PRD_000142
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N1 | C1 | sing | 1.47Å | 1.43Å | |
N1 | H1 | sing | 0.97Å | 1.00Å | |
C1 | C2 | sing | 1.53Å | 1.54Å | |
C1 | C3 | sing | 1.50Å | 1.52Å | |
C1 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H3 | sing | 1.09Å | 1.10Å | |
C2 | H4 | sing | 1.09Å | 1.10Å | |
C2 | H5 | sing | 1.09Å | 1.10Å | |
C3 | O1 | doub | 1.22Å | 1.22Å | |
N2 | C4 | sing | 1.47Å | 1.48Å | |
N2 | C5 | sing | 1.48Å | 1.47Å | |
C4 | H6 | sing | 1.09Å | 1.10Å | |
C4 | H7 | sing | 1.09Å | 1.10Å | |
C4 | H8 | sing | 1.09Å | 1.10Å | |
C5 | C6 | sing | 1.53Å | 1.52Å | |
C5 | C10 | sing | 1.50Å | 1.54Å | |
C5 | H9 | sing | 1.08Å | 1.10Å | |
C6 | C7 | sing | 1.53Å | 1.55Å | |
C6 | H10 | sing | 1.09Å | 1.10Å | |
C6 | H11 | sing | 1.09Å | 1.10Å | |
C7 | C8 | sing | 1.53Å | 1.55Å | |
C7 | C9 | sing | 1.53Å | 1.52Å | |
C7 | H12 | sing | 1.09Å | 1.10Å | |
C8 | H13 | sing | 1.09Å | 1.10Å | |
C8 | H14 | sing | 1.09Å | 1.10Å | |
C8 | H15 | sing | 1.09Å | 1.10Å | |
C9 | H16 | sing | 1.09Å | 1.10Å | |
C9 | H17 | sing | 1.09Å | 1.10Å | |
C9 | H18 | sing | 1.09Å | 1.10Å | |
C10 | O2 | doub | 1.22Å | 1.23Å | |
N3 | C11 | sing | 1.47Å | 1.46Å | |
N3 | C12 | sing | 1.48Å | 1.48Å | |
C11 | H19 | sing | 1.09Å | 1.10Å | |
C11 | H20 | sing | 1.09Å | 1.10Å | |
C11 | H21 | sing | 1.09Å | 1.10Å | |
C12 | C13 | sing | 1.54Å | 1.53Å | |
C12 | C17 | sing | 1.50Å | 1.55Å | |
C12 | H22 | sing | 1.09Å | 1.10Å | |
C13 | C14 | sing | 1.53Å | 1.54Å | |
C13 | H23 | sing | 1.09Å | 1.10Å | |
C13 | H24 | sing | 1.09Å | 1.10Å | |
C14 | C15 | sing | 1.53Å | 1.56Å | |
C14 | C16 | sing | 1.53Å | 1.53Å | |
C14 | H25 | sing | 1.09Å | 1.10Å | |
C15 | H26 | sing | 1.09Å | 1.10Å | |
C15 | H27 | sing | 1.09Å | 1.10Å | |
C15 | H28 | sing | 1.09Å | 1.10Å | |
C16 | H29 | sing | 1.09Å | 1.10Å | |
C16 | H30 | sing | 1.09Å | 1.10Å | |
C16 | H31 | sing | 1.09Å | 1.10Å | |
C17 | O3 | doub | 1.22Å | 1.22Å | |
N4 | C18 | sing | 1.47Å | 1.48Å | |
N4 | C19 | sing | 1.48Å | 1.48Å | |
C18 | H32 | sing | 1.09Å | 1.10Å | |
C18 | H33 | sing | 1.09Å | 1.10Å | |
C18 | H34 | sing | 1.09Å | 1.10Å | |
C19 | C20 | sing | 1.54Å | 1.54Å | |
C19 | C23 | sing | 1.50Å | 1.55Å | |
C19 | H35 | sing | 1.08Å | 1.10Å | |
C20 | C21 | sing | 1.53Å | 1.52Å | |
C20 | C22 | sing | 1.53Å | 1.52Å | |
C20 | H36 | sing | 1.09Å | 1.10Å | |
C21 | H37 | sing | 1.09Å | 1.10Å | |
C21 | H38 | sing | 1.09Å | 1.10Å | |
C21 | H39 | sing | 1.09Å | 1.10Å | |
C22 | H40 | sing | 1.09Å | 1.10Å | |
C22 | H41 | sing | 1.09Å | 1.10Å | |
C22 | H42 | sing | 1.09Å | 1.10Å | |
C23 | O4 | doub | 1.22Å | 1.23Å | |
N5 | C24 | sing | 1.47Å | 1.48Å | |
N5 | C25 | sing | 1.49Å | 1.46Å | |
C24 | H43 | sing | 1.09Å | 1.10Å | |
C24 | H44 | sing | 1.09Å | 1.10Å | |
C24 | H45 | sing | 1.09Å | 1.10Å | |
C25 | C26 | sing | 1.50Å | 1.52Å | |
C25 | C27 | sing | 1.53Å | 1.54Å | |
C25 | H46 | sing | 1.09Å | 1.10Å | |
C26 | O5 | doub | 1.22Å | 1.23Å | |
C27 | O6 | sing | 1.43Å | 1.43Å | |
C27 | C28 | sing | 1.53Å | 1.53Å | |
C27 | H47 | sing | 1.09Å | 1.10Å | |
O6 | H48 | sing | 0.97Å | 0.95Å | |
C28 | C29 | sing | 1.53Å | 1.54Å | |
C28 | C30 | sing | 1.53Å | 1.55Å | |
C28 | H49 | sing | 1.09Å | 1.10Å | |
C29 | H50 | sing | 1.09Å | 1.10Å | |
C29 | H51 | sing | 1.09Å | 1.10Å | |
C29 | H52 | sing | 1.09Å | 1.10Å | |
C30 | C31 | sing | 1.51Å | 1.51Å | |
C30 | H53 | sing | 1.09Å | 1.10Å | |
C30 | H54 | sing | 1.09Å | 1.10Å | |
C31 | C32 | doub | 1.31Å | 1.33Å | |
C31 | H55 | sing | 1.08Å | 1.08Å | |
C32 | C33 | sing | 1.51Å | 1.52Å | |
C32 | H56 | sing | 1.08Å | 1.08Å | |
C33 | H57 | sing | 1.09Å | 1.10Å | |
C33 | H58 | sing | 1.09Å | 1.10Å | |
C33 | H59 | sing | 1.09Å | 1.10Å | |
N6 | C34 | sing | 1.48Å | 1.49Å | |
N6 | H60 | sing | 0.97Å | 1.00Å | |
C34 | C35 | sing | 1.50Å | 1.54Å | |
C34 | C36 | sing | 1.54Å | 1.53Å | |
C34 | H61 | sing | 1.09Å | 1.10Å | |
C35 | O7 | doub | 1.22Å | 1.20Å | |
C36 | C37 | sing | 1.53Å | 1.54Å | |
C36 | H62 | sing | 1.09Å | 1.10Å | |
C36 | H63 | sing | 1.09Å | 1.10Å | |
C37 | H64 | sing | 1.09Å | 1.10Å | |
C37 | H65 | sing | 1.09Å | 1.10Å | |
C37 | H66 | sing | 1.09Å | 1.10Å | |
N7 | C38 | sing | 1.48Å | 1.47Å | |
N7 | C40 | sing | 1.46Å | 1.46Å | |
C38 | C39 | sing | 1.50Å | 1.55Å | |
C38 | H67 | sing | 1.10Å | 1.10Å | |
C38 | H68 | sing | 1.09Å | 1.10Å | |
C39 | O8 | doub | 1.22Å | 1.22Å | |
C40 | H69 | sing | 1.09Å | 1.10Å | |
C40 | H70 | sing | 1.09Å | 1.10Å | |
C40 | H71 | sing | 1.09Å | 1.10Å | |
N8 | C41 | sing | 1.46Å | 1.45Å | |
N8 | C42 | sing | 1.48Å | 1.46Å | |
C41 | H72 | sing | 1.09Å | 1.10Å | |
C41 | H73 | sing | 1.09Å | 1.10Å | |
C41 | H74 | sing | 1.09Å | 1.10Å | |
C42 | C43 | sing | 1.53Å | 1.54Å | |
C42 | C47 | sing | 1.50Å | 1.53Å | |
C42 | H75 | sing | 1.09Å | 1.10Å | |
C43 | C44 | sing | 1.53Å | 1.53Å | |
C43 | H76 | sing | 1.09Å | 1.10Å | |
C43 | H77 | sing | 1.09Å | 1.10Å | |
C44 | C45 | sing | 1.53Å | 1.49Å | |
C44 | C46 | sing | 1.53Å | 1.54Å | |
C44 | H78 | sing | 1.09Å | 1.10Å | |
C45 | H79 | sing | 1.09Å | 1.10Å | |
C45 | H80 | sing | 1.09Å | 1.10Å | |
C45 | H81 | sing | 1.09Å | 1.10Å | |
C46 | H82 | sing | 1.09Å | 1.10Å | |
C46 | H83 | sing | 1.09Å | 1.10Å | |
C46 | H84 | sing | 1.09Å | 1.10Å | |
C47 | O9 | doub | 1.23Å | 1.25Å | |
N9 | C48 | sing | 1.47Å | 1.47Å | |
N9 | H85 | sing | 0.99Å | 1.00Å | |
C48 | C49 | sing | 1.51Å | 1.54Å | |
C48 | C50 | sing | 1.53Å | 1.51Å | |
C48 | H86 | sing | 1.09Å | 1.10Å | |
C49 | O10 | doub | 1.22Å | 1.21Å | |
C50 | C51 | sing | 1.53Å | 1.51Å | |
C50 | C52 | sing | 1.53Å | 1.57Å | |
C50 | H87 | sing | 1.09Å | 1.10Å | |
C51 | H88 | sing | 1.09Å | 1.10Å | |
C51 | H89 | sing | 1.09Å | 1.10Å | |
C51 | H90 | sing | 1.09Å | 1.10Å | |
C52 | H91 | sing | 1.09Å | 1.10Å | |
C52 | H92 | sing | 1.09Å | 1.10Å | |
C52 | H93 | sing | 1.09Å | 1.10Å | |
N10 | C53 | sing | 1.47Å | 1.46Å | |
N10 | C54 | sing | 1.48Å | 1.46Å | |
C53 | H94 | sing | 1.09Å | 1.10Å | |
C53 | H95 | sing | 1.09Å | 1.10Å | |
