PRD_900127
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.53Å | 1.53Å | |
C1 | O1 | sing | 1.43Å | 1.40Å | |
C1 | O4 | sing | 1.43Å | 1.41Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C2 | C3 | sing | 1.53Å | 1.54Å | |
C2 | N1 | sing | 1.46Å | 1.47Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
C3 | C4 | sing | 1.53Å | 1.56Å | |
C3 | O2 | sing | 1.43Å | 1.42Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
C4 | C5 | sing | 1.53Å | 1.55Å | |
C4 | O3 | sing | 1.43Å | 1.46Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C5 | C6 | sing | 1.53Å | 1.54Å | |
C5 | O4 | sing | 1.43Å | 1.41Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
C6 | O5 | sing | 1.43Å | 1.44Å | |
C6 | H6 | sing | 1.09Å | 1.10Å | |
C6 | H7 | sing | 1.09Å | 1.10Å | |
C7 | C8 | sing | 1.51Å | 1.52Å | |
C7 | N1 | sing | 1.35Å | 1.37Å | |
C7 | O6 | doub | 1.21Å | 1.24Å | |
C8 | H8 | sing | 1.09Å | 1.10Å | |
C8 | H9 | sing | 1.09Å | 1.10Å | |
C8 | H10 | sing | 1.09Å | 1.10Å | |
N1 | H11 | sing | 0.97Å | 1.00Å | |
O1 | H12 | sing | 0.97Å | 0.95Å | |
O5 | H13 | sing | 0.97Å | 0.95Å | |
C9 | C10 | sing | 1.53Å | 1.54Å | |
C9 | O10 | sing | 1.43Å | 1.41Å | |
C9 | H14 | sing | 1.09Å | 1.10Å | |
C10 | C11 | sing | 1.53Å | 1.54Å | |
C10 | O7 | sing | 1.43Å | 1.42Å | |
C10 | H15 | sing | 1.09Å | 1.10Å | |
C11 | C12 | sing | 1.53Å | 1.52Å | |
C11 | O8 | sing | 1.43Å | 1.43Å | |
C11 | H16 | sing | 1.09Å | 1.10Å | |
C12 | C13 | sing | 1.53Å | 1.52Å | |
C12 | O9 | sing | 1.43Å | 1.43Å | |
C12 | H17 | sing | 1.09Å | 1.10Å | |
C13 | C14 | sing | 1.53Å | 1.53Å | |
C13 | O10 | sing | 1.43Å | 1.39Å | |
C13 | H18 | sing | 1.09Å | 1.10Å | |
C14 | O11 | sing | 1.43Å | 1.42Å | |
C14 | H19 | sing | 1.09Å | 1.10Å | |
C14 | H20 | sing | 1.09Å | 1.10Å | |
O9 | H21 | sing | 0.97Å | 0.95Å | |
O11 | H22 | sing | 0.97Å | 0.95Å | |
C15 | C16 | sing | 1.53Å | 1.54Å | |
C15 | O15 | sing | 1.43Å | 1.41Å | |
C15 | H23 | sing | 1.09Å | 1.10Å | |
C16 | C17 | sing | 1.53Å | 1.54Å | |
C16 | O12 | sing | 1.43Å | 1.41Å | |
C16 | H24 | sing | 1.09Å | 1.10Å | |
C17 | C18 | sing | 1.53Å | 1.52Å | |
C17 | O13 | sing | 1.43Å | 1.42Å | |
C17 | H25 | sing | 1.09Å | 1.10Å | |
C18 | C19 | sing | 1.53Å | 1.54Å | |
C18 | O14 | sing | 1.43Å | 1.43Å | |
C18 | H26 | sing | 1.09Å | 1.10Å | |
C19 | C20 | sing | 1.53Å | 1.52Å | |
C19 | O15 | sing | 1.43Å | 1.42Å | |
C19 | H27 | sing | 1.09Å | 1.10Å | |
C20 | H28 | sing | 1.09Å | 1.10Å | |
C20 | H29 | sing | 1.09Å | 1.10Å | |
C20 | H30 | sing | 1.09Å | 1.10Å | |
O12 | H31 | sing | 0.97Å | 0.95Å | |
O13 | H32 | sing | 0.97Å | 0.95Å | |
O14 | H33 | sing | 0.97Å | 0.95Å | |
O16 | C25 | sing | 1.43Å | 1.46Å | |
C21 | O16 | sing | 1.43Å | 1.47Å | |
C21 | C22 | sing | 1.53Å | 1.53Å | |
C21 | H34 | sing | 1.09Å | 1.10Å | |
C22 | C23 | sing | 1.53Å | 1.53Å | |
C22 | H35 | sing | 1.09Å | 1.10Å | |
N2 | C22 | sing | 1.46Å | 1.47Å | |
N2 | H36 | sing | 0.97Å | 1.00Å | |
C23 | C24 | sing | 1.53Å | 1.57Å | |
C23 | O17 | sing | 1.43Å | 1.43Å | |
C23 | H37 | sing | 1.09Å | 1.10Å | |
O17 | H38 | sing | 0.97Å | 0.95Å | |
C24 | O18 | sing | 1.43Å | 1.43Å | |
C24 | H39 | sing | 1.09Å | 1.10Å | |
O18 | H40 | sing | 0.97Å | 0.95Å | |
C25 | C24 | sing | 1.53Å | 1.53Å | |
C25 | C26 | sing | 1.53Å | 1.57Å | |
C25 | H41 | sing | 1.09Å | 1.10Å | |
C26 | O19 | sing | 1.43Å | 1.46Å | |
C26 | H42 | sing | 1.09Å | 1.10Å | |
C27 | N2 | sing | 1.35Å | 1.36Å | |
O20 | C27 | doub | 1.21Å | 1.23Å | |
C28 | C27 | sing | 1.51Å | 1.54Å | |
C28 | H43 | sing | 1.09Å | 1.10Å | |
C28 | H44 | sing | 1.09Å | 1.10Å | |
C28 | H45 | sing | 1.09Å | 1.10Å | |
C26 | H46 | sing | 1.09Å | 1.10Å | |
O19 | H47 | sing | 0.97Å | 0.95Å | |
C29 | C30 | sing | 1.53Å | 1.54Å | |
C29 | O24 | sing | 1.43Å | 1.44Å | |
C29 | H48 | sing | 1.09Å | 1.10Å | |
C30 | C31 | sing | 1.53Å | 1.53Å | |
C30 | O21 | sing | 1.43Å | 1.42Å | |
C30 | H49 | sing | 1.09Å | 1.10Å | |
C31 | C32 | sing | 1.53Å | 1.53Å | |
C31 | O22 | sing | 1.43Å | 1.41Å | |
C31 | H50 | sing | 1.09Å | 1.10Å | |
