ODY
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C26 | C25 | sing | 1.54Å | 1.56Å | |
C26 | N23 | sing | 1.48Å | 1.49Å | |
C27 | C25 | sing | 1.53Å | 1.54Å | |
C27 | F28 | sing | 1.40Å | 1.40Å | |
C25 | C24 | sing | 1.54Å | 1.56Å | |
N23 | C22 | sing | 1.47Å | 1.47Å | |
N23 | C24 | sing | 1.47Å | 1.49Å | |
C22 | C21 | sing | 1.53Å | 1.49Å | |
O20 | C21 | sing | 1.43Å | 1.42Å | |
O20 | C17 | sing | 1.36Å | 1.38Å | |
C10 | C11 | doub | 1.38Å | 1.38Å | Aromatic |
C10 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
C16 | C17 | doub | 1.39Å | 1.38Å | Aromatic |
C16 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
C11 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
C9 | C8 | doub | 1.39Å | 1.40Å | Aromatic |
C17 | C18 | sing | 1.39Å | 1.38Å | Aromatic |
C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
C12 | O13 | sing | 1.36Å | 1.36Å | |
C12 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
C8 | C7 | sing | 1.40Å | 1.39Å | Aromatic |
C8 | C2 | sing | 1.47Å | 1.46Å | |
C1 | C2 | sing | 1.51Å | 1.50Å | |
C7 | O6 | sing | 1.36Å | 1.37Å | |
C2 | C3 | doub | 1.35Å | 1.35Å | |
C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
C14 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
C14 | C4 | sing | 1.51Å | 1.51Å | |
C30 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
C30 | C29 | sing | 1.40Å | 1.39Å | Aromatic |
C3 | C4 | sing | 1.51Å | 1.51Å | |
C3 | C29 | sing | 1.47Å | 1.48Å | |
O6 | C4 | sing | 1.43Å | 1.45Å | |
C31 | C32 | sing | 1.38Å | 1.38Å | Aromatic |
C29 | C34 | doub | 1.40Å | 1.39Å | Aromatic |
C32 | C33 | doub | 1.39Å | 1.39Å | Aromatic |
C34 | C33 | sing | 1.39Å | 1.39Å | Aromatic |
C33 | O35 | sing | 1.36Å | 1.36Å | |
C4 | H5 | sing | 1.09Å | 1.10Å | |
C11 | H41 | sing | 1.08Å | 1.08Å | |
C9 | H39 | sing | 1.08Å | 1.08Å | |
C10 | H40 | sing | 1.08Å | 1.08Å | |
C1 | H38 | sing | 1.09Å | 1.10Å | |
C1 | H37 | sing | 1.09Å | 1.10Å | |
C1 | H36 | sing | 1.09Å | 1.10Å | |
O13 | H42 | sing | 0.97Å | 0.95Å | |
C15 | H43 | sing | 1.08Å | 1.08Å | |
C16 | H44 | sing | 1.08Å | 1.08Å | |
C18 | H45 | sing | 1.08Å | 1.08Å | |
C19 | H46 | sing | 1.08Å | 1.08Å | |
C21 | H48 | sing | 1.09Å | 1.10Å | |
C21 | H47 | sing | 1.09Å | 1.10Å | |
C22 | H50 | sing | 1.09Å | 1.10Å | |
