 | H39 | 111.5° | 110.4° |
| C4 | C3 | H40 | 111.4° | 110.4° |
| C3 | C4 | H10 | 109.0° | 108.6° |
| C5 | C4 | C8 | 103.2° | 100.7° |
| C4 | C5 | C6 | 100.9° | 97.8° |
| C5 | C4 | H10 | 108.6° | 107.6° |
| C4 | C5 | H9 | 108.8° | 111.8° |
| C4 | C8 | N7 | 101.0° | 104.6° |
| C8 | C4 | H10 | 108.8° | 107.9° |
| C4 | C8 | H43 | 111.6° | 110.4° |
| C4 | C8 | H44 | 111.5° | 110.4° |
| C5 | C6 | N7 | 99.6° | 102.4° |
| C6 | C5 | H9 | 109.5° | 111.7° |
| C5 | C6 | H42 | 111.9° | 110.8° |
| C5 | C6 | H41 | 111.9° | 110.8° |
| C6 | N7 | C8 | 112.1° | 107.8° |
| C6 | N7 | C22 | 117.9° | 126.2° |
| N7 | C6 | H42 | 111.9° | 110.8° |
| N7 | C6 | H41 | 111.9° | 110.8° |
| C8 | N7 | C22 | 123.4° | 126.1° |
| N7 | C8 | H43 | 111.6° | 110.4° |
| N7 | C8 | H44 | 111.6° | 110.4° |
| N7 | C22 | O23 | 124.8° | 120.0° |
| N7 | C22 | O24 | 111.3° | 120.1° |
| C12 | C11 | O13 | 117.8° | 120.0° |
| C11 | C12 | C14 | 114.3° | 119.9° |
| C11 | C12 | C16 | 123.7° | 119.8° |
| C14 | C12 | C16 | 121.9° | 120.3° |
| C12 | C14 | C15 | 123.0° | 120.5° |
| C12 | C14 | H45 | 118.5° | 119.8° |
| C12 | C16 | C17 | 115.5° | 119.5° |
| C12 | C16 | H47 | 122.3° | 120.3° |
| C14 | C15 | C18 | 116.1° | 120.1° |
| C14 | C15 | H46 | 121.9° | 120.0° |
| C15 | C14 | H45 | 118.5° | 119.7° |
| C15 | C18 | C17 | 121.4° | 120.2° |
| C15 | C18 | N19 | 132.9° | 133.7° |
| C18 | C15 | H46 | 122.0° | 119.9° |
| C16 | C17 | C18 | 122.1° | 119.4° |
| C16 | C17 | N21 | 132.5° | 133.0° |
| C17 | C16 | H47 | 122.2° | 120.2° |
| C18 | C17 | N21 | 105.4° | 107.6° |
| C17 | C18 | N19 | 105.7° | 106.1° |
| C17 | N21 | N20 | 109.9° | 110.1° |
| C18 | N19 | N20 | 108.0° | 106.7° |
| C18 | N19 | H48 | 126.0° | 126.6° |
| N19 | N20 | N21 | 111.0° | 109.5° |
| N20 | N19 | H48 | 126.0° | 126.7° |
| O23 | C22 | O24 | 123.9° | 120.0° |
| C22 | O24 | C25 | 116.2° | 117.0° |
| O24 | C25 | C26 | 119.6° | 109.5° |
| O24 | C25 | H49 | 106.9° | 109.5° |
| O24 | C25 | H50 | 106.9° | 109.5° |
| C25 | C26 | C27 | 123.9° | 119.9° |
| C25 | C26 | C31 | 118.5° | 119.9° |
| C26 | C25 | H49 | 106.9° | 109.5° |
| C26 | C25 | H50 | 106.9° | 109.5° |
| C27 | C26 | C31 | 117.5° | 120.2° |
| C26 | C27 | C28 | 119.6° | 120.1° |
| C26 | C27 | O32 | 117.5° | 120.0° |
| C26 | C31 | C30 | 122.8° | 120.2° |
| C26 | C31 | H53 | 118.6° | 119.9° |
| C28 | C27 | O32 | 122.9° | 119.9° |
| C27 | C28 | C29 | 119.0° | 119.7° |
| C27 | C28 | H51 | 120.5° | 120.1° |
| C27 | O32 | C33 | 116.6° | 117.0° |
| C28 | C29 | C30 | 122.5° | 119.8° |