C32 | C33 | sing | 1.53Å | 1.54Å | |
C32 | O23 | sing | 1.43Å | 1.42Å | |
C32 | H51 | sing | 1.09Å | 1.10Å | |
C33 | C34 | sing | 1.53Å | 1.52Å | |
C33 | O24 | sing | 1.43Å | 1.43Å | |
C33 | H52 | sing | 1.09Å | 1.10Å | |
C34 | H53 | sing | 1.09Å | 1.10Å | |
C34 | H54 | sing | 1.09Å | 1.10Å | |
C34 | H55 | sing | 1.09Å | 1.10Å | |
O21 | H56 | sing | 0.97Å | 0.95Å | |
O22 | H57 | sing | 0.97Å | 0.95Å | |
O23 | H58 | sing | 0.97Å | 0.95Å | |
O3 | C9 | sing | 1.43Å | 1.44Å | |
O2 | C29 | sing | 1.43Å | 1.45Å | |
O7 | C15 | sing | 1.43Å | 1.44Å | |
O8 | C21 | sing | 1.43Å | 1.32Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | O1 | 109.6° | 109.5° |
C2 | C1 | O4 | 110.1° | 109.4° |
C2 | C1 | H1 | 108.5° | 109.5° |
C1 | C2 | C3 | 107.6° | 109.2° |
C1 | C2 | N1 | 109.8° | 109.6° |
C1 | C2 | H2 | 108.6° | 109.5° |
O1 | C1 | O4 | 108.1° | 109.5° |
O1 | C1 | H1 | 110.3° | 109.5° |
C1 | O1 | H12 | 109.5° | 114.0° |
O4 | C1 | H1 | 110.3° | 109.5° |
C1 | O4 | C5 | 114.2° | 114.1° |
C3 | C2 | N1 | 113.0° | 109.5° |
C3 | C2 | H2 | 108.5° | 109.5° |
C2 | C3 | C4 | 112.8° | 109.0° |
C2 | C3 | O2 | 114.3° | 109.5° |
C2 | C3 | H3 | 107.1° | 109.6° |
N1 | C2 | H2 | 109.4° | 109.6° |
C2 | N1 | C7 | 127.2° | 120.0° |
C2 | N1 | H11 | 116.4° | 120.1° |
C4 | C3 | O2 | 106.8° | 109.5° |
C4 | C3 | H3 | 106.9° | 109.5° |
C3 | C4 | C5 | 110.9° | 109.1° |
C3 | C4 | O3 | 111.8° | 109.5° |
C3 | C4 | H4 | 106.2° | 109.5° |
O2 | C3 | H3 | 108.6° | 109.6° |
C3 | O2 | C29 | 121.5° | 114.0° |
C5 | C4 | O3 | 113.9° | 109.5° |
C5 | C4 | H4 | 106.2° | 109.5° |
C4 | C5 | C6 | 115.1° | 109.5° |
C4 | C5 | O4 | 107.7° | 109.4° |
C4 | C5 | H5 | 109.0° | 109.5° |
O3 | C4 | H4 | 107.3° | 109.6° |
C4 | O3 | C9 | 113.6° | 114.0° |
C6 | C5 | O4 | 104.9° | 109.5° |
C6 | C5 | H5 | 109.2° | 109.5° |
C5 | C6 | O5 | 114.8° | 109.5° |
C5 | C6 | H6 | 108.1° | 109.5° |
C5 | C6 | H7 | 108.1° | 109.5° |
O4 | C5 | H5 | 111.0° | 109.5° |
O5 | C6 | H6 | 108.2° | 109.5° |
O5 | C6 | H7 | 108.1° | 109.5° |
C6 | O5 | H13 | 109.5° | 114.0° |
H6 | C6 | H7 | 109.4° | 109.4° |
C8 | C7 | N1 | 120.3° | 120.0° |
C8 | C7 | O6 | 116.1° | 120.0° |
C7 | C8 | H8 | 109.5° | 109.5° |
C7 | C8 | H9 | 109.5° | 109.5° |
C7 | C8 | H10 | 109.5° | 109.5° |
N1 | C7 | O6 | 123.5° | 120.0° |
C7 | N1 | H11 | 116.4° | 119.9° |
H8 | C8 | H9 | 109.5° | 109.4° |
H8 | C8 | H10 | 109.5° | 109.5° |
H9 | C8 | H10 | 109.4° | 109.4° |
C10 | C9 | O10 | 112.0° | 109.4° |
C10 | C9 | H14 | 108.8° | 109.5° |
C9 | C10 | C11 | 113.3° | 109.2° |
C9 | C10 | O7 | 107.4° | 109.5° |
C9 | C10 | H15 | 109.3° | 109.5° |
C10 | C9 | O3 | 111.1° | 109.5° |
O10 | C9 | H14 | 110.6° | 109.5° |
C9 | O10 | C13 | 119.4° | 114.1° |
O10 | C9 | O3 | 104.1° | 109.5° |
H14 | C9 | O3 | 110.3° | 109.5° |
C11 | C10 | O7 | 106.4° | 109.5° |
C11 | C10 | H15 | 109.3° | 109.5° |
C10 | C11 | C12 | 111.1° | 109.0° |
C10 | C11 | O8 | 109.2° | 109.5° |
C10 | C11 | H16 | 107.9° | 109.5° |
O7 | C10 | H15 | 111.1° | 109.6° |
C10 | O7 | C15 | 117.2° | 114.0° |
C12 | C11 | O8 | 111.2° | 109.6° |
C12 | C11 | H16 | 108.1° | 109.5° |
C11 | C12 | C13 | 107.9° | 109.2° |
C11 | C12 | O9 | 109.5° | 109.5° |
C11 | C12 | H17 | 109.1° | 109.5° |
O8 | C11 | H16 | 109.3° | 109.6° |
C11 | O8 | C21 | 124.2° | 114.0° |
C13 | C12 | O9 | 110.9° | 109.5° |
C13 | C12 | H17 | 109.1° | 109.6° |
C12 | C13 | C14 | 115.9° | 109.5° |
C12 | C13 | O10 | 108.0° | 109.4° |
C12 | C13 | H18 | 109.4° | 109.5° |
O9 | C12 | H17 | 110.3° | 109.6° |
C12 | O9 | H21 | 109.5° | 114.0° |
C14 | C13 | O10 | 102.9° | 109.5° |
C14 | C13 | H18 | 109.3° | 109.4° |
C13 | C14 | O11 | 107.6° | 109.5° |
C13 | C14 | H19 | 109.9° | 109.4° |
C13 | C14 | H20 | 109.9° | 109.5° |
O10 | C13 | H18 | 111.3° | 109.5° |
O11 | C14 | H19 | 109.9° | 109.5° |
O11 | C14 | H20 | 109.9° | 109.5° |
C14 | O11 | H22 | 109.5° | 114.0° |
H19 | C14 | H20 | 109.5° | 109.4° |
C16 | C15 | O15 | 111.1° | 109.4° |
C16 | C15 | H23 | 108.8° | 109.5° |
C15 | C16 | C17 | 112.5° | 109.1° |
C15 | C16 | O12 | 111.5° | 109.5° |