C22 | H49 | sing | 1.09Å | 1.10Å | |
C24 | H51 | sing | 1.09Å | 1.10Å | |
C24 | H52 | sing | 1.09Å | 1.10Å | |
C25 | H53 | sing | 1.09Å | 1.10Å | |
C26 | H55 | sing | 1.09Å | 1.10Å | |
C26 | H54 | sing | 1.09Å | 1.10Å | |
C27 | H57 | sing | 1.09Å | 1.10Å | |
C27 | H56 | sing | 1.09Å | 1.10Å | |
C30 | H58 | sing | 1.08Å | 1.08Å | |
C31 | H59 | sing | 1.08Å | 1.08Å | |
C32 | H60 | sing | 1.08Å | 1.08Å | |
C34 | H61 | sing | 1.08Å | 1.08Å | |
O35 | H62 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C25 | C26 | N23 | 89.9° | 87.9° |
C26 | C25 | C27 | 115.5° | 114.3° |
C26 | C25 | C24 | 87.1° | 83.6° |
C26 | C25 | H53 | 112.6° | 114.1° |
C25 | C26 | H55 | 114.1° | 113.5° |
C25 | C26 | H54 | 114.1° | 113.5° |
C26 | N23 | C22 | 116.8° | 111.0° |
C26 | N23 | C24 | 92.1° | 87.8° |
N23 | C26 | H55 | 114.1° | 113.5° |
N23 | C26 | H54 | 114.1° | 113.5° |
C25 | C27 | F28 | 110.9° | 109.5° |
C27 | C25 | C24 | 113.6° | 114.2° |
C27 | C25 | H53 | 112.9° | 113.3° |
C25 | C27 | H57 | 109.1° | 109.5° |
C25 | C27 | H56 | 109.1° | 109.5° |
F28 | C27 | H57 | 109.1° | 109.5° |
F28 | C27 | H56 | 109.1° | 109.5° |
C25 | C24 | N23 | 90.2° | 88.0° |
C25 | C24 | H51 | 114.1° | 113.5° |
C25 | C24 | H52 | 114.0° | 113.5° |
C24 | C25 | H53 | 112.7° | 114.2° |
C22 | N23 | C24 | 113.6° | 111.0° |
N23 | C22 | C21 | 111.4° | 109.5° |
N23 | C22 | H50 | 109.0° | 109.5° |
N23 | C22 | H49 | 109.0° | 109.4° |
N23 | C24 | H51 | 114.1° | 113.5° |
N23 | C24 | H52 | 114.1° | 113.4° |
C22 | C21 | O20 | 105.6° | 109.5° |
C22 | C21 | H48 | 110.4° | 109.4° |
C22 | C21 | H47 | 110.4° | 109.5° |
C21 | C22 | H50 | 109.0° | 109.5° |
C21 | C22 | H49 | 109.0° | 109.5° |
C21 | O20 | C17 | 118.7° | 117.0° |
O20 | C21 | H48 | 110.4° | 109.5° |
O20 | C21 | H47 | 110.4° | 109.5° |
O20 | C17 | C16 | 112.4° | 120.0° |
O20 | C17 | C18 | 127.4° | 120.1° |
C11 | C10 | C9 | 120.5° | 120.4° |
C10 | C11 | C12 | 120.1° | 120.5° |
C10 | C11 | H41 | 120.0° | 119.8° |
C11 | C10 | H40 | 119.7° | 119.8° |
C10 | C9 | C8 | 120.6° | 119.7° |
C10 | C9 | H39 | 119.7° | 120.1° |
C9 | C10 | H40 | 119.7° | 119.8° |
C17 | C16 | C15 | 119.5° | 119.9° |
C16 | C17 | C18 | 120.2° | 119.9° |
C17 | C16 | H44 | 120.3° | 120.1° |
C16 | C15 | C14 | 121.4° | 120.1° |