| C28 | C29 | C35 | 119.2° | 120.1° |
| C29 | C28 | H51 | 120.5° | 120.2° |
| C30 | C29 | C35 | 118.3° | 120.1° |
| C29 | C30 | C31 | 118.6° | 119.9° |
| C29 | C30 | H52 | 120.7° | 120.1° |
| C29 | C35 | N36 | 178.9° | 180.0° |
| C31 | C30 | H52 | 120.7° | 120.0° |
| C30 | C31 | H53 | 118.6° | 119.9° |
| O32 | C33 | C34 | 105.1° | 109.5° |
| O32 | C33 | H54 | 110.6° | 109.5° |
| O32 | C33 | H55 | 110.5° | 109.5° |
| C34 | C33 | H54 | 110.5° | 109.5° |
| C34 | C33 | H55 | 110.6° | 109.4° |
| C33 | C34 | H57 | 109.5° | 109.5° |
| C33 | C34 | H56 | 109.5° | 109.5° |
| C33 | C34 | H58 | 109.4° | 109.5° |
| H49 | C25 | H50 | 109.5° | 109.4° |
| H38 | C2 | H37 | 109.5° | 110.9° |
| H39 | C3 | H40 | 109.5° | 110.5° |
| H42 | C6 | H41 | 109.5° | 110.9° |
| H43 | C8 | H44 | 109.5° | 110.5° |
| H54 | C33 | H55 | 109.5° | 109.5° |
| H57 | C34 | H56 | 109.4° | 109.4° |
| H57 | C34 | H58 | 109.4° | 109.4° |
| H56 | C34 | H58 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | C3 | C11 | 159.0° | 179.7° |
| N1 | C2 | C5 | H38 | 118.1° | 118.2° |
| N1 | C2 | C5 | H37 | 118.1° | 118.2° |
| C2 | N1 | C3 | C4 | 8.5° | 6.7° |
| N1 | C2 | C5 | C4 | 46.8° | 45.7° |
| N1 | C2 | C5 | C6 | 158.9° | 150.6° |
| C2 | N1 | C11 | C12 | 3.5° | 175.5° |
| C2 | N1 | C11 | O13 | 178.4° | 4.1° |
| N1 | C2 | H38 | H37 | 125.3° | 123.5° |
| C2 | N1 | C3 | H39 | 127.2° | 125.5° |
| C2 | N1 | C3 | H40 | 110.2° | 112.0° |
| N1 | C2 | C5 | H9 | 67.6° | 71.5° |
| C3 | N1 | C2 | C5 | 24.2° | 25.9° |
| N1 | C3 | C4 | H39 | 118.6° | 118.8° |
| N1 | C3 | C4 | H40 | 118.7° | 118.8° |
| N1 | C3 | C4 | C5 | 36.8° | 35.0° |
| N1 | C3 | C4 | C8 | 150.7° | 148.4° |
| C3 | N1 | C11 | C12 | 152.8° | 4.2° |
| C3 | N1 | C11 | O13 | 25.3° | 176.2° |
| C3 | N1 | C2 | H38 | 142.3° | 144.0° |
| C3 | N1 | C2 | H37 | 93.9° | 92.4° |
| N1 | C3 | H39 | H40 | 123.8° | 122.4° |
| N1 | C3 | C4 | H10 | 76.6° | 77.8° |
| C11 | N1 | C2 | C5 | 177.4° | 154.4° |
| C11 | N1 | C3 | C4 | 150.5° | 173.0° |
| N1 | C11 | C12 | O13 | 178.1° | 179.7° |
| N1 | C11 | C12 | C14 | 125.2° | 33.8° |
| N1 | C11 | C12 | C16 | 58.2° | 146.7° |
| C11 | N1 | C2 | H38 | 59.3° | 36.2° |
| C11 | N1 | C2 | H37 | 64.5° | 87.4° |
| C11 | N1 | C3 | H39 | 31.8° | 54.2° |
| C11 | N1 | C3 | H40 | 90.8° | 68.2° |
| C2 | C5 | C4 | C3 | 53.9° | 50.1° |
| C2 | C5 | C4 | C6 | 130.1° | 126.2° |
| C2 | C5 | C4 | H9 | 114.8° | 116.7° |
| C2 | C5 | C4 | C8 | 175.3° | 176.2° |
| C2 | C5 | C6 | H9 | 133.3° | 137.8° |
| C2 | C5 | C6 | N7 | 157.7° | 150.6° |