C53 | H96 | sing | 1.09Å | 1.10Å | |
C54 | C55 | sing | 1.53Å | 1.54Å | |
C54 | C59 | sing | 1.50Å | 1.51Å | |
C54 | H97 | sing | 1.09Å | 1.10Å | |
C55 | C56 | sing | 1.53Å | 1.51Å | |
C55 | H98 | sing | 1.09Å | 1.10Å | |
C55 | H99 | sing | 1.09Å | 1.10Å | |
C56 | C57 | sing | 1.53Å | 1.51Å | |
C56 | C58 | sing | 1.53Å | 1.52Å | |
C56 | H100 | sing | 1.09Å | 1.10Å | |
C57 | H101 | sing | 1.09Å | 1.10Å | |
C57 | H102 | sing | 1.09Å | 1.10Å | |
C57 | H103 | sing | 1.09Å | 1.10Å | |
C58 | H104 | sing | 1.09Å | 1.10Å | |
C58 | H105 | sing | 1.09Å | 1.10Å | |
C58 | H106 | sing | 1.09Å | 1.10Å | |
C59 | O11 | doub | 1.22Å | 1.21Å | |
N11 | C60 | sing | 1.48Å | 1.45Å | |
N11 | H107 | sing | 0.97Å | 1.00Å | |
C60 | C61 | sing | 1.51Å | 1.51Å | |
C60 | C62 | sing | 1.53Å | 1.55Å | |
C60 | H108 | sing | 1.09Å | 1.10Å | |
C61 | O12 | doub | 1.21Å | 1.22Å | |
C62 | H109 | sing | 1.09Å | 1.10Å | |
C62 | H110 | sing | 1.09Å | 1.10Å | |
C62 | H111 | sing | 1.09Å | 1.10Å | |
N1 | C61 | sing | 1.34Å | 1.33Å | |
C3 | N2 | sing | 1.36Å | 1.36Å | |
C10 | N3 | sing | 1.37Å | 1.35Å | |
C17 | N4 | sing | 1.36Å | 1.34Å | |
C23 | N5 | sing | 1.36Å | 1.34Å | |
C26 | N6 | sing | 1.36Å | 1.35Å | |
C35 | N7 | sing | 1.37Å | 1.35Å | |
C39 | N8 | sing | 1.36Å | 1.32Å | |
C47 | N9 | sing | 1.35Å | 1.31Å | |
C49 | N10 | sing | 1.36Å | 1.34Å | |
C59 | N11 | sing | 1.36Å | 1.37Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C1 | N1 | H1 | 119.3° | 119.3° |
N1 | C1 | C2 | 110.2° | 108.6° |
N1 | C1 | C3 | 110.9° | 109.0° |
N1 | C1 | H2 | 110.4° | 108.8° |
C1 | N1 | C61 | 121.6° | 120.1° |
H1 | N1 | C61 | 119.2° | 120.5° |
C2 | C1 | C3 | 107.2° | 109.7° |
C2 | C1 | H2 | 108.9° | 109.9° |
C1 | C2 | H3 | 109.5° | 109.4° |
C1 | C2 | H4 | 109.5° | 109.5° |
C1 | C2 | H5 | 109.4° | 109.5° |
C3 | C1 | H2 | 109.1° | 110.9° |
C1 | C3 | O1 | 119.6° | 119.0° |
C1 | C3 | N2 | 119.0° | 122.5° |
H3 | C2 | H4 | 109.5° | 109.4° |
H3 | C2 | H5 | 109.5° | 109.4° |
H4 | C2 | H5 | 109.5° | 109.5° |
O1 | C3 | N2 | 121.5° | 118.5° |
C4 | N2 | C5 | 118.7° | 120.3° |
N2 | C4 | H6 | 109.5° | 109.5° |
N2 | C4 | H7 | 109.5° | 109.5° |
N2 | C4 | H8 | 109.5° | 109.5° |
C4 | N2 | C3 | 121.9° | 120.0° |
N2 | C5 | C6 | 110.8° | 108.3° |
N2 | C5 | C10 | 110.0° | 109.1° |
N2 | C5 | H9 | 109.3° | 109.8° |
C5 | N2 | C3 | 119.3° | 119.6° |
H6 | C4 | H7 | 109.5° | 109.5° |
H6 | C4 | H8 | 109.5° | 109.5° |
H7 | C4 | H8 | 109.5° | 109.5° |
C6 | C5 | C10 | 109.6° | 109.3° |
C6 | C5 | H9 | 108.7° | 109.3° |
C5 | C6 | C7 | 115.0° | 109.5° |
C5 | C6 | H10 | 108.1° | 109.4° |
C5 | C6 | H11 | 108.1° | 109.5° |
C10 | C5 | H9 | 108.5° | 111.1° |
C5 | C10 | O2 | 119.4° | 119.4° |
C5 | C10 | N3 | 118.4° | 120.9° |
C7 | C6 | H10 | 108.1° | 109.5° |
C7 | C6 | H11 | 108.1° | 109.5° |
C6 | C7 | C8 | 107.4° | 109.5° |
C6 | C7 | C9 | 110.6° | 109.5° |
C6 | C7 | H12 | 108.7° | 109.4° |
H10 | C6 | H11 | 109.5° | 109.4° |
C8 | C7 | C9 | 112.3° | 109.5° |
C8 | C7 | H12 | 108.7° | 109.5° |
C7 | C8 | H13 | 109.5° | 109.5° |
C7 | C8 | H14 | 109.5° | 109.5° |
C7 | C8 | H15 | 109.5° | 109.4° |
C9 | C7 | H12 | 109.1° | 109.5° |
C7 | C9 | H16 | 109.5° | 109.5° |
C7 | C9 | H17 | 109.4° | 109.4° |
C7 | C9 | H18 | 109.5° | 109.5° |
H13 | C8 | H14 | 109.5° | 109.5° |
H13 | C8 | H15 | 109.5° | 109.5° |
H14 | C8 | H15 | 109.4° | 109.4° |
H16 | C9 | H17 | 109.5° | 109.5° |
H16 | C9 | H18 | 109.4° | 109.5° |
H17 | C9 | H18 | 109.5° | 109.4° |
O2 | C10 | N3 | 122.1° | 119.6° |
C11 | N3 | C12 | 118.4° | 121.8° |
N3 | C11 | H19 | 109.5° | 109.5° |
N3 | C11 | H20 | 109.5° | 109.4° |
N3 | C11 | H21 | 109.5° | 109.5° |
C11 | N3 | C10 | 124.6° | 122.6° |
N3 | C12 | C13 | 112.7° | 109.1° |
N3 | C12 | C17 | 109.9° | 110.2° |
N3 | C12 | H22 | 108.2° | 109.0° |
C12 | N3 | C10 | 116.8° | 115.6° |
H19 | C11 | H20 | 109.5° | 109.5° |
H19 | C11 | H21 | 109.5° | 109.5° |
H20 | C11 | H21 | 109.4° | 109.4° |
C13 | C12 | C17 | 111.0° | 108.0° |
C13 | C12 | H22 | 107.5° | 108.6° |
C12 | C13 | C14 | 112.9° | 109.5° |
C12 | C13 | H23 | 108.6° | 109.5° |
C12 | C13 | H24 | 108.6° | 109.5° |
C17 | C12 | H22 | 107.3° | 112.0° |
C12 | C17 | O3 | 120.9° | 119.0° |
C12 | C17 | N4 | 116.5° | 122.2° |
C14 | C13 | H23 | 108.6° | 109.5° |
C14 | C13 | H24 | 108.6° | 109.5° |
C13 | C14 | C15 | 107.4° | 109.5° |
C13 | C14 | C16 | 114.6° | 109.5° |
C13 | C14 | H25 | 108.7° | 109.5° |
H23 | C13 | H24 | 109.5° | 109.5° |
C15 | C14 | C16 | 108.6° | 109.5° |
C15 | C14 | H25 | 108.4° | 109.5° |
C14 | C15 | H26 | 109.5° | 109.4° |
C14 | C15 | H27 | 109.5° | 109.5° |
C14 | C15 | H28 | 109.5° | 109.5° |
C16 | C14 | H25 | 108.9° | 109.4° |
C14 | C16 | H29 | 109.5° | 109.5° |
C14 | C16 | H30 | 109.5° | 109.4° |
C14 | C16 | H31 | 109.5° | 109.4° |
H26 | C15 | H27 | 109.5° | 109.5° |
H26 | C15 | H28 | 109.5° | 109.5° |
H27 | C15 | H28 | 109.4° | 109.4° |
H29 | C16 | H30 | 109.4° | 109.5° |
H29 | C16 | H31 | 109.5° | 109.5° |
H30 | C16 | H31 | 109.5° | 109.5° |
O3 | C17 | N4 | 122.6° | 118.8° |
C18 | N4 | C19 | 114.3° | 119.9° |
N4 | C18 | H32 | 109.5° | 109.5° |
N4 | C18 | H33 | 109.5° | 109.5° |
N4 | C18 | H34 | 109.4° | 109.5° |
C18 | N4 | C17 | 126.0° | 123.6° |
N4 | C19 | C20 | 114.1° | 108.2° |
N4 | C19 | C23 | 107.8° | 109.5° |
N4 | C19 | H35 | 108.5° | 109.2° |
C19 | N4 | C17 | 119.4° | 116.5° |
H32 | C18 | H33 | 109.5° | 109.5° |
H32 | C18 | H34 | 109.5° | 109.5° |
H33 | C18 | H34 | 109.5° | 109.4° |
C20 | C19 | C23 | 111.0° | 108.9° |
C20 | C19 | H35 | 107.7° | 108.6° |
C19 | C20 | C21 | 106.7° | 109.5° |
C19 | C20 | C22 | 111.0° | 109.5° |
C19 | C20 | H36 | 109.0° | 109.5° |
C23 | C19 | H35 | 107.5° | 112.3° |
C19 | C23 | O4 | 120.2° | 118.9° |
C19 | C23 | N5 | 116.7° | 121.9° |
C21 | C20 | C22 | 111.6° | 109.5° |
C21 | C20 | H36 | 109.3° | 109.5° |
C20 | C21 | H37 | 109.5° | 109.5° |
C20 | C21 | H38 | 109.5° | 109.5° |
C20 | C21 | H39 | 109.5° | 109.4° |
C22 | C20 | H36 | 109.2° | 109.5° |
C20 | C22 | H40 | 109.5° | 109.5° |
C20 | C22 | H41 | 109.5° | 109.5° |