C16 | C15 | H43 | 119.3° | 119.9° |
C15 | C16 | H44 | 120.2° | 120.0° |
C11 | C12 | O13 | 120.4° | 120.1° |
C11 | C12 | C7 | 119.0° | 119.8° |
C12 | C11 | H41 | 119.9° | 119.7° |
C9 | C8 | C7 | 118.3° | 120.0° |
C9 | C8 | C2 | 123.8° | 121.4° |
C8 | C9 | H39 | 119.7° | 120.2° |
C17 | C18 | C19 | 119.5° | 119.9° |
C17 | C18 | H45 | 120.3° | 120.0° |
C15 | C14 | C19 | 118.4° | 120.1° |
C15 | C14 | C4 | 120.4° | 120.0° |
C14 | C15 | H43 | 119.3° | 120.0° |
O13 | C12 | C7 | 120.6° | 120.1° |
C12 | O13 | H42 | 109.5° | 113.9° |
C12 | C7 | C8 | 121.5° | 119.7° |
C12 | C7 | O6 | 116.4° | 121.2° |
C7 | C8 | C2 | 117.8° | 118.6° |
C8 | C7 | O6 | 122.1° | 119.1° |
C8 | C2 | C1 | 118.9° | 120.9° |
C8 | C2 | C3 | 119.3° | 118.1° |
C1 | C2 | C3 | 121.7° | 121.0° |
C2 | C1 | H38 | 109.5° | 109.5° |
C2 | C1 | H37 | 109.4° | 109.4° |
C2 | C1 | H36 | 109.4° | 109.5° |
C7 | O6 | C4 | 118.0° | 117.6° |
C2 | C3 | C4 | 121.8° | 120.0° |
C2 | C3 | C29 | 124.8° | 120.0° |
C18 | C19 | C14 | 121.1° | 120.0° |
C19 | C18 | H45 | 120.3° | 120.0° |
C18 | C19 | H46 | 119.4° | 120.0° |
C19 | C14 | C4 | 121.2° | 119.9° |
C14 | C19 | H46 | 119.5° | 120.0° |
C14 | C4 | C3 | 111.1° | 109.2° |
C14 | C4 | O6 | 109.2° | 109.2° |
C14 | C4 | H5 | 107.7° | 109.2° |
C31 | C30 | C29 | 120.5° | 119.9° |
C30 | C31 | C32 | 120.3° | 120.2° |
C31 | C30 | H58 | 119.7° | 120.1° |
C30 | C31 | H59 | 119.9° | 119.9° |
C30 | C29 | C3 | 120.6° | 120.1° |
C30 | C29 | C34 | 119.4° | 119.8° |
C29 | C30 | H58 | 119.8° | 120.0° |
C4 | C3 | C29 | 113.4° | 120.0° |
C3 | C4 | O6 | 112.4° | 110.7° |
C3 | C4 | H5 | 107.7° | 109.2° |
C3 | C29 | C34 | 119.9° | 120.1° |
O6 | C4 | H5 | 108.5° | 109.2° |
C31 | C32 | C33 | 119.5° | 120.3° |
C32 | C31 | H59 | 119.9° | 119.9° |
C31 | C32 | H60 | 120.2° | 119.8° |
C29 | C34 | C33 | 119.7° | 119.8° |
C29 | C34 | H61 | 120.1° | 120.2° |
C32 | C33 | C34 | 120.6° | 120.0° |
C32 | C33 | O35 | 119.5° | 120.0° |
C33 | C32 | H60 | 120.2° | 119.9° |
C34 | C33 | O35 | 119.9° | 120.0° |
C33 | C34 | H61 | 120.2° | 120.0° |
C33 | O35 | H62 | 109.5° | 114.0° |
H38 | C1 | H37 | 109.5° | 109.5° |
H38 | C1 | H36 | 109.5° | 109.5° |
H37 | C1 | H36 | 109.5° | 109.5° |
H48 | C21 | H47 | 109.5° | 109.5° |
H50 | C22 | H49 | 109.5° | 109.5° |