| C5 | C2 | H38 | H37 | 125.3° | 123.5° |
| C2 | C5 | C4 | H10 | 59.9° | 63.5° |
| C2 | C5 | C6 | H42 | 83.9° | 91.2° |
| C2 | C5 | C6 | H41 | 39.4° | 32.3° |
| C3 | C4 | C5 | C8 | 130.9° | 133.7° |
| C3 | C4 | C5 | H10 | 113.7° | 113.6° |
| C3 | C4 | C8 | H10 | 132.7° | 134.0° |
| C3 | C4 | C5 | C6 | 176.0° | 176.3° |
| C3 | C4 | C8 | N7 | 136.9° | 148.4° |
| C4 | C3 | H39 | H40 | 123.8° | 122.4° |
| C3 | C4 | C5 | H9 | 60.9° | 66.6° |
| C3 | C4 | C8 | H43 | 104.5° | 92.8° |
| C3 | C4 | C8 | H44 | 18.3° | 29.6° |
| C5 | C4 | C8 | H10 | 115.2° | 112.6° |
| C4 | C5 | C6 | H9 | 114.6° | 117.3° |
| C4 | C5 | C6 | N7 | 45.6° | 45.7° |
| C5 | C4 | C8 | N7 | 24.8° | 35.0° |
| C4 | C5 | C2 | H38 | 164.9° | 163.9° |
| C4 | C5 | C2 | H37 | 71.3° | 72.6° |
| C5 | C4 | C3 | H39 | 155.4° | 153.8° |
| C5 | C4 | C3 | H40 | 81.9° | 83.7° |
| C4 | C5 | C6 | H42 | 164.0° | 163.9° |
| C4 | C5 | C6 | H41 | 72.7° | 72.6° |
| C5 | C4 | C8 | H43 | 143.5° | 153.8° |
| C5 | C4 | C8 | H44 | 93.8° | 83.8° |
| C8 | C4 | C5 | C6 | 45.1° | 50.1° |
| C4 | C8 | N7 | C6 | 4.1° | 6.7° |
| C4 | C8 | N7 | H43 | 118.6° | 118.8° |
| C4 | C8 | N7 | H44 | 118.6° | 118.7° |
| C4 | C8 | N7 | C22 | 154.9° | 173.2° |
| C8 | C4 | C3 | H39 | 90.6° | 92.8° |
| C8 | C4 | C3 | H40 | 32.0° | 29.7° |
| C8 | C4 | C5 | H9 | 70.0° | 67.1° |
| C4 | C8 | H43 | H44 | 123.9° | 122.4° |
| C5 | C6 | N7 | H42 | 118.3° | 118.2° |
| C5 | C6 | N7 | H41 | 118.4° | 118.2° |
| C5 | C6 | N7 | C8 | 32.0° | 25.9° |
| C5 | C6 | N7 | C22 | 175.4° | 154.2° |
| C6 | C5 | C2 | H38 | 83.0° | 91.2° |
| C6 | C5 | C2 | H37 | 40.9° | 32.3° |
| C6 | C5 | C4 | H10 | 70.3° | 62.7° |
| C5 | C6 | H42 | H41 | 124.7° | 123.5° |
| C6 | N7 | C8 | C22 | 150.7° | 180.0° |
| C6 | N7 | C22 | O23 | 149.5° | 0.0° |
| C6 | N7 | C22 | O24 | 31.1° | 180.0° |
| N7 | C6 | C5 | H9 | 68.9° | 71.6° |
| N7 | C6 | H42 | H41 | 124.6° | 123.5° |
| C6 | N7 | C8 | H43 | 114.5° | 125.5° |
| C6 | N7 | C8 | H44 | 122.7° | 112.0° |
| C8 | N7 | C22 | O23 | 0.3° | 180.0° |
| C8 | N7 | C22 | O24 | 179.8° | 0.0° |
| N7 | C8 | C4 | H10 | 90.4° | 77.6° |
| C8 | N7 | C6 | H42 | 150.4° | 144.1° |
| C8 | N7 | C6 | H41 | 86.3° | 92.3° |
| N7 | C8 | H43 | H44 | 124.0° | 122.4° |
| N7 | C22 | O23 | O24 | 179.4° | 180.0° |
| N7 | C22 | O24 | C25 | 179.7° | 180.0° |
| C22 | N7 | C6 | H42 | 57.1° | 36.0° |
| C22 | N7 | C6 | H41 | 66.2° | 87.6° |
| C22 | N7 | C8 | H43 | 36.2° | 54.4° |
| C22 | N7 | C8 | H44 | 86.5° | 68.0° |
| C11 | C12 | C14 | C16 | 176.7° | 179.5° |