C20 | C22 | H42 | 109.5° | 109.4° |
H37 | C21 | H38 | 109.5° | 109.5° |
H37 | C21 | H39 | 109.4° | 109.5° |
H38 | C21 | H39 | 109.5° | 109.5° |
H40 | C22 | H41 | 109.5° | 109.5° |
H40 | C22 | H42 | 109.4° | 109.5° |
H41 | C22 | H42 | 109.5° | 109.4° |
O4 | C23 | N5 | 123.1° | 119.2° |
C24 | N5 | C25 | 119.2° | 121.3° |
N5 | C24 | H43 | 109.5° | 109.5° |
N5 | C24 | H44 | 109.5° | 109.4° |
N5 | C24 | H45 | 109.4° | 109.5° |
C24 | N5 | C23 | 123.1° | 123.6° |
N5 | C25 | C26 | 110.5° | 110.1° |
N5 | C25 | C27 | 114.7° | 108.6° |
N5 | C25 | H46 | 106.9° | 109.1° |
C25 | N5 | C23 | 117.5° | 115.0° |
H43 | C24 | H44 | 109.5° | 109.4° |
H43 | C24 | H45 | 109.4° | 109.5° |
H44 | C24 | H45 | 109.5° | 109.5° |
C26 | C25 | C27 | 112.0° | 110.7° |
C26 | C25 | H46 | 106.2° | 109.1° |
C25 | C26 | O5 | 123.7° | 119.9° |
C25 | C26 | N6 | 111.9° | 121.0° |
C27 | C25 | H46 | 105.9° | 109.1° |
C25 | C27 | O6 | 107.1° | 109.4° |
C25 | C27 | C28 | 113.1° | 109.5° |
C25 | C27 | H47 | 107.4° | 109.5° |
O5 | C26 | N6 | 124.4° | 119.2° |
O6 | C27 | C28 | 112.6° | 109.4° |
O6 | C27 | H47 | 108.8° | 109.5° |
C27 | O6 | H48 | 109.5° | 114.0° |
C28 | C27 | H47 | 107.6° | 109.5° |
C27 | C28 | C29 | 111.1° | 109.5° |
C27 | C28 | C30 | 111.8° | 109.5° |
C27 | C28 | H49 | 108.4° | 109.5° |
C29 | C28 | C30 | 109.1° | 109.4° |
C29 | C28 | H49 | 108.2° | 109.4° |
C28 | C29 | H50 | 109.5° | 109.4° |
C28 | C29 | H51 | 109.5° | 109.5° |
C28 | C29 | H52 | 109.5° | 109.5° |
C30 | C28 | H49 | 108.0° | 109.5° |
C28 | C30 | C31 | 114.3° | 109.5° |
C28 | C30 | H53 | 108.3° | 109.5° |
C28 | C30 | H54 | 108.3° | 109.5° |
H50 | C29 | H51 | 109.5° | 109.5° |
H50 | C29 | H52 | 109.4° | 109.5° |
H51 | C29 | H52 | 109.5° | 109.5° |
C31 | C30 | H53 | 108.3° | 109.4° |
C31 | C30 | H54 | 108.3° | 109.5° |
C30 | C31 | C32 | 124.4° | 120.0° |
C30 | C31 | H55 | 117.8° | 120.0° |
H53 | C30 | H54 | 109.5° | 109.5° |
C32 | C31 | H55 | 117.8° | 120.0° |
C31 | C32 | C33 | 124.0° | 120.0° |
C31 | C32 | H56 | 118.0° | 120.0° |
C33 | C32 | H56 | 118.0° | 120.0° |
C32 | C33 | H57 | 109.5° | 109.5° |
C32 | C33 | H58 | 109.4° | 109.4° |
C32 | C33 | H59 | 109.5° | 109.5° |
H57 | C33 | H58 | 109.5° | 109.5° |
H57 | C33 | H59 | 109.4° | 109.5° |
H58 | C33 | H59 | 109.5° | 109.5° |
C34 | N6 | H60 | 118.5° | 119.3° |
N6 | C34 | C35 | 107.0° | 109.0° |
N6 | C34 | C36 | 108.9° | 109.1° |
N6 | C34 | H61 | 110.5° | 110.1° |
C34 | N6 | C26 | 123.0° | 118.0° |
H60 | N6 | C26 | 118.5° | 122.6° |
C35 | C34 | C36 | 110.6° | 108.4° |
C35 | C34 | H61 | 109.8° | 111.5° |
C34 | C35 | O7 | 120.9° | 118.9° |
C34 | C35 | N7 | 118.0° | 122.0° |
C36 | C34 | H61 | 110.0° | 108.8° |
C34 | C36 | C37 | 111.0° | 109.5° |
C34 | C36 | H62 | 109.1° | 109.5° |
C34 | C36 | H63 | 109.1° | 109.5° |
O7 | C35 | N7 | 121.0° | 119.1° |
C37 | C36 | H62 | 109.1° | 109.4° |
C37 | C36 | H63 | 109.1° | 109.5° |
C36 | C37 | H64 | 109.5° | 109.5° |
C36 | C37 | H65 | 109.5° | 109.4° |
C36 | C37 | H66 | 109.4° | 109.4° |
H62 | C36 | H63 | 109.5° | 109.5° |
H64 | C37 | H65 | 109.5° | 109.5° |
H64 | C37 | H66 | 109.5° | 109.5° |
H65 | C37 | H66 | 109.5° | 109.5° |
C38 | N7 | C40 | 117.7° | 122.4° |
N7 | C38 | C39 | 109.2° | 110.5° |
N7 | C38 | H67 | 109.6° | 107.8° |
N7 | C38 | H68 | 109.5° | 110.0° |
C38 | N7 | C35 | 117.0° | 114.3° |
N7 | C40 | H69 | 109.5° | 109.5° |
N7 | C40 | H70 | 109.4° | 109.5° |
N7 | C40 | H71 | 109.5° | 109.4° |
C40 | N7 | C35 | 125.3° | 123.3° |
C39 | C38 | H67 | 109.6° | 108.7° |
C39 | C38 | H68 | 109.5° | 111.6° |
C38 | C39 | O8 | 117.6° | 119.3° |
C38 | C39 | N8 | 119.6° | 122.2° |
H67 | C38 | H68 | 109.5° | 108.1° |
O8 | C39 | N8 | 122.5° | 118.4° |
H69 | C40 | H70 | 109.5° | 109.5° |
H69 | C40 | H71 | 109.4° | 109.5° |
H70 | C40 | H71 | 109.5° | 109.5° |
C41 | N8 | C42 | 119.4° | 120.9° |
N8 | C41 | H72 | 109.5° | 109.6° |
N8 | C41 | H73 | 109.5° | 109.5° |
N8 | C41 | H74 | 109.5° | 109.5° |
C41 | N8 | C39 | 120.4° | 123.2° |
N8 | C42 | C43 | 114.7° | 109.3° |
N8 | C42 | C47 | 107.8° | 109.3° |
N8 | C42 | H75 | 109.6° | 108.8° |
C42 | N8 | C39 | 120.2° | 115.8° |
H72 | C41 | H73 | 109.5° | 109.5° |
H72 | C41 | H74 | 109.5° | 109.4° |
H73 | C41 | H74 | 109.5° | 109.4° |
C43 | C42 | C47 | 107.7° | 110.4° |
C43 | C42 | H75 | 108.5° | 109.4° |
C42 | C43 | C44 | 111.0° | 109.5° |
C42 | C43 | H76 | 109.1° | 109.5° |
C42 | C43 | H77 | 109.1° | 109.4° |
C47 | C42 | H75 | 108.5° | 109.5° |
C42 | C47 | O9 | 121.3° | 118.4° |
C42 | C47 | N9 | 117.6° | 121.4° |
C44 | C43 | H76 | 109.1° | 109.5° |
C44 | C43 | H77 | 109.1° | 109.5° |
C43 | C44 | C45 | 128.4° | 109.5° |
C43 | C44 | C46 | 107.2° | 109.5° |
C43 | C44 | H78 | 104.2° | 109.5° |
H76 | C43 | H77 | 109.5° | 109.5° |
C45 | C44 | C46 | 106.0° | 109.5° |
C45 | C44 | H78 | 104.6° | 109.5° |
C44 | C45 | H79 | 109.5° | 109.5° |
C44 | C45 | H80 | 109.4° | 109.5° |
C44 | C45 | H81 | 109.5° | 109.5° |
C46 | C44 | H78 | 104.1° | 109.4° |
C44 | C46 | H82 | 109.5° | 109.5° |
C44 | C46 | H83 | 109.5° | 109.5° |
C44 | C46 | H84 | 109.5° | 109.5° |
H79 | C45 | H80 | 109.5° | 109.5° |
H79 | C45 | H81 | 109.5° | 109.5° |
H80 | C45 | H81 | 109.5° | 109.4° |
H82 | C46 | H83 | 109.5° | 109.5° |
H82 | C46 | H84 | 109.5° | 109.4° |
H83 | C46 | H84 | 109.5° | 109.4° |
O9 | C47 | N9 | 121.0° | 120.2° |
C48 | N9 | H85 | 118.8° | 118.6° |
N9 | C48 | C49 | 107.7° | 109.3° |
N9 | C48 | C50 | 111.6° | 111.2° |
N9 | C48 | H86 | 109.4° | 108.4° |
C48 | N9 | C47 | 122.4° | 122.3° |
H85 | N9 | C47 | 118.8° | 119.2° |
C49 | C48 | C50 | 111.1° | 109.2° |
C49 | C48 | H86 | 108.3° | 110.1° |
C48 | C49 | O10 | 119.7° | 119.3° |
C48 | C49 | N10 | 117.8° | 121.4° |
C50 | C48 | H86 | 108.7° | 108.6° |
C48 | C50 | C51 | 111.2° | 109.5° |
C48 | C50 | C52 | 109.7° | 109.5° |
C48 | C50 | H87 | 107.9° | 109.5° |
O10 | C49 | N10 | 122.4° | 119.3° |
C51 | C50 | C52 | 112.6° | 109.5° |
C51 | C50 | H87 | 108.0° | 109.5° |
C50 | C51 | H88 | 109.5° | 109.4° |