C15 | C16 | H24 | 107.4° | 109.5° |
C16 | C15 | O7 | 105.9° | 109.5° |
O15 | C15 | H23 | 110.7° | 109.5° |
C15 | O15 | C19 | 114.9° | 114.1° |
O15 | C15 | O7 | 110.2° | 109.5° |
H23 | C15 | O7 | 110.1° | 109.5° |
C17 | C16 | O12 | 108.8° | 109.6° |
C17 | C16 | H24 | 107.5° | 109.5° |
C16 | C17 | C18 | 109.3° | 109.1° |
C16 | C17 | O13 | 109.4° | 109.5° |
C16 | C17 | H25 | 109.1° | 109.6° |
O12 | C16 | H24 | 109.1° | 109.6° |
C16 | O12 | H31 | 109.5° | 114.0° |
C18 | C17 | O13 | 108.8° | 109.6° |
C18 | C17 | H25 | 109.4° | 109.5° |
C17 | C18 | C19 | 108.2° | 109.2° |
C17 | C18 | O14 | 110.3° | 109.5° |
C17 | C18 | H26 | 108.4° | 109.5° |
O13 | C17 | H25 | 110.8° | 109.6° |
C17 | O13 | H32 | 109.5° | 114.0° |
C19 | C18 | O14 | 111.9° | 109.5° |
C19 | C18 | H26 | 108.3° | 109.6° |
C18 | C19 | C20 | 112.8° | 109.5° |
C18 | C19 | O15 | 111.8° | 109.5° |
C18 | C19 | H27 | 106.6° | 109.5° |
O14 | C18 | H26 | 109.7° | 109.6° |
C18 | O14 | H33 | 109.5° | 114.0° |
C20 | C19 | O15 | 110.5° | 109.5° |
C20 | C19 | H27 | 106.8° | 109.5° |
C19 | C20 | H28 | 109.5° | 109.5° |
C19 | C20 | H29 | 109.5° | 109.4° |
C19 | C20 | H30 | 109.5° | 109.4° |
O15 | C19 | H27 | 108.0° | 109.5° |
H28 | C20 | H29 | 109.4° | 109.5° |
H28 | C20 | H30 | 109.5° | 109.5° |
H29 | C20 | H30 | 109.5° | 109.5° |
C25 | O16 | C21 | 113.6° | 114.0° |
O16 | C25 | C24 | 106.5° | 109.4° |
O16 | C25 | C26 | 104.1° | 109.4° |
O16 | C25 | H41 | 111.5° | 109.6° |
O16 | C21 | C22 | 106.9° | 109.4° |
O16 | C21 | H34 | 107.5° | 109.5° |
O16 | C21 | O8 | 112.7° | 109.5° |
C22 | C21 | H34 | 106.7° | 109.5° |
C21 | C22 | C23 | 109.4° | 109.1° |
C21 | C22 | H35 | 109.0° | 109.5° |
C21 | C22 | N2 | 109.7° | 109.5° |
C22 | C21 | O8 | 113.1° | 109.5° |
H34 | C21 | O8 | 109.5° | 109.5° |
C23 | C22 | H35 | 109.0° | 109.5° |
C23 | C22 | N2 | 109.9° | 109.5° |
C22 | C23 | C24 | 108.5° | 109.1° |
C22 | C23 | O17 | 109.0° | 109.5° |
C22 | C23 | H37 | 109.1° | 109.5° |
H35 | C22 | N2 | 109.9° | 109.6° |
C22 | N2 | H36 | 121.1° | 120.0° |
C22 | N2 | C27 | 117.8° | 120.0° |
H36 | N2 | C27 | 121.1° | 120.0° |
C24 | C23 | O17 | 111.2° | 109.6° |
C24 | C23 | H37 | 108.6° | 109.5° |
C23 | C24 | O18 | 107.6° | 109.5° |
C23 | C24 | H39 | 108.5° | 109.5° |
C23 | C24 | C25 | 111.7° | 109.2° |
O17 | C23 | H37 | 110.5° | 109.6° |
C23 | O17 | H38 | 109.5° | 114.0° |
O18 | C24 | H39 | 110.3° | 109.5° |
C24 | O18 | H40 | 109.5° | 114.0° |
O18 | C24 | C25 | 109.8° | 109.5° |
H39 | C24 | C25 | 109.0° | 109.6° |
C24 | C25 | C26 | 114.0° | 109.5° |
C24 | C25 | H41 | 110.6° | 109.5° |
C26 | C25 | H41 | 110.0° | 109.5° |
C25 | C26 | O19 | 112.8° | 109.5° |
C25 | C26 | H42 | 108.6° | 109.5° |
C25 | C26 | H46 | 108.6° | 109.5° |
O19 | C26 | H42 | 108.6° | 109.4° |
O19 | C26 | H46 | 108.6° | 109.5° |
C26 | O19 | H47 | 109.5° | 114.0° |
H42 | C26 | H46 | 109.5° | 109.4° |
N2 | C27 | O20 | 124.1° | 120.0° |
N2 | C27 | C28 | 117.4° | 120.0° |
O20 | C27 | C28 | 118.5° | 120.0° |
C27 | C28 | H43 | 109.5° | 109.4° |
C27 | C28 | H44 | 109.5° | 109.5° |
C27 | C28 | H45 | 109.5° | 109.5° |
H43 | C28 | H44 | 109.5° | 109.5° |
H43 | C28 | H45 | 109.5° | 109.4° |
H44 | C28 | H45 | 109.4° | 109.5° |
C30 | C29 | O24 | 110.7° | 109.4° |
C30 | C29 | H48 | 106.3° | 109.5° |
C29 | C30 | C31 | 110.4° | 109.2° |
C29 | C30 | O21 | 113.9° | 109.6° |
C29 | C30 | H49 | 106.5° | 109.5° |
C30 | C29 | O2 | 110.3° | 109.5° |
O24 | C29 | H48 | 107.6° | 109.5° |
C29 | O24 | C33 | 115.7° | 114.1° |
O24 | C29 | O2 | 114.1° | 109.5° |
H48 | C29 | O2 | 107.5° | 109.4° |
C31 | C30 | O21 | 111.1° | 109.5° |
C31 | C30 | H49 | 106.6° | 109.5° |
C30 | C31 | C32 | 108.5° | 109.0° |
C30 | C31 | O22 | 112.3° | 109.6° |
C30 | C31 | H50 | 108.7° | 109.5° |
O21 | C30 | H49 | 108.0° | 109.5° |
C30 | O21 | H56 | 109.5° | 114.0° |
C32 | C31 | O22 | 108.1° | 109.5° |
C32 | C31 | H50 | 108.8° | 109.5° |
C31 | C32 | C33 | 112.1° | 109.2° |
C31 | C32 | O23 | 108.1° | 109.5° |
C31 | C32 | H51 | 108.5° | 109.5° |
O22 | C31 | H50 | 110.4° | 109.6° |