| C11 | C12 | C14 | C15 | 178.7° | 180.0° |
| C11 | C12 | C16 | C17 | 178.2° | 179.7° |
| C11 | C12 | C16 | H47 | 1.9° | 0.3° |
| C11 | C12 | C14 | H45 | 1.3° | 0.0° |
| O13 | C11 | C12 | C14 | 56.7° | 146.6° |
| O13 | C11 | C12 | C16 | 119.9° | 32.9° |
| C12 | C14 | C15 | H45 | 180.0° | 180.0° |
| C12 | C14 | C15 | C18 | 1.2° | 0.0° |
| C14 | C12 | C16 | C17 | 1.8° | 0.8° |
| C12 | C14 | C15 | H46 | 178.8° | 179.7° |
| C14 | C12 | C16 | H47 | 178.2° | 179.8° |
| C16 | C12 | C14 | C15 | 2.0° | 0.5° |
| C12 | C16 | C17 | H47 | 180.0° | 179.4° |
| C12 | C16 | C17 | C18 | 1.0° | 0.6° |
| C12 | C16 | C17 | N21 | 179.1° | 179.5° |
| C16 | C12 | C14 | H45 | 178.0° | 179.5° |
| C14 | C15 | C18 | H46 | 180.0° | 179.8° |
| C14 | C15 | C18 | C17 | 0.4° | 0.2° |
| C14 | C15 | C18 | N19 | 179.2° | 179.7° |
| C15 | C18 | C17 | C16 | 0.4° | 0.1° |
| C15 | C18 | C17 | N19 | 179.7° | 179.9° |
| C15 | C18 | C17 | N21 | 179.8° | 180.0° |
| C15 | C18 | N19 | N20 | 179.6° | 180.0° |
| C18 | C15 | C14 | H45 | 178.8° | 179.9° |
| C15 | C18 | N19 | H48 | 0.4° | 0.1° |
| C16 | C17 | C18 | N21 | 179.9° | 179.9° |
| C16 | C17 | C18 | N19 | 179.4° | 180.0° |
| C16 | C17 | N21 | N20 | 178.9° | 179.9° |
| C17 | C18 | N19 | N20 | 0.1° | 0.1° |
| C18 | C17 | N21 | N20 | 1.0° | 0.0° |
| C17 | C18 | C15 | H46 | 179.6° | 179.9° |
| C18 | C17 | C16 | H47 | 179.0° | 180.0° |
| C17 | C18 | N19 | H48 | 179.9° | 180.0° |
| N21 | C17 | C18 | N19 | 0.5° | 0.1° |
| C17 | N21 | N20 | N19 | 1.1° | 0.0° |
| N21 | C17 | C16 | H47 | 0.9° | 0.1° |
| C18 | N19 | N20 | H48 | 180.0° | 180.0° |
| C18 | N19 | N20 | N21 | 0.8° | 0.1° |
| N19 | C18 | C15 | H46 | 0.8° | 0.1° |
| N21 | N20 | N19 | H48 | 179.3° | 180.0° |
| O23 | C22 | O24 | C25 | 0.2° | 0.0° |
| C22 | O24 | C25 | C26 | 178.8° | 180.0° |
| C22 | O24 | C25 | H49 | 57.3° | 60.0° |
| C22 | O24 | C25 | H50 | 59.8° | 60.0° |
| O24 | C25 | C26 | H49 | 121.4° | 120.0° |
| O24 | C25 | C26 | H50 | 121.4° | 120.0° |
| O24 | C25 | C26 | C27 | 51.4° | 180.0° |
| O24 | C25 | C26 | C31 | 131.5° | 0.3° |
| O24 | C25 | H49 | H50 | 115.4° | 120.0° |
| C25 | C26 | C27 | C31 | 177.1° | 179.7° |
| C25 | C26 | C27 | C28 | 177.9° | 180.0° |
| C25 | C26 | C27 | O32 | 2.1° | 0.0° |
| C25 | C26 | C31 | C30 | 178.1° | 179.8° |
| C26 | C25 | H49 | H50 | 115.4° | 120.0° |
| C25 | C26 | C31 | H53 | 1.9° | 0.0° |
| C26 | C27 | C28 | O32 | 179.9° | 180.0° |
| C26 | C27 | C28 | C29 | 0.3° | 0.1° |
| C27 | C26 | C31 | C30 | 0.8° | 0.5° |
| C26 | C27 | O32 | C33 | 179.8° | 180.0° |