C50 | C51 | H89 | 109.5° | 109.5° |
C50 | C51 | H90 | 109.5° | 109.5° |
C52 | C50 | H87 | 107.2° | 109.4° |
C50 | C52 | H91 | 109.5° | 109.5° |
C50 | C52 | H92 | 109.5° | 109.5° |
C50 | C52 | H93 | 109.5° | 109.5° |
H88 | C51 | H89 | 109.5° | 109.5° |
H88 | C51 | H90 | 109.5° | 109.4° |
H89 | C51 | H90 | 109.5° | 109.6° |
H91 | C52 | H92 | 109.5° | 109.5° |
H91 | C52 | H93 | 109.5° | 109.4° |
H92 | C52 | H93 | 109.5° | 109.5° |
C53 | N10 | C54 | 116.7° | 120.6° |
N10 | C53 | H94 | 109.5° | 109.4° |
N10 | C53 | H95 | 109.4° | 109.4° |
N10 | C53 | H96 | 109.5° | 109.5° |
C53 | N10 | C49 | 123.8° | 123.6° |
N10 | C54 | C55 | 111.8° | 109.6° |
N10 | C54 | C59 | 109.2° | 109.5° |
N10 | C54 | H97 | 108.3° | 109.2° |
C54 | N10 | C49 | 119.5° | 115.8° |
H94 | C53 | H95 | 109.5° | 109.5° |
H94 | C53 | H96 | 109.5° | 109.5° |
H95 | C53 | H96 | 109.5° | 109.5° |
C55 | C54 | C59 | 112.3° | 110.0° |
C55 | C54 | H97 | 107.3° | 109.1° |
C54 | C55 | C56 | 114.5° | 109.5° |
C54 | C55 | H98 | 108.2° | 109.5° |
C54 | C55 | H99 | 108.2° | 109.5° |
C59 | C54 | H97 | 107.7° | 109.4° |
C54 | C59 | O11 | 125.8° | 119.9° |
C54 | C59 | N11 | 115.1° | 119.8° |
C56 | C55 | H98 | 108.2° | 109.5° |
C56 | C55 | H99 | 108.2° | 109.5° |
C55 | C56 | C57 | 113.7° | 109.5° |
C55 | C56 | C58 | 111.8° | 109.5° |
C55 | C56 | H100 | 106.6° | 109.4° |
H98 | C55 | H99 | 109.5° | 109.5° |
C57 | C56 | C58 | 111.0° | 109.5° |
C57 | C56 | H100 | 106.6° | 109.5° |
C56 | C57 | H101 | 109.5° | 109.5° |
C56 | C57 | H102 | 109.5° | 109.5° |
C56 | C57 | H103 | 109.5° | 109.5° |
C58 | C56 | H100 | 106.6° | 109.5° |
C56 | C58 | H104 | 109.5° | 109.5° |
C56 | C58 | H105 | 109.5° | 109.5° |
C56 | C58 | H106 | 109.4° | 109.4° |
H101 | C57 | H102 | 109.4° | 109.4° |
H101 | C57 | H103 | 109.5° | 109.5° |
H102 | C57 | H103 | 109.5° | 109.5° |
H104 | C58 | H105 | 109.5° | 109.5° |
H104 | C58 | H106 | 109.5° | 109.4° |
H105 | C58 | H106 | 109.5° | 109.4° |
O11 | C59 | N11 | 119.1° | 120.3° |
C60 | N11 | H107 | 118.3° | 121.4° |
N11 | C60 | C61 | 114.9° | 109.2° |
N11 | C60 | C62 | 110.4° | 109.7° |
N11 | C60 | H108 | 108.9° | 109.6° |
C60 | N11 | C59 | 123.4° | 115.8° |
H107 | N11 | C59 | 118.3° | 122.8° |
C61 | C60 | C62 | 106.7° | 109.8° |
C61 | C60 | H108 | 108.0° | 109.2° |
C60 | C61 | O12 | 119.4° | 119.5° |
C60 | C61 | N1 | 116.5° | 120.5° |
C62 | C60 | H108 | 107.6° | 109.2° |
C60 | C62 | H109 | 109.5° | 109.4° |
C60 | C62 | H110 | 109.5° | 109.4° |
C60 | C62 | H111 | 109.5° | 109.4° |
O12 | C61 | N1 | 124.1° | 120.0° |
H109 | C62 | H110 | 109.5° | 109.5° |
H109 | C62 | H111 | 109.5° | 109.5° |
H110 | C62 | H111 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C1 | N1 | H1 | C61 | 180.0° | 179.5° |
N1 | C1 | C2 | C3 | 120.8° | 119.0° |
N1 | C1 | C2 | H2 | 121.3° | 118.9° |
N1 | C1 | C3 | H2 | 121.8° | 119.7° |
N1 | C1 | C2 | H3 | 180.0° | 60.0° |
N1 | C1 | C2 | H4 | 60.0° | 180.0° |
N1 | C1 | C2 | H5 | 60.0° | 60.0° |
N1 | C1 | C3 | O1 | 55.9° | 34.8° |
C1 | N1 | C61 | C60 | 173.2° | 176.2° |
C1 | N1 | C61 | O12 | 3.3° | 3.9° |
N1 | C1 | C3 | N2 | 125.0° | 145.0° |
H1 | N1 | C1 | C2 | 20.5° | 80.3° |
H1 | N1 | C1 | C3 | 98.0° | 39.2° |
H1 | N1 | C1 | H2 | 140.9° | 160.2° |
H1 | N1 | C61 | C60 | 6.8° | 4.3° |
H1 | N1 | C61 | O12 | 176.7° | 175.6° |
C2 | C1 | C3 | H2 | 117.8° | 121.5° |
C1 | C2 | H3 | H4 | 120.0° | 120.0° |
C1 | C2 | H3 | H5 | 120.0° | 120.0° |
C1 | C2 | H4 | H5 | 120.0° | 120.1° |
C2 | C1 | C3 | O1 | 64.4° | 84.0° |
C2 | C1 | N1 | C61 | 159.5° | 99.2° |
C2 | C1 | C3 | N2 | 114.6° | 96.2° |
C3 | C1 | C2 | H3 | 59.2° | 179.0° |
C3 | C1 | C2 | H4 | 60.8° | 61.0° |
C3 | C1 | C2 | H5 | 179.2° | 59.0° |
C1 | C3 | O1 | N2 | 179.0° | 179.8° |
C1 | C3 | N2 | C4 | 8.7° | 170.7° |
C1 | C3 | N2 | C5 | 167.6° | 9.8° |
C3 | C1 | N1 | C61 | 82.0° | 141.3° |
H2 | C1 | C2 | H3 | 58.7° | 58.9° |
H2 | C1 | C2 | H4 | 178.8° | 61.1° |
H2 | C1 | C2 | H5 | 61.2° | 178.8° |
H2 | C1 | C3 | O1 | 177.8° | 154.5° |
H2 | C1 | N1 | C61 | 39.1° | 20.3° |
H2 | C1 | C3 | N2 | 3.2° | 25.3° |
H3 | C2 | H4 | H5 | 120.0° | 119.9° |
O1 | C3 | N2 | C4 | 172.2° | 9.1° |
O1 | C3 | N2 | C5 | 11.4° | 170.4° |
C4 | N2 | C5 | C3 | 176.5° | 179.5° |
N2 | C4 | H6 | H7 | 120.0° | 120.0° |
N2 | C4 | H6 | H8 | 120.0° | 120.0° |
N2 | C4 | H7 | H8 | 120.0° | 120.0° |
C4 | N2 | C5 | C6 | 67.2° | 33.9° |
C4 | N2 | C5 | C10 | 54.1° | 84.9° |
C4 | N2 | C5 | H9 | 173.1° | 153.2° |
C5 | N2 | C4 | H6 | 180.0° | 175.5° |
C5 | N2 | C4 | H7 | 60.0° | 64.5° |
C5 | N2 | C4 | H8 | 60.0° | 55.5° |
N2 | C5 | C6 | C10 | 121.5° | 118.7° |
N2 | C5 | C6 | H9 | 120.1° | 119.6° |
N2 | C5 | C10 | H9 | 119.5° | 121.2° |
N2 | C5 | C6 | C7 | 60.7° | 168.8° |
N2 | C5 | C6 | H10 | 60.1° | 48.9° |
N2 | C5 | C6 | H11 | 178.5° | 71.1° |
N2 | C5 | C10 | O2 | 118.3° | 33.5° |
N2 | C5 | C10 | N3 | 64.8° | 148.1° |
H6 | C4 | H7 | H8 | 120.0° | 120.0° |
H6 | C4 | N2 | C3 | 3.6° | 5.0° |
H7 | C4 | N2 | C3 | 123.6° | 115.1° |
H8 | C4 | N2 | C3 | 116.4° | 124.9° |
C6 | C5 | C10 | H9 | 118.5° | 120.7° |
C5 | C6 | C7 | H10 | 120.8° | 120.0° |
C5 | C6 | C7 | H11 | 120.8° | 120.1° |
C5 | C6 | H10 | H11 | 117.5° | 120.0° |
C5 | C6 | C7 | C8 | 169.3° | 68.9° |
C5 | C6 | C7 | C9 | 67.8° | 171.1° |
C5 | C6 | C7 | H12 | 51.9° | 51.1° |
C6 | C5 | C10 | O2 | 3.7° | 84.7° |
C6 | C5 | N2 | C3 | 109.3° | 146.6° |
C6 | C5 | C10 | N3 | 173.2° | 93.7° |
C10 | C5 | C6 | C7 | 177.8° | 72.5° |
C10 | C5 | C6 | H10 | 61.4° | 167.6° |
C10 | C5 | C6 | H11 | 57.0° | 47.6° |
C5 | C10 | O2 | N3 | 176.8° | 178.5° |
C5 | C10 | N3 | C11 | 5.4° | 16.3° |
C5 | C10 | N3 | C12 | 180.0° | 163.5° |
C10 | C5 | N2 | C3 | 129.4° | 94.6° |
H9 | C5 | C6 | C7 | 59.4° | 49.3° |
H9 | C5 | C6 | H10 | 179.7° | 70.7° |
H9 | C5 | C6 | H11 | 61.4° | 169.3° |
H9 | C5 | C10 | O2 | 122.2° | 154.6° |
H9 | C5 | N2 | C3 | 10.4° | 27.3° |
H9 | C5 | C10 | N3 | 54.7° | 26.9° |
C7 | C6 | H10 | H11 | 117.5° | 120.0° |
C6 | C7 | C8 | C9 | 121.8° | 120.0° |
C6 | C7 | C8 | H12 | 117.4° | 119.9° |