C31 | O22 | H57 | 109.5° | 114.0° |
C33 | C32 | O23 | 109.5° | 109.5° |
C33 | C32 | H51 | 108.4° | 109.5° |
C32 | C33 | C34 | 107.6° | 109.5° |
C32 | C33 | O24 | 111.7° | 109.4° |
C32 | C33 | H52 | 108.6° | 109.5° |
O23 | C32 | H51 | 110.1° | 109.6° |
C32 | O23 | H58 | 109.5° | 113.9° |
C34 | C33 | O24 | 110.0° | 109.5° |
C34 | C33 | H52 | 108.8° | 109.5° |
C33 | C34 | H53 | 109.5° | 109.4° |
C33 | C34 | H54 | 109.5° | 109.5° |
C33 | C34 | H55 | 109.5° | 109.5° |
O24 | C33 | H52 | 110.0° | 109.5° |
H53 | C34 | H54 | 109.4° | 109.5° |
H53 | C34 | H55 | 109.4° | 109.5° |
H54 | C34 | H55 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | O1 | O4 | 120.0° | 120.0° |
C2 | C1 | O1 | H1 | 119.4° | 120.0° |
C2 | C1 | O4 | H1 | 119.7° | 120.0° |
C1 | C2 | C3 | N1 | 121.3° | 119.9° |
C1 | C2 | C3 | H2 | 117.2° | 119.9° |
C1 | C2 | N1 | H2 | 119.0° | 120.2° |
C1 | C2 | C3 | C4 | 49.1° | 57.0° |
C1 | C2 | C3 | O2 | 171.3° | 176.8° |
C1 | C2 | C3 | H3 | 68.3° | 62.9° |
C2 | C1 | O4 | C5 | 69.2° | 61.2° |
C1 | C2 | N1 | C7 | 94.8° | 85.0° |
C1 | C2 | N1 | H11 | 85.2° | 95.0° |
C2 | C1 | O1 | H12 | 180.0° | 180.0° |
O1 | C1 | O4 | H1 | 120.6° | 120.0° |
O1 | C1 | C2 | C3 | 175.9° | 177.6° |
O1 | C1 | C2 | N1 | 60.8° | 62.5° |
O1 | C1 | C2 | H2 | 58.7° | 57.7° |
O1 | C1 | O4 | C5 | 171.1° | 178.9° |
O4 | C1 | C2 | C3 | 57.1° | 57.6° |
O4 | C1 | C2 | N1 | 179.6° | 177.5° |
O4 | C1 | C2 | H2 | 60.1° | 62.3° |
C1 | O4 | C5 | C4 | 64.7° | 61.2° |
C1 | O4 | C5 | C6 | 172.3° | 178.9° |
C1 | O4 | C5 | H5 | 54.5° | 58.8° |
O4 | C1 | O1 | H12 | 60.0° | 60.0° |
H1 | C1 | C2 | C3 | 63.7° | 62.4° |
H1 | C1 | C2 | N1 | 59.7° | 57.5° |
H1 | C1 | C2 | H2 | 179.2° | 177.7° |
H1 | C1 | O4 | C5 | 50.6° | 58.8° |
H1 | C1 | O1 | H12 | 60.6° | 60.0° |
C3 | C2 | N1 | H2 | 120.9° | 120.2° |
C2 | C3 | C4 | O2 | 126.4° | 119.9° |
C2 | C3 | C4 | H3 | 117.5° | 119.9° |
C2 | C3 | O2 | H3 | 119.5° | 120.3° |
C2 | C3 | C4 | C5 | 48.2° | 57.0° |
C2 | C3 | C4 | O3 | 176.5° | 176.9° |
C2 | C3 | C4 | H4 | 66.8° | 62.9° |
C3 | C2 | N1 | C7 | 145.2° | 155.3° |
C3 | C2 | N1 | H11 | 34.8° | 24.7° |
C2 | C3 | O2 | C29 | 31.7° | 86.4° |
N1 | C2 | C3 | C4 | 170.4° | 176.9° |
N1 | C2 | C3 | O2 | 67.4° | 63.2° |
N1 | C2 | C3 | H3 | 53.0° | 57.1° |
C2 | N1 | C7 | C8 | 99.9° | 179.9° |
C2 | N1 | C7 | H11 | 180.0° | 180.0° |
C2 | N1 | C7 | O6 | 81.6° | 0.0° |
H2 | C2 | C3 | C4 | 68.2° | 62.9° |
H2 | C2 | C3 | O2 | 54.0° | 56.9° |
H2 | C2 | C3 | H3 | 174.4° | 177.3° |
H2 | C2 | N1 | C7 | 24.2° | 35.2° |
H2 | C2 | N1 | H11 | 155.8° | 144.9° |
C4 | C3 | O2 | H3 | 115.0° | 120.2° |
C3 | C4 | C5 | O3 | 127.2° | 119.9° |
C3 | C4 | C5 | H4 | 114.9° | 119.9° |
C3 | C4 | O3 | H4 | 116.1° | 120.2° |
C3 | C4 | C5 | C6 | 168.8° | 177.6° |
C3 | C4 | C5 | O4 | 52.3° | 57.6° |
C3 | C4 | C5 | H5 | 68.3° | 62.4° |
C3 | C4 | O3 | C9 | 122.7° | 129.4° |
C4 | C3 | O2 | C29 | 157.1° | 154.1° |
O2 | C3 | C4 | C5 | 174.5° | 176.9° |
O2 | C3 | C4 | O3 | 57.2° | 63.3° |
O2 | C3 | C4 | H4 | 59.6° | 56.9° |
C3 | O2 | C29 | C30 | 165.0° | 165.2° |
C3 | O2 | C29 | O24 | 69.7° | 74.8° |
C3 | O2 | C29 | H48 | 49.5° | 45.3° |
H3 | C3 | C4 | C5 | 69.4° | 62.9° |
H3 | C3 | C4 | O3 | 59.0° | 57.0° |
H3 | C3 | C4 | H4 | 175.7° | 177.2° |
H3 | C3 | O2 | C29 | 87.9° | 33.9° |
C5 | C4 | O3 | H4 | 117.3° | 120.2° |
C4 | C5 | C6 | O4 | 118.1° | 119.9° |
C4 | C5 | C6 | H5 | 122.8° | 120.0° |
C4 | C5 | O4 | H5 | 119.2° | 120.0° |
C4 | C5 | C6 | O5 | 167.9° | 172.7° |
C4 | C5 | C6 | H6 | 47.1° | 52.7° |
C4 | C5 | C6 | H7 | 71.3° | 67.3° |
C5 | C4 | O3 | C9 | 110.6° | 111.0° |
O3 | C4 | C5 | C6 | 64.0° | 62.5° |
O3 | C4 | C5 | O4 | 179.5° | 177.5° |
O3 | C4 | C5 | H5 | 58.9° | 57.5° |
C4 | O3 | C9 | C10 | 103.2° | 164.5° |
C4 | O3 | C9 | O10 | 17.5° | 75.6° |
C4 | O3 | C9 | H14 | 136.1° | 44.4° |
H4 | C4 | C5 | C6 | 53.9° | 57.7° |
H4 | C4 | C5 | O4 | 62.6° | 62.3° |
H4 | C4 | C5 | H5 | 176.8° | 177.7° |
H4 | C4 | O3 | C9 | 6.7° | 9.2° |
C6 | C5 | O4 | H5 | 117.8° | 120.0° |
C5 | C6 | O5 | H6 | 120.8° | 120.0° |