H51 | C24 | H52 | 109.5° | 112.7° |
H55 | C26 | H54 | 109.4° | 112.8° |
H57 | C27 | H56 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C25 | C26 | N23 | H55 | 116.6° | 114.8° |
C25 | C26 | N23 | H54 | 116.6° | 114.8° |
C26 | C25 | C27 | C24 | 98.5° | 93.9° |
C26 | C25 | C27 | H53 | 131.6° | 133.1° |
C26 | C25 | C27 | F28 | 148.9° | 86.1° |
C26 | C25 | C24 | H53 | 113.3° | 113.6° |
C25 | C26 | N23 | C22 | 124.4° | 138.7° |
C25 | C26 | N23 | C24 | 6.4° | 27.0° |
C26 | C25 | C24 | H51 | 122.8° | 88.7° |
C26 | C25 | C24 | H52 | 110.4° | 140.8° |
C25 | C26 | H55 | H54 | 129.3° | 130.8° |
C26 | C25 | C27 | H57 | 90.9° | 33.9° |
C26 | C25 | C27 | H56 | 28.7° | 153.9° |
N23 | C26 | C25 | C27 | 121.1° | 139.7° |
C26 | N23 | C22 | C24 | 105.5° | 96.0° |
C26 | N23 | C22 | C21 | 175.3° | 94.0° |
C26 | N23 | C22 | H50 | 64.4° | 26.0° |
C26 | N23 | C22 | H49 | 55.0° | 146.0° |
C26 | N23 | C24 | H51 | 123.1° | 87.8° |
C26 | N23 | C24 | H52 | 110.1° | 141.9° |
N23 | C26 | C25 | H53 | 107.2° | 87.6° |
N23 | C26 | H55 | H54 | 129.3° | 130.8° |
C25 | C27 | F28 | H57 | 120.2° | 120.0° |
C25 | C27 | F28 | H56 | 120.2° | 120.0° |
C27 | C25 | C24 | H53 | 130.1° | 132.6° |
C27 | C25 | C24 | N23 | 122.8° | 139.9° |
C27 | C25 | C24 | H51 | 120.6° | 25.1° |
C27 | C25 | C24 | H52 | 6.2° | 105.4° |
C27 | C25 | C26 | H55 | 4.5° | 105.6° |
C27 | C25 | C26 | H54 | 122.4° | 24.9° |
C25 | C27 | H57 | H56 | 119.3° | 120.0° |
F28 | C27 | C25 | C24 | 50.4° | 180.0° |
F28 | C27 | C25 | H53 | 79.5° | 47.0° |
F28 | C27 | H57 | H56 | 119.3° | 120.0° |
C25 | C24 | N23 | C22 | 127.1° | 138.7° |
C25 | C24 | N23 | H51 | 116.6° | 114.8° |
C25 | C24 | N23 | H52 | 116.6° | 114.8° |
C25 | C24 | H51 | H52 | 129.1° | 130.9° |
C24 | C25 | C26 | H55 | 110.4° | 140.8° |
C24 | C25 | C26 | H54 | 122.7° | 88.7° |
C24 | C25 | C27 | H57 | 170.6° | 60.0° |
C24 | C25 | C27 | H56 | 69.8° | 60.0° |
N23 | C22 | C21 | H50 | 120.3° | 120.0° |
N23 | C22 | C21 | H49 | 120.3° | 119.9° |
N23 | C22 | C21 | O20 | 109.5° | 65.0° |
N23 | C22 | C21 | H48 | 9.9° | 55.0° |
N23 | C22 | C21 | H47 | 131.1° | 175.0° |
N23 | C22 | H50 | H49 | 119.1° | 119.9° |
C22 | N23 | C24 | H51 | 116.3° | 23.9° |
C22 | N23 | C24 | H52 | 10.5° | 106.5° |