C6 | C7 | C9 | H12 | 119.5° | 119.9° |
C6 | C7 | C8 | H13 | 180.0° | 62.9° |
C6 | C7 | C8 | H14 | 60.0° | 57.1° |
C6 | C7 | C8 | H15 | 60.0° | 177.0° |
C6 | C7 | C9 | H16 | 180.0° | 60.0° |
C6 | C7 | C9 | H17 | 60.0° | 180.0° |
C6 | C7 | C9 | H18 | 60.0° | 60.1° |
H10 | C6 | C7 | C8 | 48.5° | 51.1° |
H10 | C6 | C7 | C9 | 171.4° | 69.0° |
H10 | C6 | C7 | H12 | 68.9° | 171.0° |
H11 | C6 | C7 | C8 | 69.9° | 171.1° |
H11 | C6 | C7 | C9 | 53.0° | 51.0° |
H11 | C6 | C7 | H12 | 172.7° | 69.0° |
C8 | C7 | C9 | H12 | 120.6° | 120.0° |
C7 | C8 | H13 | H14 | 120.0° | 120.0° |
C7 | C8 | H13 | H15 | 120.0° | 120.0° |
C7 | C8 | H14 | H15 | 120.0° | 119.9° |
C8 | C7 | C9 | H16 | 60.1° | 180.0° |
C8 | C7 | C9 | H17 | 59.9° | 60.0° |
C8 | C7 | C9 | H18 | 180.0° | 59.9° |
C9 | C7 | C8 | H13 | 58.2° | 177.0° |
C9 | C7 | C8 | H14 | 178.2° | 62.9° |
C9 | C7 | C8 | H15 | 61.8° | 57.0° |
C7 | C9 | H16 | H17 | 120.0° | 120.0° |
C7 | C9 | H16 | H18 | 120.0° | 120.1° |
C7 | C9 | H17 | H18 | 120.0° | 120.0° |
H12 | C7 | C8 | H13 | 62.6° | 57.0° |
H12 | C7 | C8 | H14 | 57.4° | 177.0° |
H12 | C7 | C8 | H15 | 177.4° | 63.0° |
H12 | C7 | C9 | H16 | 60.5° | 59.9° |
H12 | C7 | C9 | H17 | 179.5° | 60.1° |
H12 | C7 | C9 | H18 | 59.4° | 180.0° |
H13 | C8 | H14 | H15 | 120.0° | 120.0° |
H16 | C9 | H17 | H18 | 120.0° | 120.0° |
O2 | C10 | N3 | C11 | 177.8° | 162.2° |
O2 | C10 | N3 | C12 | 3.2° | 18.1° |
C11 | N3 | C12 | C10 | 174.9° | 179.8° |
N3 | C11 | H19 | H20 | 120.0° | 120.0° |
N3 | C11 | H19 | H21 | 120.0° | 120.0° |
N3 | C11 | H20 | H21 | 120.0° | 119.9° |
C11 | N3 | C12 | C13 | 50.4° | 119.3° |
C11 | N3 | C12 | C17 | 73.9° | 0.9° |
C11 | N3 | C12 | H22 | 169.2° | 122.3° |
C12 | N3 | C11 | H19 | 180.0° | 179.5° |
C12 | N3 | C11 | H20 | 60.0° | 59.5° |
C12 | N3 | C11 | H21 | 60.0° | 60.5° |
N3 | C12 | C13 | C17 | 123.7° | 119.8° |
N3 | C12 | C13 | H22 | 119.2° | 118.6° |
N3 | C12 | C17 | H22 | 117.5° | 121.4° |
N3 | C12 | C13 | C14 | 62.9° | 75.1° |
N3 | C12 | C13 | H23 | 57.5° | 44.9° |
N3 | C12 | C13 | H24 | 176.5° | 164.9° |
N3 | C12 | C17 | O3 | 15.7° | 64.6° |
N3 | C12 | C17 | N4 | 166.6° | 117.3° |
H19 | C11 | H20 | H21 | 120.0° | 120.0° |
H19 | C11 | N3 | C10 | 5.5° | 0.7° |
H20 | C11 | N3 | C10 | 125.5° | 120.8° |
H21 | C11 | N3 | C10 | 114.5° | 119.3° |
C13 | C12 | C17 | H22 | 117.3° | 119.5° |
C12 | C13 | C14 | H23 | 120.5° | 120.0° |
C12 | C13 | C14 | H24 | 120.5° | 120.0° |
C12 | C13 | H23 | H24 | 118.5° | 120.0° |
C12 | C13 | C14 | C15 | 175.4° | 171.2° |
C12 | C13 | C14 | C16 | 54.7° | 51.1° |
C12 | C13 | C14 | H25 | 67.5° | 68.8° |
C13 | C12 | C17 | O3 | 109.6° | 54.5° |
C13 | C12 | N3 | C10 | 124.5° | 60.4° |
C13 | C12 | C17 | N4 | 68.2° | 123.7° |
C17 | C12 | C13 | C14 | 173.4° | 165.2° |
C17 | C12 | C13 | H23 | 66.1° | 74.8° |
C17 | C12 | C13 | H24 | 52.9° | 45.2° |
C12 | C17 | O3 | N4 | 177.6° | 178.2° |
C12 | C17 | N4 | C18 | 13.1° | 0.5° |
C12 | C17 | N4 | C19 | 173.9° | 179.5° |
C17 | C12 | N3 | C10 | 111.2° | 178.9° |
H22 | C12 | C13 | C14 | 56.2° | 43.6° |
H22 | C12 | C13 | H23 | 176.7° | 163.6° |
H22 | C12 | C13 | H24 | 64.3° | 76.4° |
H22 | C12 | C17 | O3 | 133.2° | 174.0° |
H22 | C12 | N3 | C10 | 5.7° | 57.9° |
H22 | C12 | C17 | N4 | 49.1° | 4.2° |
C14 | C13 | H23 | H24 | 118.4° | 120.0° |
C13 | C14 | C15 | C16 | 124.5° | 120.0° |
C13 | C14 | C15 | H25 | 117.3° | 120.0° |
C13 | C14 | C16 | H25 | 122.0° | 120.0° |
C13 | C14 | C15 | H26 | 180.0° | 65.8° |
C13 | C14 | C15 | H27 | 60.0° | 174.2° |
C13 | C14 | C15 | H28 | 60.0° | 54.3° |
C13 | C14 | C16 | H29 | 180.0° | 173.8° |
C13 | C14 | C16 | H30 | 60.0° | 53.8° |
C13 | C14 | C16 | H31 | 60.0° | 66.2° |
H23 | C13 | C14 | C15 | 64.1° | 68.8° |
H23 | C13 | C14 | C16 | 175.1° | 171.1° |
H23 | C13 | C14 | H25 | 53.0° | 51.2° |
H24 | C13 | C14 | C15 | 54.8° | 51.2° |
H24 | C13 | C14 | C16 | 65.9° | 68.8° |
H24 | C13 | C14 | H25 | 172.0° | 171.2° |
C15 | C14 | C16 | H25 | 117.9° | 120.0° |
C14 | C15 | H26 | H27 | 120.0° | 120.0° |
C14 | C15 | H26 | H28 | 120.0° | 120.0° |
C14 | C15 | H27 | H28 | 120.0° | 120.0° |
C15 | C14 | C16 | H29 | 59.9° | 53.8° |
C15 | C14 | C16 | H30 | 60.1° | 66.2° |
C15 | C14 | C16 | H31 | 179.9° | 173.8° |
C16 | C14 | C15 | H26 | 55.5° | 54.3° |
C16 | C14 | C15 | H27 | 175.5° | 65.8° |
C16 | C14 | C15 | H28 | 64.5° | 174.3° |
C14 | C16 | H29 | H30 | 120.0° | 120.0° |
C14 | C16 | H29 | H31 | 120.0° | 119.9° |
C14 | C16 | H30 | H31 | 120.0° | 119.9° |
H25 | C14 | C15 | H26 | 62.7° | 174.2° |
H25 | C14 | C15 | H27 | 57.4° | 54.2° |
H25 | C14 | C15 | H28 | 177.3° | 65.7° |
H25 | C14 | C16 | H29 | 58.0° | 66.2° |
H25 | C14 | C16 | H30 | 178.0° | 173.8° |
H25 | C14 | C16 | H31 | 62.0° | 53.8° |
H26 | C15 | H27 | H28 | 120.0° | 120.1° |
H29 | C16 | H30 | H31 | 120.0° | 120.1° |
O3 | C17 | N4 | C18 | 169.2° | 177.6° |
O3 | C17 | N4 | C19 | 3.9° | 2.4° |
C18 | N4 | C19 | C17 | 173.8° | 180.0° |
N4 | C18 | H32 | H33 | 120.0° | 120.0° |
N4 | C18 | H32 | H34 | 120.0° | 120.0° |
N4 | C18 | H33 | H34 | 120.0° | 120.0° |
C18 | N4 | C19 | C20 | 63.4° | 15.1° |
C18 | N4 | C19 | C23 | 60.4° | 103.5° |
C18 | N4 | C19 | H35 | 176.6° | 133.2° |
C19 | N4 | C18 | H32 | 180.0° | 175.4° |
C19 | N4 | C18 | H33 | 60.0° | 55.4° |
C19 | N4 | C18 | H34 | 60.0° | 64.6° |
N4 | C19 | C20 | C23 | 122.1° | 118.9° |
N4 | C19 | C20 | H35 | 120.5° | 118.5° |
N4 | C19 | C23 | H35 | 116.8° | 121.5° |
N4 | C19 | C20 | C21 | 166.6° | 172.0° |
N4 | C19 | C20 | C22 | 44.9° | 68.0° |
N4 | C19 | C20 | H36 | 75.5° | 52.0° |
N4 | C19 | C23 | O4 | 102.8° | 69.8° |
N4 | C19 | C23 | N5 | 77.1° | 110.6° |
H32 | C18 | H33 | H34 | 120.0° | 120.0° |
H32 | C18 | N4 | C17 | 6.7° | 4.6° |
H33 | C18 | N4 | C17 | 126.6° | 124.6° |
H34 | C18 | N4 | C17 | 113.3° | 115.4° |
C20 | C19 | C23 | H35 | 117.6° | 120.3° |
C19 | C20 | C21 | C22 | 121.3° | 120.0° |
C19 | C20 | C21 | H36 | 117.7° | 120.0° |
C19 | C20 | C22 | H36 | 120.2° | 120.0° |
C19 | C20 | C21 | H37 | 180.0° | 60.0° |