C5 | C6 | O5 | H7 | 120.8° | 120.0° |
C5 | C6 | H6 | H7 | 117.5° | 120.0° |
C5 | C6 | O5 | H13 | 180.0° | 180.0° |
O4 | C5 | C6 | O5 | 74.0° | 67.4° |
O4 | C5 | C6 | H6 | 165.1° | 172.6° |
O4 | C5 | C6 | H7 | 46.8° | 52.7° |
H5 | C5 | C6 | O5 | 45.0° | 52.7° |
H5 | C5 | C6 | H6 | 75.8° | 67.3° |
H5 | C5 | C6 | H7 | 165.8° | 172.7° |
O5 | C6 | H6 | H7 | 117.6° | 120.0° |
H6 | C6 | O5 | H13 | 59.2° | 60.0° |
H7 | C6 | O5 | H13 | 59.2° | 60.0° |
C8 | C7 | N1 | O6 | 178.5° | 179.9° |
C7 | C8 | H8 | H9 | 120.0° | 120.0° |
C7 | C8 | H8 | H10 | 120.0° | 120.0° |
C7 | C8 | H9 | H10 | 120.0° | 120.0° |
C8 | C7 | N1 | H11 | 80.1° | 0.0° |
N1 | C7 | C8 | H8 | 178.6° | 90.0° |
N1 | C7 | C8 | H9 | 58.6° | 150.0° |
N1 | C7 | C8 | H10 | 61.3° | 30.1° |
O6 | C7 | C8 | H8 | 0.0° | 89.9° |
O6 | C7 | C8 | H9 | 120.0° | 30.0° |
O6 | C7 | C8 | H10 | 120.0° | 150.0° |
O6 | C7 | N1 | H11 | 98.4° | 180.0° |
H8 | C8 | H9 | H10 | 120.0° | 120.0° |
C10 | C9 | O10 | H14 | 121.5° | 120.0° |
C10 | C9 | O10 | O3 | 120.1° | 119.9° |
C10 | C9 | H14 | O3 | 122.0° | 120.0° |
C9 | C10 | C11 | O7 | 117.8° | 119.9° |
C9 | C10 | C11 | H15 | 122.2° | 119.9° |
C9 | C10 | O7 | H15 | 119.5° | 120.2° |
C9 | C10 | C11 | C12 | 44.9° | 57.0° |
C9 | C10 | C11 | O8 | 167.9° | 176.9° |
C9 | C10 | C11 | H16 | 73.4° | 62.9° |
C10 | C9 | O10 | C13 | 48.2° | 61.2° |
C9 | C10 | O7 | C15 | 134.0° | 159.7° |
O10 | C9 | H14 | O3 | 114.6° | 120.1° |
O10 | C9 | C10 | C11 | 37.4° | 57.6° |
O10 | C9 | C10 | O7 | 154.7° | 177.5° |
O10 | C9 | C10 | H15 | 84.7° | 62.3° |
C9 | O10 | C13 | C12 | 61.5° | 61.2° |
C9 | O10 | C13 | C14 | 175.4° | 178.8° |
C9 | O10 | C13 | H18 | 58.5° | 58.8° |
H14 | C9 | C10 | C11 | 85.1° | 62.4° |
H14 | C9 | C10 | O7 | 32.1° | 57.5° |
H14 | C9 | C10 | H15 | 152.7° | 177.7° |
H14 | C9 | O10 | C13 | 73.4° | 58.8° |
C11 | C10 | O7 | H15 | 118.9° | 120.2° |
C10 | C11 | C12 | O8 | 121.8° | 119.9° |
C10 | C11 | C12 | H16 | 118.2° | 119.8° |
C10 | C11 | O8 | H16 | 117.8° | 120.2° |
C10 | C11 | C12 | C13 | 56.9° | 57.0° |
C10 | C11 | C12 | O9 | 63.8° | 62.9° |
C10 | C11 | C12 | H17 | 175.3° | 176.9° |
C11 | C10 | C9 | O3 | 153.3° | 177.6° |
C11 | C10 | O7 | C15 | 104.4° | 80.6° |
C10 | C11 | O8 | C21 | 176.6° | 164.6° |
O7 | C10 | C11 | C12 | 162.7° | 176.8° |
O7 | C10 | C11 | O8 | 74.3° | 63.3° |
O7 | C10 | C11 | H16 | 44.4° | 57.0° |
C10 | O7 | C15 | C16 | 172.4° | 179.7° |
C10 | O7 | C15 | O15 | 67.4° | 59.8° |
C10 | O7 | C15 | H23 | 54.9° | 60.2° |
O7 | C10 | C9 | O3 | 89.5° | 62.5° |
H15 | C10 | C11 | C12 | 77.3° | 63.0° |
H15 | C10 | C11 | O8 | 45.7° | 57.0° |
H15 | C10 | C11 | H16 | 164.4° | 177.2° |
H15 | C10 | C9 | O3 | 31.1° | 57.7° |
H15 | C10 | O7 | C15 | 14.5° | 39.5° |
C12 | C11 | O8 | H16 | 119.3° | 120.2° |
C11 | C12 | C13 | O9 | 119.9° | 119.8° |
C11 | C12 | C13 | H17 | 118.4° | 119.9° |
C11 | C12 | O9 | H17 | 120.1° | 120.1° |
C11 | C12 | C13 | C14 | 177.7° | 177.6° |
C11 | C12 | C13 | O10 | 63.0° | 57.6° |
C11 | C12 | C13 | H18 | 58.2° | 62.4° |
C11 | C12 | O9 | H21 | 180.0° | 180.0° |
C12 | C11 | O8 | C21 | 60.4° | 75.8° |
O8 | C11 | C12 | C13 | 178.8° | 176.8° |
O8 | C11 | C12 | O9 | 58.0° | 57.0° |
O8 | C11 | C12 | H17 | 62.9° | 63.2° |
C11 | O8 | C21 | O16 | 70.9° | 69.7° |
C11 | O8 | C21 | C22 | 167.7° | 170.3° |
C11 | O8 | C21 | H34 | 48.8° | 50.3° |
H16 | C11 | C12 | C13 | 61.3° | 62.9° |
H16 | C11 | C12 | O9 | 178.0° | 177.2° |
H16 | C11 | C12 | H17 | 57.1° | 57.1° |
H16 | C11 | O8 | C21 | 58.9° | 44.4° |
C13 | C12 | O9 | H17 | 120.9° | 120.2° |
C12 | C13 | C14 | O10 | 117.6° | 119.9° |
C12 | C13 | C14 | H18 | 124.1° | 120.1° |
C12 | C13 | O10 | H18 | 120.0° | 120.0° |
C12 | C13 | C14 | O11 | 166.2° | 175.0° |
C12 | C13 | C14 | H19 | 46.4° | 55.0° |
C12 | C13 | C14 | H20 | 74.1° | 65.0° |
C13 | C12 | O9 | H21 | 61.0° | 60.4° |
O9 | C12 | C13 | C14 | 57.8° | 57.7° |
O9 | C12 | C13 | O10 | 56.9° | 62.2° |
O9 | C12 | C13 | H18 | 178.1° | 177.7° |
H17 | C12 | C13 | C14 | 63.8° | 62.5° |