C22 | N23 | C26 | H55 | 7.8° | 106.5° |
C22 | N23 | C26 | H54 | 119.1° | 24.0° |
C24 | N23 | C22 | C21 | 79.2° | 170.0° |
C24 | N23 | C22 | H50 | 41.1° | 69.9° |
C24 | N23 | C22 | H49 | 160.5° | 50.0° |
N23 | C24 | H51 | H52 | 129.2° | 130.7° |
N23 | C24 | C25 | H53 | 107.1° | 87.6° |
C24 | N23 | C26 | H55 | 110.1° | 141.8° |
C24 | N23 | C26 | H54 | 123.0° | 87.7° |
C22 | C21 | O20 | H48 | 119.4° | 120.0° |
C22 | C21 | O20 | H47 | 119.4° | 120.0° |
C22 | C21 | O20 | C17 | 178.9° | 180.0° |
C22 | C21 | H48 | H47 | 121.8° | 120.0° |
C21 | C22 | H50 | H49 | 119.2° | 120.0° |
C21 | O20 | C17 | C16 | 179.1° | 180.0° |
C21 | O20 | C17 | C18 | 3.1° | 0.0° |
O20 | C21 | H48 | H47 | 121.8° | 120.0° |
O20 | C21 | C22 | H50 | 130.2° | 175.0° |
O20 | C21 | C22 | H49 | 10.7° | 55.0° |
O20 | C17 | C16 | C18 | 177.9° | 180.0° |
O20 | C17 | C16 | C15 | 177.2° | 179.9° |
O20 | C17 | C18 | C19 | 177.0° | 180.0° |
O20 | C17 | C16 | H44 | 2.8° | 0.0° |
O20 | C17 | C18 | H45 | 3.0° | 0.0° |
C17 | O20 | C21 | H48 | 59.5° | 60.0° |
C17 | O20 | C21 | H47 | 61.7° | 60.0° |
C11 | C10 | C9 | H40 | 180.0° | 180.0° |
C10 | C11 | C12 | H41 | 180.0° | 179.9° |
C11 | C10 | C9 | C8 | 0.4° | 0.0° |
C10 | C11 | C12 | O13 | 178.4° | 180.0° |
C10 | C11 | C12 | C7 | 0.8° | 0.1° |
C11 | C10 | C9 | H39 | 179.6° | 180.0° |
C9 | C10 | C11 | C12 | 0.8° | 0.3° |
C10 | C9 | C8 | H39 | 180.0° | 180.0° |
C10 | C9 | C8 | C7 | 1.4° | 0.6° |
C10 | C9 | C8 | C2 | 175.0° | 179.0° |
C9 | C10 | C11 | H41 | 179.3° | 179.8° |
C17 | C16 | C15 | H44 | 180.0° | 179.9° |
C17 | C16 | C15 | C14 | 0.0° | 0.1° |
C16 | C17 | C18 | C19 | 0.6° | 0.0° |
C17 | C16 | C15 | H43 | 179.9° | 180.0° |
C16 | C17 | C18 | H45 | 179.4° | 180.0° |
C15 | C16 | C17 | C18 | 0.7° | 0.1° |
C16 | C15 | C14 | H43 | 180.0° | 180.0° |
C16 | C15 | C14 | C19 | 0.6° | 0.0° |
C16 | C15 | C14 | C4 | 177.6° | 179.7° |
C11 | C12 | O13 | C7 | 179.2° | 180.0° |
C11 | C12 | C7 | C8 | 0.3° | 0.5° |
C11 | C12 | C7 | O6 | 179.1° | 179.3° |
C12 | C11 | C10 | H40 | 179.3° | 179.7° |
C11 | C12 | O13 | H42 | 180.0° | 90.0° |
C9 | C8 | C7 | C12 | 1.4° | 0.9° |
C9 | C8 | C7 | C2 | 176.6° | 179.6° |
C9 | C8 | C2 | C1 | 12.0° | 14.6° |
C9 | C8 | C7 | O6 | 178.0° | 179.0° |
C9 | C8 | C2 | C3 | 165.2° | 165.4° |