C19 | C20 | C21 | H38 | 60.0° | 180.0° |
C19 | C20 | C21 | H39 | 60.0° | 60.0° |
C19 | C20 | C22 | H40 | 180.0° | 51.6° |
C19 | C20 | C22 | H41 | 60.0° | 171.7° |
C19 | C20 | C22 | H42 | 60.0° | 68.4° |
C20 | C19 | C23 | O4 | 22.8° | 48.4° |
C20 | C19 | N4 | C17 | 110.4° | 164.9° |
C20 | C19 | C23 | N5 | 157.2° | 131.2° |
C23 | C19 | C20 | C21 | 71.3° | 53.1° |
C23 | C19 | C20 | C22 | 166.9° | 173.1° |
C23 | C19 | C20 | H36 | 46.6° | 66.9° |
C19 | C23 | O4 | N5 | 180.0° | 179.6° |
C19 | C23 | N5 | C24 | 7.7° | 6.3° |
C19 | C23 | N5 | C25 | 177.5° | 172.4° |
C23 | C19 | N4 | C17 | 125.8° | 76.5° |
H35 | C19 | C20 | C21 | 46.1° | 69.5° |
H35 | C19 | C20 | C22 | 75.6° | 50.5° |
H35 | C19 | C20 | H36 | 164.0° | 170.5° |
H35 | C19 | C23 | O4 | 140.4° | 168.7° |
H35 | C19 | N4 | C17 | 9.6° | 46.8° |
H35 | C19 | C23 | N5 | 39.6° | 10.9° |
C21 | C20 | C22 | H36 | 121.0° | 120.0° |
C20 | C21 | H37 | H38 | 120.0° | 120.0° |
C20 | C21 | H37 | H39 | 120.0° | 120.0° |
C20 | C21 | H38 | H39 | 120.0° | 120.0° |
C21 | C20 | C22 | H40 | 61.2° | 171.7° |
C21 | C20 | C22 | H41 | 58.8° | 68.3° |
C21 | C20 | C22 | H42 | 178.8° | 51.6° |
C22 | C20 | C21 | H37 | 58.7° | 60.0° |
C22 | C20 | C21 | H38 | 178.7° | 60.0° |
C22 | C20 | C21 | H39 | 61.3° | 180.0° |
C20 | C22 | H40 | H41 | 120.0° | 120.0° |
C20 | C22 | H40 | H42 | 120.0° | 120.0° |
C20 | C22 | H41 | H42 | 120.0° | 119.9° |
H36 | C20 | C21 | H37 | 62.3° | 180.0° |
H36 | C20 | C21 | H38 | 57.7° | 60.0° |
H36 | C20 | C21 | H39 | 177.7° | 60.0° |
H36 | C20 | C22 | H40 | 59.8° | 68.3° |
H36 | C20 | C22 | H41 | 179.7° | 51.7° |
H36 | C20 | C22 | H42 | 60.2° | 171.6° |
H37 | C21 | H38 | H39 | 120.0° | 120.0° |
H40 | C22 | H41 | H42 | 120.0° | 120.0° |
O4 | C23 | N5 | C24 | 172.3° | 173.3° |
O4 | C23 | N5 | C25 | 2.4° | 8.0° |
C24 | N5 | C25 | C23 | 175.0° | 178.7° |
N5 | C24 | H43 | H44 | 120.0° | 119.9° |
N5 | C24 | H43 | H45 | 120.0° | 120.0° |
N5 | C24 | H44 | H45 | 120.0° | 120.0° |
C24 | N5 | C25 | C26 | 69.7° | 32.3° |
C24 | N5 | C25 | C27 | 58.1° | 89.1° |
C24 | N5 | C25 | H46 | 175.1° | 152.1° |
C25 | N5 | C24 | H43 | 180.0° | 178.6° |
C25 | N5 | C24 | H44 | 60.0° | 61.5° |
C25 | N5 | C24 | H45 | 60.0° | 58.6° |
N5 | C25 | C26 | C27 | 129.2° | 120.1° |
N5 | C25 | C26 | H46 | 115.6° | 119.8° |
N5 | C25 | C27 | H46 | 117.6° | 118.9° |
N5 | C25 | C26 | O5 | 6.5° | 38.1° |
N5 | C25 | C27 | O6 | 74.9° | 38.1° |
N5 | C25 | C27 | C28 | 49.7° | 81.8° |
N5 | C25 | C27 | H47 | 168.3° | 158.1° |
N5 | C25 | C26 | N6 | 171.6° | 143.3° |
H43 | C24 | H44 | H45 | 120.0° | 120.0° |
H43 | C24 | N5 | C23 | 5.4° | 0.0° |
H44 | C24 | N5 | C23 | 114.7° | 120.0° |
H45 | C24 | N5 | C23 | 125.3° | 120.0° |
C26 | C25 | C27 | H46 | 115.4° | 120.1° |
C25 | C26 | O5 | N6 | 177.8° | 178.6° |
C26 | C25 | C27 | O6 | 52.1° | 82.9° |
C26 | C25 | C27 | C28 | 176.8° | 157.1° |
C26 | C25 | C27 | H47 | 64.6° | 37.1° |
C25 | C26 | N6 | C34 | 169.3° | 170.7° |
C25 | C26 | N6 | H60 | 10.7° | 11.1° |
C26 | C25 | N5 | C23 | 105.3° | 149.0° |
C27 | C25 | C26 | O5 | 122.7° | 158.2° |
C25 | C27 | O6 | C28 | 124.9° | 120.0° |
C25 | C27 | O6 | H47 | 115.8° | 120.0° |
C25 | C27 | C28 | H47 | 118.5° | 120.1° |
C25 | C27 | O6 | H48 | 170.8° | 59.9° |
C25 | C27 | C28 | C29 | 56.8° | 53.0° |
C25 | C27 | C28 | C30 | 179.0° | 173.0° |
C25 | C27 | C28 | H49 | 62.0° | 67.0° |
C27 | C25 | N5 | C23 | 127.0° | 89.6° |
C27 | C25 | C26 | N6 | 59.2° | 23.2° |
H46 | C25 | C26 | O5 | 122.1° | 81.7° |
H46 | C25 | C27 | O6 | 167.5° | 157.0° |
H46 | C25 | C27 | C28 | 67.9° | 37.0° |
H46 | C25 | C27 | H47 | 50.7° | 83.0° |
H46 | C25 | N5 | C23 | 9.9° | 29.2° |
H46 | C25 | C26 | N6 | 56.0° | 96.9° |
O5 | C26 | N6 | C34 | 8.8° | 10.7° |
O5 | C26 | N6 | H60 | 171.2° | 167.5° |
O6 | C27 | C28 | H47 | 119.9° | 120.0° |
O6 | C27 | C28 | C29 | 178.4° | 173.0° |
O6 | C27 | C28 | C30 | 59.4° | 67.1° |
O6 | C27 | C28 | H49 | 59.6° | 53.0° |
C28 | C27 | O6 | H48 | 64.3° | 60.0° |
C27 | C28 | C29 | C30 | 123.8° | 120.0° |
C27 | C28 | C29 | H49 | 118.9° | 120.0° |
C27 | C28 | C30 | H49 | 119.2° | 120.1° |
C27 | C28 | C29 | H50 | 180.0° | 64.5° |
C27 | C28 | C29 | H51 | 60.0° | 55.4° |
C27 | C28 | C29 | H52 | 60.0° | 175.5° |
C27 | C28 | C30 | C31 | 60.5° | 158.6° |
C27 | C28 | C30 | H53 | 178.8° | 81.4° |
C27 | C28 | C30 | H54 | 60.2° | 38.6° |
H47 | C27 | O6 | H48 | 54.9° | 180.0° |
H47 | C27 | C28 | C29 | 61.7° | 67.1° |
H47 | C27 | C28 | C30 | 60.5° | 52.9° |
H47 | C27 | C28 | H49 | 179.5° | 173.0° |
C29 | C28 | C30 | H49 | 117.5° | 120.0° |
C28 | C29 | H50 | H51 | 120.0° | 120.0° |
C28 | C29 | H50 | H52 | 120.0° | 120.0° |
C28 | C29 | H51 | H52 | 120.0° | 120.0° |
C29 | C28 | C30 | C31 | 62.8° | 38.7° |
C29 | C28 | C30 | H53 | 57.9° | 158.6° |
C29 | C28 | C30 | H54 | 176.4° | 81.4° |
C30 | C28 | C29 | H50 | 56.2° | 55.4° |
C30 | C28 | C29 | H51 | 63.8° | 175.4° |
C30 | C28 | C29 | H52 | 176.2° | 64.5° |
C28 | C30 | C31 | H53 | 120.7° | 120.0° |
C28 | C30 | C31 | H54 | 120.7° | 120.1° |
C28 | C30 | H53 | H54 | 117.8° | 120.0° |
C28 | C30 | C31 | C32 | 123.6° | 125.8° |
C28 | C30 | C31 | H55 | 56.4° | 54.2° |
H49 | C28 | C29 | H50 | 61.1° | 175.4° |
H49 | C28 | C29 | H51 | 178.9° | 64.6° |
H49 | C28 | C29 | H52 | 58.9° | 55.5° |
H49 | C28 | C30 | C31 | 179.7° | 81.3° |
H49 | C28 | C30 | H53 | 59.6° | 38.7° |
H49 | C28 | C30 | H54 | 59.0° | 158.7° |
H50 | C29 | H51 | H52 | 120.0° | 120.0° |
C31 | C30 | H53 | H54 | 117.8° | 120.0° |
C30 | C31 | C32 | H55 | 180.0° | 180.0° |
C30 | C31 | C32 | C33 | 176.3° | 173.1° |
C30 | C31 | C32 | H56 | 3.7° | 6.9° |
H53 | C30 | C31 | C32 | 115.7° | 5.8° |
H53 | C30 | C31 | H55 | 64.3° | 174.2° |
H54 | C30 | C31 | C32 | 2.9° | 114.1° |
H54 | C30 | C31 | H55 | 177.1° | 65.8° |
C31 | C32 | C33 | H56 | 180.0° | 180.0° |
C31 | C32 | C33 | H57 | 180.0° | 62.7° |
C31 | C32 | C33 | H58 | 60.0° | 57.3° |
C31 | C32 | C33 | H59 | 60.0° | 177.4° |
H55 | C31 | C32 | C33 | 3.7° | 6.8° |
H55 | C31 | C32 | H56 | 176.3° | 173.2° |