H17 | C12 | C13 | O10 | 178.6° | 177.5° |
H17 | C12 | C13 | H18 | 60.2° | 57.5° |
H17 | C12 | O9 | H21 | 59.9° | 59.8° |
C14 | C13 | O10 | H18 | 116.9° | 120.0° |
C13 | C14 | O11 | H19 | 119.7° | 120.0° |
C13 | C14 | O11 | H20 | 119.7° | 120.1° |
C13 | C14 | H19 | H20 | 120.8° | 120.0° |
C13 | C14 | O11 | H22 | 180.0° | 180.0° |
O10 | C13 | C14 | O11 | 76.2° | 65.1° |
O10 | C13 | C14 | H19 | 164.0° | 174.9° |
O10 | C13 | C14 | H20 | 43.5° | 55.0° |
C13 | O10 | C9 | O3 | 168.2° | 178.8° |
H18 | C13 | C14 | O11 | 42.1° | 54.9° |
H18 | C13 | C14 | H19 | 77.7° | 65.1° |
H18 | C13 | C14 | H20 | 161.8° | 175.0° |
O11 | C14 | H19 | H20 | 120.8° | 120.0° |
H19 | C14 | O11 | H22 | 60.3° | 60.0° |
H20 | C14 | O11 | H22 | 60.3° | 60.0° |
C16 | C15 | O15 | H23 | 120.9° | 120.0° |
C16 | C15 | O15 | O7 | 117.0° | 120.0° |
C16 | C15 | H23 | O7 | 115.7° | 120.1° |
C15 | C16 | C17 | O12 | 124.1° | 119.9° |
C15 | C16 | C17 | H24 | 118.0° | 119.9° |
C15 | C16 | O12 | H24 | 118.4° | 120.1° |
C15 | C16 | C17 | C18 | 52.6° | 57.0° |
C15 | C16 | C17 | O13 | 171.6° | 176.9° |
C15 | C16 | C17 | H25 | 67.0° | 62.9° |
C16 | C15 | O15 | C19 | 53.8° | 61.1° |
C15 | C16 | O12 | H31 | 180.0° | 63.3° |
O15 | C15 | H23 | O7 | 122.0° | 120.0° |
O15 | C15 | C16 | C17 | 50.3° | 57.6° |
O15 | C15 | C16 | O12 | 172.9° | 177.5° |
O15 | C15 | C16 | H24 | 67.7° | 62.3° |
C15 | O15 | C19 | C18 | 59.7° | 61.1° |
C15 | O15 | C19 | C20 | 173.8° | 178.8° |
C15 | O15 | C19 | H27 | 57.4° | 58.9° |
H23 | C15 | C16 | C17 | 172.3° | 177.6° |
H23 | C15 | C16 | O12 | 65.1° | 62.5° |
H23 | C15 | C16 | H24 | 54.3° | 57.7° |
H23 | C15 | O15 | C19 | 174.8° | 178.9° |
C17 | C16 | O12 | H24 | 117.0° | 120.2° |
C16 | C17 | C18 | O13 | 119.4° | 119.9° |
C16 | C17 | C18 | H25 | 119.4° | 119.9° |
C16 | C17 | O13 | H25 | 120.4° | 120.2° |
C16 | C17 | C18 | C19 | 55.4° | 57.0° |
C16 | C17 | C18 | O14 | 67.3° | 62.9° |
C16 | C17 | C18 | H26 | 172.6° | 176.9° |
C17 | C16 | O12 | H31 | 55.4° | 177.1° |
C16 | C17 | O13 | H32 | 180.0° | 59.9° |
C17 | C16 | C15 | O7 | 69.3° | 62.4° |
O12 | C16 | C17 | C18 | 176.6° | 176.9° |
O12 | C16 | C17 | O13 | 64.4° | 63.2° |
O12 | C16 | C17 | H25 | 57.1° | 57.0° |
O12 | C16 | C15 | O7 | 53.3° | 57.6° |
H24 | C16 | C17 | C18 | 65.4° | 62.9° |
H24 | C16 | C17 | O13 | 53.6° | 57.0° |
H24 | C16 | C17 | H25 | 175.0° | 177.2° |
H24 | C16 | O12 | H31 | 61.6° | 56.9° |
H24 | C16 | C15 | O7 | 172.7° | 177.7° |
C18 | C17 | O13 | H25 | 120.3° | 120.2° |
C17 | C18 | C19 | O14 | 121.7° | 119.9° |
C17 | C18 | C19 | H26 | 117.3° | 119.9° |
C17 | C18 | O14 | H26 | 119.3° | 120.1° |
C17 | C18 | C19 | C20 | 175.7° | 177.6° |
C17 | C18 | C19 | O15 | 59.1° | 57.6° |
C17 | C18 | C19 | H27 | 58.7° | 62.4° |
C18 | C17 | O13 | H32 | 60.7° | 179.5° |
C17 | C18 | O14 | H33 | 180.0° | 180.0° |
O13 | C17 | C18 | C19 | 174.8° | 176.8° |
O13 | C17 | C18 | O14 | 52.1° | 57.0° |
O13 | C17 | C18 | H26 | 68.0° | 63.2° |
H25 | C17 | C18 | C19 | 64.0° | 62.9° |
H25 | C17 | C18 | O14 | 173.3° | 177.2° |
H25 | C17 | C18 | H26 | 53.2° | 57.0° |
H25 | C17 | O13 | H32 | 59.6° | 60.3° |
C19 | C18 | O14 | H26 | 120.2° | 120.2° |
C18 | C19 | C20 | O15 | 125.9° | 120.0° |
C18 | C19 | C20 | H27 | 116.8° | 120.0° |
C18 | C19 | O15 | H27 | 117.0° | 120.0° |
C18 | C19 | C20 | H28 | 180.0° | 66.3° |
C18 | C19 | C20 | H29 | 60.0° | 173.6° |
C18 | C19 | C20 | H30 | 60.0° | 53.7° |
C19 | C18 | O14 | H33 | 59.5° | 60.3° |
O14 | C18 | C19 | C20 | 62.6° | 57.7° |
O14 | C18 | C19 | O15 | 62.6° | 62.3° |
O14 | C18 | C19 | H27 | 179.6° | 177.7° |
H26 | C18 | C19 | C20 | 58.4° | 62.5° |
H26 | C18 | C19 | O15 | 176.4° | 177.5° |
H26 | C18 | C19 | H27 | 58.6° | 57.5° |
H26 | C18 | O14 | H33 | 60.7° | 59.8° |
C20 | C19 | O15 | H27 | 116.5° | 120.0° |
C19 | C20 | H28 | H29 | 120.0° | 120.0° |
C19 | C20 | H28 | H30 | 120.0° | 120.0° |
C19 | C20 | H29 | H30 | 120.0° | 119.9° |
O15 | C19 | C20 | H28 | 54.1° | 173.6° |
O15 | C19 | C20 | H29 | 65.9° | 53.6° |
O15 | C19 | C20 | H30 | 174.1° | 66.3° |