C8 | C9 | C10 | H40 | 179.6° | 180.0° |
C17 | C18 | C19 | H45 | 180.0° | 180.0° |
C17 | C18 | C19 | C14 | 0.1° | 0.0° |
C18 | C17 | C16 | H44 | 179.3° | 180.0° |
C17 | C18 | C19 | H46 | 179.9° | 179.8° |
C15 | C14 | C19 | C18 | 0.7° | 0.0° |
C15 | C14 | C19 | C4 | 178.2° | 179.7° |
C15 | C14 | C4 | C3 | 37.7° | 80.4° |
C15 | C14 | C4 | O6 | 86.9° | 40.9° |
C15 | C14 | C4 | H5 | 155.5° | 160.3° |
C14 | C15 | C16 | H44 | 179.9° | 180.0° |
C15 | C14 | C19 | H46 | 179.3° | 179.8° |
O13 | C12 | C7 | C8 | 179.5° | 179.5° |
O13 | C12 | C7 | O6 | 0.1° | 0.7° |
O13 | C12 | C11 | H41 | 1.6° | 0.0° |
C12 | C7 | C8 | O6 | 179.3° | 179.8° |
C12 | C7 | C8 | C2 | 175.2° | 178.8° |
C12 | C7 | O6 | C4 | 151.8° | 146.6° |
C7 | C12 | C11 | H41 | 179.2° | 180.0° |
C7 | C12 | O13 | H42 | 0.8° | 90.0° |
C7 | C8 | C2 | C1 | 171.6° | 165.7° |
C7 | C8 | C2 | C3 | 11.2° | 14.3° |
C8 | C7 | O6 | C4 | 28.9° | 33.6° |
C7 | C8 | C9 | H39 | 178.6° | 179.4° |
C8 | C2 | C1 | C3 | 177.1° | 180.0° |
C2 | C8 | C7 | O6 | 5.4° | 1.4° |
C8 | C2 | C3 | C4 | 4.2° | 1.6° |
C8 | C2 | C3 | C29 | 172.4° | 178.4° |
C2 | C8 | C9 | H39 | 5.1° | 1.0° |
C8 | C2 | C1 | H38 | 180.0° | 0.1° |
C8 | C2 | C1 | H37 | 60.0° | 120.0° |
C8 | C2 | C1 | H36 | 60.0° | 120.0° |
C1 | C2 | C3 | C4 | 178.7° | 178.4° |
C1 | C2 | C3 | C29 | 4.7° | 1.6° |
C2 | C1 | H38 | H37 | 120.0° | 119.9° |
C2 | C1 | H38 | H36 | 120.0° | 120.0° |
C2 | C1 | H37 | H36 | 120.0° | 120.0° |
C7 | O6 | C4 | C14 | 90.6° | 73.4° |
C7 | O6 | C4 | C3 | 33.3° | 46.9° |
C7 | O6 | C4 | H5 | 152.3° | 167.1° |
C2 | C3 | C4 | C14 | 105.4° | 89.7° |
C2 | C3 | C29 | C30 | 91.1° | 114.7° |
C2 | C3 | C4 | C29 | 177.0° | 180.0° |
C2 | C3 | C4 | O6 | 17.4° | 30.6° |
C2 | C3 | C29 | C34 | 92.2° | 65.0° |
C2 | C3 | C4 | H5 | 136.9° | 151.0° |
C3 | C2 | C1 | H38 | 2.9° | 180.0° |
C3 | C2 | C1 | H37 | 117.1° | 60.0° |
C3 | C2 | C1 | H36 | 122.9° | 60.0° |
C18 | C19 | C14 | H46 | 180.0° | 179.8° |
C18 | C19 | C14 | C4 | 177.5° | 179.7° |
C19 | C14 | C4 | C3 | 144.1° | 99.4° |
C19 | C14 | C4 | O6 | 91.3° | 139.4° |
C19 | C14 | C4 | H5 | 26.4° | 20.0° |
C19 | C14 | C15 | H43 | 179.4° | 180.0° |
C14 | C19 | C18 | H45 | 179.9° | 180.0° |
C14 | C4 | C3 | O6 | 122.8° | 120.3° |
C14 | C4 | C3 | H5 | 117.8° | 119.4° |