C32 | C33 | H57 | H58 | 120.0° | 120.0° |
C32 | C33 | H57 | H59 | 120.0° | 120.0° |
C32 | C33 | H58 | H59 | 120.0° | 120.0° |
H56 | C32 | C33 | H57 | 0.0° | 117.3° |
H56 | C32 | C33 | H58 | 120.0° | 122.7° |
H56 | C32 | C33 | H59 | 120.0° | 2.6° |
H57 | C33 | H58 | H59 | 120.0° | 120.0° |
C34 | N6 | H60 | C26 | 180.0° | 178.2° |
N6 | C34 | C35 | C36 | 118.5° | 118.6° |
N6 | C34 | C35 | H61 | 119.9° | 121.7° |
N6 | C34 | C36 | H61 | 121.2° | 120.1° |
N6 | C34 | C35 | O7 | 95.9° | 84.5° |
N6 | C34 | C36 | C37 | 62.6° | 175.7° |
N6 | C34 | C36 | H62 | 57.6° | 55.7° |
N6 | C34 | C36 | H63 | 177.2° | 64.3° |
N6 | C34 | C35 | N7 | 81.9° | 95.8° |
H60 | N6 | C34 | C35 | 54.7° | 15.2° |
H60 | N6 | C34 | C36 | 64.9° | 103.0° |
H60 | N6 | C34 | H61 | 174.2° | 137.7° |
C35 | C34 | C36 | H61 | 121.5° | 121.4° |
C34 | C35 | O7 | N7 | 177.7° | 179.8° |
C35 | C34 | C36 | C37 | 179.9° | 65.8° |
C35 | C34 | C36 | H62 | 59.7° | 174.3° |
C35 | C34 | C36 | H63 | 59.8° | 54.2° |
C34 | C35 | N7 | C38 | 178.6° | 175.5° |
C34 | C35 | N7 | C40 | 1.5° | 4.9° |
C35 | C34 | N6 | C26 | 125.3° | 166.6° |
C36 | C34 | C35 | O7 | 22.6° | 34.1° |
C34 | C36 | C37 | H62 | 120.2° | 120.0° |
C34 | C36 | C37 | H63 | 120.3° | 120.1° |
C34 | C36 | H62 | H63 | 119.4° | 120.0° |
C34 | C36 | C37 | H64 | 180.0° | 174.9° |
C34 | C36 | C37 | H65 | 60.0° | 65.0° |
C34 | C36 | C37 | H66 | 60.0° | 54.9° |
C36 | C34 | N6 | C26 | 115.1° | 75.2° |
C36 | C34 | C35 | N7 | 159.6° | 145.6° |
H61 | C34 | C35 | O7 | 144.2° | 153.9° |
H61 | C34 | C36 | C37 | 58.6° | 55.6° |
H61 | C34 | C36 | H62 | 178.8° | 64.3° |
H61 | C34 | C36 | H63 | 61.6° | 175.6° |
H61 | C34 | N6 | C26 | 5.8° | 44.1° |
H61 | C34 | C35 | N7 | 38.0° | 25.9° |
O7 | C35 | N7 | C38 | 3.6° | 4.2° |
O7 | C35 | N7 | C40 | 179.3° | 175.4° |
C37 | C36 | H62 | H63 | 119.3° | 120.0° |
C36 | C37 | H64 | H65 | 120.0° | 120.0° |
C36 | C37 | H64 | H66 | 120.0° | 120.0° |
C36 | C37 | H65 | H66 | 120.0° | 119.9° |
H62 | C36 | C37 | H64 | 59.8° | 55.0° |
H62 | C36 | C37 | H65 | 179.8° | 175.0° |
H62 | C36 | C37 | H66 | 60.2° | 65.1° |
H63 | C36 | C37 | H64 | 59.8° | 65.0° |
H63 | C36 | C37 | H65 | 60.3° | 55.0° |
H63 | C36 | C37 | H66 | 179.8° | 175.0° |
H64 | C37 | H65 | H66 | 120.0° | 120.0° |
C38 | N7 | C40 | C35 | 177.1° | 179.6° |
N7 | C38 | C39 | H67 | 120.0° | 118.1° |
N7 | C38 | C39 | H68 | 119.9° | 122.8° |
N7 | C38 | H67 | H68 | 120.1° | 118.9° |
N7 | C38 | C39 | O8 | 119.1° | 86.5° |
C38 | N7 | C40 | H69 | 180.0° | 179.5° |
C38 | N7 | C40 | H70 | 60.0° | 60.5° |
C38 | N7 | C40 | H71 | 60.0° | 59.6° |
N7 | C38 | C39 | N8 | 66.8° | 94.9° |
C40 | N7 | C38 | C39 | 47.2° | 1.3° |
C40 | N7 | C38 | H67 | 72.7° | 117.3° |
C40 | N7 | C38 | H68 | 167.1° | 125.1° |
N7 | C40 | H69 | H70 | 120.0° | 120.0° |
N7 | C40 | H69 | H71 | 120.0° | 119.9° |
N7 | C40 | H70 | H71 | 120.0° | 120.0° |
C39 | C38 | H67 | H68 | 120.1° | 121.3° |
C38 | C39 | O8 | N8 | 173.9° | 178.7° |
C38 | C39 | N8 | C41 | 1.3° | 8.8° |
C38 | C39 | N8 | C42 | 177.1° | 170.1° |
C39 | C38 | N7 | C35 | 135.5° | 178.3° |
H67 | C38 | C39 | O8 | 0.8° | 31.6° |
H67 | C38 | N7 | C35 | 104.6° | 63.1° |
H67 | C38 | C39 | N8 | 173.2° | 147.0° |
H68 | C38 | C39 | O8 | 121.0° | 150.7° |
H68 | C38 | N7 | C35 | 15.5° | 54.5° |
H68 | C38 | C39 | N8 | 53.1° | 27.9° |
O8 | C39 | N8 | C41 | 172.5° | 172.6° |
O8 | C39 | N8 | C42 | 9.1° | 8.6° |
H69 | C40 | H70 | H71 | 120.0° | 120.1° |
H69 | C40 | N7 | C35 | 2.9° | 0.0° |
H70 | C40 | N7 | C35 | 117.1° | 119.9° |
H71 | C40 | N7 | C35 | 122.9° | 120.0° |
C41 | N8 | C42 | C39 | 178.4° | 178.9° |
N8 | C41 | H72 | H73 | 120.0° | 120.1° |
N8 | C41 | H72 | H74 | 120.0° | 120.0° |
N8 | C41 | H73 | H74 | 120.0° | 120.0° |
C41 | N8 | C42 | C43 | 55.8° | 42.2° |
C41 | N8 | C42 | C47 | 64.1° | 78.8° |
C41 | N8 | C42 | H75 | 178.0° | 161.7° |
C42 | N8 | C41 | H72 | 180.0° | 174.0° |
C42 | N8 | C41 | H73 | 60.0° | 66.0° |
C42 | N8 | C41 | H74 | 60.0° | 54.0° |
N8 | C42 | C43 | C47 | 120.0° | 120.3° |
N8 | C42 | C43 | H75 | 122.8° | 119.1° |
N8 | C42 | C47 | H75 | 118.6° | 119.1° |
N8 | C42 | C43 | C44 | 157.9° | 65.0° |
N8 | C42 | C43 | H76 | 37.7° | 55.0° |
N8 | C42 | C43 | H77 | 81.9° | 175.0° |
N8 | C42 | C47 | O9 | 82.6° | 52.5° |
N8 | C42 | C47 | N9 | 94.1° | 130.1° |
H72 | C41 | H73 | H74 | 120.0° | 119.9° |
H72 | C41 | N8 | C39 | 1.5° | 4.8° |
H73 | C41 | N8 | C39 | 118.5° | 115.3° |
H74 | C41 | N8 | C39 | 121.6° | 124.8° |
C43 | C42 | C47 | H75 | 117.2° | 120.5° |
C42 | C43 | C44 | H76 | 120.2° | 120.1° |
C42 | C43 | C44 | H77 | 120.2° | 120.0° |
C42 | C43 | H76 | H77 | 119.3° | 120.0° |
C42 | C43 | C44 | C45 | 51.3° | 175.0° |
C42 | C43 | C44 | C46 | 76.7° | 65.0° |
C42 | C43 | C44 | H78 | 173.4° | 55.0° |
C43 | C42 | C47 | O9 | 41.6° | 172.9° |
C43 | C42 | N8 | C39 | 125.7° | 136.7° |
C43 | C42 | C47 | N9 | 141.7° | 9.8° |
C47 | C42 | C43 | C44 | 82.2° | 174.6° |
C47 | C42 | C43 | H76 | 157.6° | 65.3° |
C47 | C42 | C43 | H77 | 38.1° | 54.7° |
C42 | C47 | O9 | N9 | 176.6° | 177.4° |
C42 | C47 | N9 | C48 | 179.3° | 114.5° |
C42 | C47 | N9 | H85 | 0.7° | 65.8° |
C47 | C42 | N8 | C39 | 114.4° | 102.4° |
H75 | C42 | C43 | C44 | 35.1° | 54.1° |
H75 | C42 | C43 | H76 | 85.1° | 174.1° |
H75 | C42 | C43 | H77 | 155.3° | 65.9° |
H75 | C42 | C47 | O9 | 158.8° | 66.6° |
H75 | C42 | N8 | C39 | 3.6° | 17.2° |
H75 | C42 | C47 | N9 | 24.5° | 110.8° |
C44 | C43 | H76 | H77 | 119.3° | 120.0° |
C43 | C44 | C45 | C46 | 128.4° | 120.0° |
C43 | C44 | C45 | H78 | 122.0° | 120.1° |
C43 | C44 | C46 | H78 | 110.0° | 120.0° |
C43 | C44 | C45 | H79 | 180.0° | 60.0° |
C43 | C44 | C45 | H80 | 60.0° | 180.0° |
C43 | C44 | C45 | H81 | 60.0° | 60.0° |
C43 | C44 | C46 | H82 | 180.0° | 60.0° |
C43 | C44 | C46 | H83 | 60.0° | 180.0° |
C43 | C44 | C46 | H84 | 60.0° | 60.0° |
H76 | C43 | C44 | C45 | 171.5° | 55.0° |
H76 | C43 | C44 | C46 | 43.6° | 175.0° |
H76 | C43 | C44 | H78 | 66.4° | 65.1° |
H77 | C43 | C44 | C45 | 69.0° | 65.0° |