| C27 | C26 | C25 | H49 | 172.8° | 60.0° |
| C27 | C26 | C25 | H50 | 70.0° | 60.0° |
| C26 | C27 | C28 | H51 | 179.7° | 180.0° |
| C27 | C26 | C31 | H53 | 179.2° | 179.7° |
| C31 | C26 | C27 | C28 | 0.8° | 0.3° |
| C31 | C26 | C27 | O32 | 179.3° | 179.7° |
| C26 | C31 | C30 | C29 | 0.3° | 0.5° |
| C26 | C31 | C30 | H53 | 180.0° | 179.7° |
| C31 | C26 | C25 | H49 | 10.0° | 119.7° |
| C31 | C26 | C25 | H50 | 107.1° | 120.3° |
| C26 | C31 | C30 | H52 | 179.7° | 179.7° |
| C27 | C28 | C29 | H51 | 180.0° | 179.9° |
| C27 | C28 | C29 | C30 | 0.2° | 0.1° |
| C27 | C28 | C29 | C35 | 179.7° | 180.0° |
| C28 | C27 | O32 | C33 | 0.1° | 0.0° |
| O32 | C27 | C28 | C29 | 179.8° | 179.9° |
| C27 | O32 | C33 | C34 | 165.8° | 180.0° |
| O32 | C27 | C28 | H51 | 0.2° | 0.0° |
| C27 | O32 | C33 | H54 | 46.5° | 60.0° |
| C27 | O32 | C33 | H55 | 74.9° | 60.0° |
| C28 | C29 | C30 | C35 | 179.4° | 179.9° |
| C28 | C29 | C30 | C31 | 0.3° | 0.3° |
| C28 | C29 | C35 | N36 | 166.7° | 132.0° |
| C28 | C29 | C30 | H52 | 179.7° | 179.9° |
| C29 | C30 | C31 | H52 | 180.0° | 179.8° |
| C30 | C29 | C35 | N36 | 13.8° | 48.1° |
| C30 | C29 | C28 | H51 | 179.7° | 180.0° |
| C29 | C30 | C31 | H53 | 179.7° | 179.7° |
| C35 | C29 | C30 | C31 | 179.7° | 179.8° |
| C35 | C29 | C28 | H51 | 0.3° | 0.1° |
| C35 | C29 | C30 | H52 | 0.3° | 0.0° |
| O32 | C33 | C34 | H54 | 119.3° | 120.0° |
| O32 | C33 | C34 | H55 | 119.3° | 120.0° |
| O32 | C33 | H54 | H55 | 122.0° | 120.0° |
| O32 | C33 | C34 | H57 | 180.0° | 180.0° |
| O32 | C33 | C34 | H56 | 60.0° | 60.0° |
| O32 | C33 | C34 | H58 | 60.0° | 60.0° |
| C34 | C33 | H54 | H55 | 122.0° | 119.9° |
| C33 | C34 | H57 | H56 | 120.0° | 120.0° |
| C33 | C34 | H57 | H58 | 120.0° | 120.0° |
| C33 | C34 | H56 | H58 | 120.0° | 120.0° |
| H46 | C15 | C14 | H45 | 1.2° | 0.3° |
| H38 | C2 | C5 | H9 | 50.5° | 46.7° |
| H37 | C2 | C5 | H9 | 174.3° | 170.3° |
| H39 | C3 | C4 | H10 | 42.0° | 41.0° |
| H40 | C3 | C4 | H10 | 164.7° | 163.4° |
| H10 | C4 | C5 | H9 | 174.7° | 179.8° |
| H10 | C4 | C8 | H43 | 28.2° | 41.2° |
| H10 | C4 | C8 | H44 | 151.0° | 163.7° |
| H9 | C5 | C6 | H42 | 49.4° | 46.6° |
| H9 | C5 | C6 | H41 | 172.7° | 170.1° |
| H52 | C30 | C31 | H53 | 0.3° | 0.0° |
| H54 | C33 | C34 | H57 | 60.7° | 60.0° |
| H54 | C33 | C34 | H56 | 179.3° | 180.0° |
| H54 | C33 | C34 | H58 | 59.3° | 60.0° |
| H55 | C33 | C34 | H57 | 60.7° | 60.0° |
| H55 | C33 | C34 | H56 | 59.3° | 60.0° |
| H55 | C33 | C34 | H58 | 179.3° | 180.0° |
| H57 | C34 | H56 | H58 | 120.0° | 119.9° |