C19 | O15 | C15 | O7 | 63.2° | 58.9° |
H27 | C19 | C20 | H28 | 63.2° | 53.7° |
H27 | C19 | C20 | H29 | 176.9° | 66.3° |
H27 | C19 | C20 | H30 | 56.9° | 173.7° |
H28 | C20 | H29 | H30 | 120.0° | 120.1° |
C25 | O16 | C21 | C22 | 66.5° | 61.2° |
C25 | O16 | C21 | H34 | 179.2° | 178.8° |
O16 | C25 | C24 | C23 | 56.8° | 57.6° |
O16 | C25 | C24 | O18 | 62.5° | 62.2° |
O16 | C25 | C24 | H39 | 176.6° | 177.6° |
O16 | C25 | C24 | C26 | 114.1° | 119.9° |
O16 | C25 | C24 | H41 | 121.3° | 120.1° |
O16 | C25 | C26 | H41 | 119.6° | 120.1° |
O16 | C25 | C26 | O19 | 63.1° | 66.4° |
O16 | C25 | C26 | H42 | 176.4° | 173.7° |
O16 | C25 | C26 | H46 | 57.4° | 53.7° |
C25 | O16 | C21 | O8 | 58.4° | 58.8° |
O16 | C21 | C22 | H34 | 114.8° | 120.0° |
O16 | C21 | C22 | O8 | 124.6° | 120.0° |
O16 | C21 | H34 | O8 | 122.8° | 120.0° |
O16 | C21 | C22 | C23 | 60.9° | 57.6° |
O16 | C21 | C22 | H35 | 58.1° | 62.3° |
O16 | C21 | C22 | N2 | 178.5° | 177.5° |
C21 | O16 | C25 | C24 | 63.8° | 61.2° |
C21 | O16 | C25 | C26 | 175.5° | 178.9° |
C21 | O16 | C25 | H41 | 57.0° | 58.8° |
C22 | C21 | H34 | O8 | 122.8° | 120.0° |
C21 | C22 | C23 | H35 | 119.1° | 119.9° |
C21 | C22 | C23 | N2 | 120.5° | 119.9° |
C21 | C22 | H35 | N2 | 120.2° | 120.2° |
C21 | C22 | N2 | H36 | 70.8° | 95.0° |
C21 | C22 | C23 | C24 | 56.7° | 57.0° |
C21 | C22 | C23 | O17 | 177.9° | 176.9° |
C21 | C22 | C23 | H37 | 61.5° | 62.9° |
C21 | C22 | N2 | C27 | 109.2° | 85.0° |
H34 | C21 | C22 | C23 | 175.7° | 177.6° |
H34 | C21 | C22 | H35 | 56.7° | 57.7° |
H34 | C21 | C22 | N2 | 63.6° | 62.5° |
C23 | C22 | H35 | N2 | 120.5° | 120.2° |
C23 | C22 | N2 | H36 | 49.6° | 24.7° |
C22 | C23 | C24 | O17 | 119.8° | 119.9° |
C22 | C23 | C24 | H37 | 118.4° | 119.9° |
C22 | C23 | O17 | H37 | 119.8° | 120.2° |
C22 | C23 | O17 | H38 | 180.0° | 180.0° |
C22 | C23 | C24 | O18 | 64.9° | 62.9° |
C22 | C23 | C24 | H39 | 175.8° | 177.0° |
C22 | C23 | C24 | C25 | 55.6° | 57.0° |
C23 | C22 | N2 | C27 | 130.5° | 155.3° |
C23 | C22 | C21 | O8 | 63.7° | 62.4° |
H35 | C22 | N2 | H36 | 169.5° | 144.8° |
H35 | C22 | C23 | C24 | 62.4° | 62.9° |
H35 | C22 | C23 | O17 | 58.8° | 57.0° |
H35 | C22 | C23 | H37 | 179.5° | 177.2° |
H35 | C22 | N2 | C27 | 10.5° | 35.2° |
H35 | C22 | C21 | O8 | 177.2° | 177.7° |
C22 | N2 | H36 | C27 | 180.0° | 180.0° |
N2 | C22 | C23 | C24 | 177.2° | 176.9° |
N2 | C22 | C23 | O17 | 61.6° | 63.2° |
N2 | C22 | C23 | H37 | 59.0° | 57.0° |
C22 | N2 | C27 | O20 | 1.2° | 0.0° |
C22 | N2 | C27 | C28 | 179.4° | 180.0° |
N2 | C22 | C21 | O8 | 56.9° | 57.5° |
H36 | N2 | C27 | O20 | 178.8° | 180.0° |
H36 | N2 | C27 | C28 | 0.6° | 0.0° |
C24 | C23 | O17 | H37 | 120.7° | 120.2° |
C24 | C23 | O17 | H38 | 60.5° | 60.4° |
C23 | C24 | O18 | H39 | 118.1° | 120.1° |
C23 | C24 | O18 | C25 | 121.7° | 119.7° |
C23 | C24 | H39 | C25 | 121.8° | 119.7° |
C23 | C24 | O18 | H40 | 180.0° | 180.0° |
C23 | C24 | C25 | C26 | 170.9° | 177.6° |
C23 | C24 | C25 | H41 | 64.6° | 62.4° |
O17 | C23 | C24 | O18 | 54.8° | 57.0° |
O17 | C23 | C24 | H39 | 64.4° | 63.1° |
O17 | C23 | C24 | C25 | 175.4° | 176.9° |
H37 | C23 | O17 | H38 | 60.2° | 59.8° |
H37 | C23 | C24 | O18 | 176.6° | 177.2° |
H37 | C23 | C24 | H39 | 57.3° | 57.1° |
H37 | C23 | C24 | C25 | 62.8° | 62.9° |
O18 | C24 | H39 | C25 | 120.7° | 120.2° |
O18 | C24 | C25 | C26 | 51.7° | 57.7° |
O18 | C24 | C25 | H41 | 176.2° | 177.7° |
H39 | C24 | O18 | H40 | 61.9° | 59.9° |
H39 | C24 | C25 | C26 | 69.3° | 62.5° |
H39 | C24 | C25 | H41 | 55.3° | 57.5° |
H40 | O18 | C24 | C25 | 58.3° | 60.4° |
C24 | C25 | C26 | H41 | 124.9° | 120.0° |
C24 | C25 | C26 | O19 | 178.6° | 173.7° |
C24 | C25 | C26 | H42 | 60.9° | 53.8° |
C24 | C25 | C26 | H46 | 58.1° | 66.2° |
C25 | C26 | O19 | H42 | 120.5° | 120.0° |
C25 | C26 | O19 | H46 | 120.5° | 120.1° |
C25 | C26 | H42 | H46 | 118.4° | 120.0° |
C25 | C26 | O19 | H47 | 180.0° | 180.0° |
H41 | C25 | C26 | O19 | 56.5° | 53.7° |
H41 | C25 | C26 | H42 | 64.0° | 66.2° |
H41 | C25 | C26 | H46 | 177.0° | 173.8° |
O19 | C26 | H42 | H46 | 118.5° | 120.0° |