C14 | C4 | C3 | C29 | 71.6° | 90.3° |
C14 | C4 | O6 | H5 | 117.1° | 119.4° |
C4 | C14 | C15 | H43 | 2.4° | 0.3° |
C4 | C14 | C19 | H46 | 2.5° | 0.0° |
C31 | C30 | C29 | H58 | 180.0° | 180.0° |
C31 | C30 | C29 | C3 | 175.8° | 180.0° |
C30 | C31 | C32 | H59 | 180.0° | 180.0° |
C31 | C30 | C29 | C34 | 0.9° | 0.3° |
C30 | C31 | C32 | C33 | 0.3° | 0.0° |
C30 | C31 | C32 | H60 | 179.7° | 179.9° |
C30 | C29 | C3 | C4 | 85.8° | 65.3° |
C30 | C29 | C3 | C34 | 176.7° | 179.7° |
C29 | C30 | C31 | C32 | 0.1° | 0.0° |
C30 | C29 | C34 | C33 | 1.6° | 0.6° |
C29 | C30 | C31 | H59 | 179.9° | 180.0° |
C30 | C29 | C34 | H61 | 178.4° | 179.7° |
C3 | C4 | O6 | H5 | 119.0° | 120.3° |
C4 | C3 | C29 | C34 | 90.9° | 115.1° |
C29 | C3 | C4 | O6 | 165.6° | 149.4° |
C3 | C29 | C34 | C33 | 175.1° | 179.7° |
C29 | C3 | C4 | H5 | 46.2° | 29.1° |
C3 | C29 | C30 | H58 | 4.2° | 0.0° |
C3 | C29 | C34 | H61 | 4.9° | 0.1° |
C31 | C32 | C33 | H60 | 180.0° | 179.9° |
C31 | C32 | C33 | C34 | 0.4° | 0.3° |
C31 | C32 | C33 | O35 | 177.5° | 180.0° |
C32 | C31 | C30 | H58 | 180.0° | 180.0° |
C29 | C34 | C33 | C32 | 1.3° | 0.6° |
C29 | C34 | C33 | H61 | 180.0° | 179.6° |
C29 | C34 | C33 | O35 | 176.6° | 179.7° |
C34 | C29 | C30 | H58 | 179.1° | 179.7° |
C32 | C33 | C34 | O35 | 177.9° | 179.7° |
C33 | C32 | C31 | H59 | 179.7° | 180.0° |
C32 | C33 | C34 | H61 | 178.7° | 179.7° |
C32 | C33 | O35 | H62 | 180.0° | 89.9° |
C34 | C33 | C32 | H60 | 179.6° | 179.7° |
C34 | C33 | O35 | H62 | 2.1° | 89.7° |
O35 | C33 | C32 | H60 | 2.5° | 0.1° |
O35 | C33 | C34 | H61 | 3.4° | 0.1° |
H41 | C11 | C10 | H40 | 0.7° | 0.3° |
H39 | C9 | C10 | H40 | 0.4° | 0.0° |
H38 | C1 | H37 | H36 | 120.0° | 120.0° |
H43 | C15 | C16 | H44 | 0.1° | 0.0° |
H45 | C18 | C19 | H46 | 0.1° | 0.3° |
H48 | C21 | C22 | H50 | 110.4° | 65.0° |
H48 | C21 | C22 | H49 | 130.2° | 175.0° |
H47 | C21 | C22 | H50 | 10.8° | 55.0° |
H47 | C21 | C22 | H49 | 108.6° | 65.1° |
H51 | C24 | C25 | H53 | 9.5° | 157.6° |
H52 | C24 | C25 | H53 | 136.3° | 27.2° |
H53 | C25 | C26 | H55 | 136.2° | 27.1° |
H53 | C25 | C26 | H54 | 9.3° | 157.6° |
H53 | C25 | C27 | H57 | 40.7° | 167.0° |
H53 | C25 | C27 | H56 | 160.2° | 73.0° |
H58 | C30 | C31 | H59 | 0.1° | 0.0° |
H59 | C31 | C32 | H60 | 0.3° | 0.0° |