H42 | C26 | O19 | H47 | 59.5° | 60.0° |
N2 | C27 | O20 | C28 | 179.4° | 180.0° |
N2 | C27 | C28 | H43 | 179.4° | 60.0° |
N2 | C27 | C28 | H44 | 59.4° | 180.0° |
N2 | C27 | C28 | H45 | 60.5° | 59.9° |
O20 | C27 | C28 | H43 | 0.0° | 120.0° |
O20 | C27 | C28 | H44 | 120.0° | 0.0° |
O20 | C27 | C28 | H45 | 120.0° | 120.0° |
C27 | C28 | H43 | H44 | 120.0° | 120.0° |
C27 | C28 | H43 | H45 | 120.0° | 120.0° |
C27 | C28 | H44 | H45 | 120.0° | 120.1° |
H43 | C28 | H44 | H45 | 120.0° | 120.0° |
H46 | C26 | O19 | H47 | 59.5° | 59.9° |
C30 | C29 | O24 | H48 | 115.8° | 120.0° |
C30 | C29 | O24 | O2 | 125.1° | 120.0° |
C30 | C29 | H48 | O2 | 118.1° | 120.0° |
C29 | C30 | C31 | O21 | 127.4° | 120.0° |
C29 | C30 | C31 | H49 | 115.3° | 119.9° |
C29 | C30 | O21 | H49 | 118.1° | 120.1° |
C29 | C30 | C31 | C32 | 55.9° | 56.9° |
C29 | C30 | C31 | O22 | 175.4° | 176.8° |
C29 | C30 | C31 | H50 | 62.3° | 62.9° |
C30 | C29 | O24 | C33 | 55.6° | 61.1° |
C29 | C30 | O21 | H56 | 180.0° | 59.9° |
O24 | C29 | H48 | O2 | 123.3° | 120.0° |
O24 | C29 | C30 | C31 | 56.4° | 57.6° |
O24 | C29 | C30 | O21 | 177.8° | 177.5° |
O24 | C29 | C30 | H49 | 58.9° | 62.3° |
C29 | O24 | C33 | C32 | 53.2° | 61.2° |
C29 | O24 | C33 | C34 | 172.6° | 178.9° |
C29 | O24 | C33 | H52 | 67.5° | 58.8° |
H48 | C29 | C30 | C31 | 173.0° | 177.6° |
H48 | C29 | C30 | O21 | 61.2° | 62.4° |
H48 | C29 | C30 | H49 | 57.7° | 57.7° |
H48 | C29 | O24 | C33 | 171.4° | 178.8° |
C31 | C30 | O21 | H49 | 116.5° | 120.1° |
C30 | C31 | C32 | O22 | 122.0° | 119.9° |
C30 | C31 | C32 | H50 | 118.1° | 119.8° |
C30 | C31 | O22 | H50 | 121.4° | 120.2° |
C30 | C31 | C32 | C33 | 53.9° | 56.9° |
C30 | C31 | C32 | O23 | 66.9° | 63.0° |
C30 | C31 | C32 | H51 | 173.7° | 176.9° |
C31 | C30 | O21 | H56 | 54.6° | 179.7° |
C30 | C31 | O22 | H57 | 180.0° | 60.0° |
C31 | C30 | C29 | O2 | 70.8° | 62.4° |
O21 | C30 | C31 | C32 | 176.7° | 176.9° |
O21 | C30 | C31 | O22 | 57.3° | 63.2° |
O21 | C30 | C31 | H50 | 65.1° | 57.1° |
O21 | C30 | C29 | O2 | 55.0° | 57.6° |
H49 | C30 | C31 | C32 | 59.4° | 63.0° |
H49 | C30 | C31 | O22 | 60.1° | 56.9° |
H49 | C30 | C31 | H50 | 177.5° | 177.2° |
H49 | C30 | O21 | H56 | 61.9° | 60.2° |
H49 | C30 | C29 | O2 | 173.9° | 177.7° |
C32 | C31 | O22 | H50 | 118.9° | 120.2° |
C31 | C32 | C33 | O23 | 120.1° | 119.9° |
C31 | C32 | C33 | H51 | 119.8° | 119.9° |
C31 | C32 | O23 | H51 | 118.4° | 120.2° |
C31 | C32 | C33 | C34 | 172.8° | 177.6° |
C31 | C32 | C33 | O24 | 52.0° | 57.6° |
C31 | C32 | C33 | H52 | 69.6° | 62.4° |
C32 | C31 | O22 | H57 | 60.3° | 179.6° |
C31 | C32 | O23 | H58 | 180.0° | 180.0° |
O22 | C31 | C32 | C33 | 176.0° | 176.9° |
O22 | C31 | C32 | O23 | 55.1° | 57.0° |
O22 | C31 | C32 | H51 | 64.3° | 63.2° |
H50 | C31 | C32 | C33 | 64.2° | 62.9° |
H50 | C31 | C32 | O23 | 175.0° | 177.2° |
H50 | C31 | C32 | H51 | 55.6° | 57.1° |
H50 | C31 | O22 | H57 | 58.6° | 60.3° |
C33 | C32 | O23 | H51 | 119.1° | 120.2° |
C32 | C33 | C34 | O24 | 121.9° | 119.9° |
C32 | C33 | C34 | H52 | 117.5° | 120.0° |
C32 | C33 | O24 | H52 | 120.7° | 120.0° |
C32 | C33 | C34 | H53 | 180.0° | 66.4° |
C32 | C33 | C34 | H54 | 60.0° | 173.7° |
C32 | C33 | C34 | H55 | 60.0° | 53.6° |
C33 | C32 | O23 | H58 | 57.5° | 60.3° |
O23 | C32 | C33 | C34 | 52.8° | 57.7° |
O23 | C32 | C33 | O24 | 68.1° | 62.3° |
O23 | C32 | C33 | H52 | 170.4° | 177.7° |
H51 | C32 | C33 | C34 | 67.4° | 62.5° |
H51 | C32 | C33 | O24 | 171.8° | 177.5° |
H51 | C32 | C33 | H52 | 50.2° | 57.5° |
H51 | C32 | O23 | H58 | 61.7° | 59.9° |
C34 | C33 | O24 | H52 | 119.9° | 120.0° |
C33 | C34 | H53 | H54 | 120.0° | 120.0° |
C33 | C34 | H53 | H55 | 120.0° | 120.0° |
C33 | C34 | H54 | H55 | 120.0° | 120.0° |
O24 | C33 | C34 | H53 | 58.1° | 173.7° |
O24 | C33 | C34 | H54 | 61.9° | 53.7° |
O24 | C33 | C34 | H55 | 178.1° | 66.3° |
C33 | O24 | C29 | O2 | 69.5° | 58.8° |
H52 | C33 | C34 | H53 | 62.5° | 53.7° |
H52 | C33 | C34 | H54 | 177.5° | 66.3° |
H52 | C33 | C34 | H55 | 57.5° | 173.7° |
H53 | C34 | H54 | H55 | 119.9° | 120.1° |