H77 | C43 | C44 | C46 | 163.1° | 55.0° |
H77 | C43 | C44 | H78 | 53.2° | 174.9° |
C45 | C44 | C46 | H78 | 110.0° | 120.0° |
C44 | C45 | H79 | H80 | 120.0° | 120.0° |
C44 | C45 | H79 | H81 | 120.0° | 120.0° |
C44 | C45 | H80 | H81 | 120.0° | 120.0° |
C45 | C44 | C46 | H82 | 40.0° | 180.0° |
C45 | C44 | C46 | H83 | 80.0° | 60.0° |
C45 | C44 | C46 | H84 | 160.0° | 60.0° |
C46 | C44 | C45 | H79 | 51.7° | 60.0° |
C46 | C44 | C45 | H80 | 171.6° | 60.0° |
C46 | C44 | C45 | H81 | 68.4° | 179.9° |
C44 | C46 | H82 | H83 | 120.0° | 120.1° |
C44 | C46 | H82 | H84 | 120.0° | 120.0° |
C44 | C46 | H83 | H84 | 120.0° | 120.0° |
H78 | C44 | C45 | H79 | 58.0° | 180.0° |
H78 | C44 | C45 | H80 | 62.0° | 59.9° |
H78 | C44 | C45 | H81 | 178.0° | 60.0° |
H78 | C44 | C46 | H82 | 70.0° | 60.0° |
H78 | C44 | C46 | H83 | 170.0° | 60.0° |
H78 | C44 | C46 | H84 | 50.0° | 180.0° |
H79 | C45 | H80 | H81 | 120.0° | 120.0° |
H82 | C46 | H83 | H84 | 120.0° | 119.9° |
O9 | C47 | N9 | C48 | 2.6° | 68.2° |
O9 | C47 | N9 | H85 | 177.5° | 111.5° |
C48 | N9 | H85 | C47 | 180.0° | 179.7° |
N9 | C48 | C49 | C50 | 122.5° | 121.9° |
N9 | C48 | C49 | H86 | 118.2° | 118.9° |
N9 | C48 | C50 | H86 | 120.7° | 119.2° |
N9 | C48 | C49 | O10 | 50.1° | 38.2° |
N9 | C48 | C50 | C51 | 176.9° | 69.0° |
N9 | C48 | C50 | C52 | 57.9° | 171.0° |
N9 | C48 | C50 | H87 | 58.6° | 51.1° |
N9 | C48 | C49 | N10 | 132.2° | 141.7° |
H85 | N9 | C48 | C49 | 107.0° | 37.8° |
H85 | N9 | C48 | C50 | 15.2° | 158.5° |
H85 | N9 | C48 | H86 | 135.5° | 82.2° |
C49 | C48 | C50 | H86 | 119.1° | 120.1° |
C48 | C49 | O10 | N10 | 177.5° | 180.0° |
C49 | C48 | C50 | C51 | 56.7° | 51.7° |
C49 | C48 | C50 | C52 | 178.1° | 68.3° |
C49 | C48 | C50 | H87 | 61.6° | 171.8° |
C48 | C49 | N10 | C53 | 0.3° | 1.7° |
C48 | C49 | N10 | C54 | 178.6° | 177.6° |
C49 | C48 | N9 | C47 | 73.0° | 141.9° |
C50 | C48 | C49 | O10 | 72.4° | 83.7° |
C48 | C50 | C51 | C52 | 123.6° | 120.0° |
C48 | C50 | C51 | H87 | 118.2° | 120.0° |
C48 | C50 | C52 | H87 | 116.9° | 120.0° |
C48 | C50 | C51 | H88 | 180.0° | 176.6° |
C48 | C50 | C51 | H89 | 60.0° | 63.4° |
C48 | C50 | C51 | H90 | 60.0° | 56.7° |
C48 | C50 | C52 | H91 | 180.0° | 55.0° |
C48 | C50 | C52 | H92 | 60.0° | 175.1° |
C48 | C50 | C52 | H93 | 60.0° | 64.9° |
C50 | C48 | N9 | C47 | 164.8° | 21.2° |
C50 | C48 | C49 | N10 | 105.3° | 96.4° |
H86 | C48 | C49 | O10 | 168.3° | 157.1° |
H86 | C48 | C50 | C51 | 62.4° | 171.9° |
H86 | C48 | C50 | C52 | 62.8° | 51.8° |
H86 | C48 | C50 | H87 | 179.3° | 68.1° |
H86 | C48 | N9 | C47 | 44.5° | 98.1° |
H86 | C48 | C49 | N10 | 14.1° | 22.8° |
O10 | C49 | N10 | C53 | 177.8° | 178.3° |
O10 | C49 | N10 | C54 | 3.9° | 2.4° |
C51 | C50 | C52 | H87 | 118.6° | 120.0° |
C50 | C51 | H88 | H89 | 120.0° | 120.0° |
C50 | C51 | H88 | H90 | 120.0° | 119.9° |
C50 | C51 | H89 | H90 | 120.0° | 120.0° |
C51 | C50 | C52 | H91 | 55.6° | 175.0° |
C51 | C50 | C52 | H92 | 64.4° | 64.9° |
C51 | C50 | C52 | H93 | 175.6° | 55.1° |
C52 | C50 | C51 | H88 | 56.4° | 56.6° |
C52 | C50 | C51 | H89 | 176.4° | 176.6° |
C52 | C50 | C51 | H90 | 63.6° | 63.3° |
C50 | C52 | H91 | H92 | 120.0° | 120.0° |
C50 | C52 | H91 | H93 | 120.0° | 120.0° |
C50 | C52 | H92 | H93 | 120.0° | 120.0° |
H87 | C50 | C51 | H88 | 61.8° | 63.4° |
H87 | C50 | C51 | H89 | 58.2° | 56.6° |
H87 | C50 | C51 | H90 | 178.2° | 176.7° |
H87 | C50 | C52 | H91 | 63.1° | 64.9° |
H87 | C50 | C52 | H92 | 176.9° | 55.1° |
H87 | C50 | C52 | H93 | 56.9° | 175.1° |
H88 | C51 | H89 | H90 | 120.0° | 120.0° |
H91 | C52 | H92 | H93 | 120.0° | 120.0° |
C53 | N10 | C54 | C49 | 178.4° | 179.4° |
N10 | C53 | H94 | H95 | 120.0° | 120.0° |
N10 | C53 | H94 | H96 | 120.0° | 120.0° |
N10 | C53 | H95 | H96 | 120.0° | 120.0° |
C53 | N10 | C54 | C55 | 54.1° | 20.3° |
C53 | N10 | C54 | C59 | 70.7° | 100.5° |
C53 | N10 | C54 | H97 | 172.2° | 139.8° |
C54 | N10 | C53 | H94 | 180.0° | 175.4° |
C54 | N10 | C53 | H95 | 60.0° | 55.4° |
C54 | N10 | C53 | H96 | 60.0° | 64.6° |
N10 | C54 | C55 | C59 | 123.2° | 120.4° |
N10 | C54 | C55 | H97 | 118.7° | 119.5° |
N10 | C54 | C59 | H97 | 117.5° | 119.7° |
N10 | C54 | C55 | C56 | 50.1° | 65.4° |
N10 | C54 | C55 | H98 | 70.6° | 54.6° |
N10 | C54 | C55 | H99 | 170.9° | 174.6° |
N10 | C54 | C59 | O11 | 4.7° | 112.5° |
N10 | C54 | C59 | N11 | 176.9° | 67.2° |
H94 | C53 | H95 | H96 | 120.0° | 120.0° |
H94 | C53 | N10 | C49 | 1.6° | 5.3° |
H95 | C53 | N10 | C49 | 121.7° | 125.3° |
H96 | C53 | N10 | C49 | 118.4° | 114.7° |
C55 | C54 | C59 | H97 | 117.9° | 119.8° |
C54 | C55 | C56 | H98 | 120.8° | 120.0° |
C54 | C55 | C56 | H99 | 120.7° | 120.0° |
C54 | C55 | H98 | H99 | 117.7° | 120.0° |
C54 | C55 | C56 | C57 | 169.6° | 174.8° |
C54 | C55 | C56 | C58 | 63.8° | 65.1° |
C54 | C55 | C56 | H100 | 52.4° | 54.9° |
C55 | C54 | C59 | O11 | 119.9° | 127.1° |
C55 | C54 | N10 | C49 | 124.3° | 159.1° |
C55 | C54 | C59 | N11 | 58.5° | 53.3° |
C59 | C54 | C55 | C56 | 173.3° | 174.2° |
C59 | C54 | C55 | H98 | 52.6° | 65.8° |
C59 | C54 | C55 | H99 | 65.9° | 54.2° |
C54 | C59 | O11 | N11 | 178.3° | 179.7° |
C54 | C59 | N11 | C60 | 179.8° | 174.2° |
C54 | C59 | N11 | H107 | 0.2° | 6.3° |
C59 | C54 | N10 | C49 | 110.8° | 80.2° |
H97 | C54 | C55 | C56 | 68.5° | 54.1° |
H97 | C54 | C55 | H98 | 170.7° | 174.2° |
H97 | C54 | C55 | H99 | 52.2° | 65.8° |
H97 | C54 | C59 | O11 | 122.2° | 7.2° |
H97 | C54 | N10 | C49 | 6.2° | 39.6° |
H97 | C54 | C59 | N11 | 59.4° | 173.1° |
C56 | C55 | H98 | H99 | 117.7° | 120.0° |
C55 | C56 | C57 | C58 | 127.1° | 120.0° |
C55 | C56 | C57 | H100 | 117.2° | 119.9° |
C55 | C56 | C58 | H100 | 116.2° | 120.0° |
C55 | C56 | C57 | H101 | 180.0° | 60.1° |
C55 | C56 | C57 | H102 | 60.0° | 180.0° |
C55 | C56 | C57 | H103 | 60.0° | 60.0° |
C55 | C56 | C58 | H104 | 180.0° | 60.1° |
C55 | C56 | C58 | H105 | 60.0° | 60.0° |
C55 | C56 | C58 | H106 | 60.0° | 180.0° |
H98 | C55 | C56 | C57 | 48.8° | 54.8° |
H98 | C55 | C56 | C58 | 175.5° | 174.8° |
H98 | C55 | C56 | H100 | 68.4° | 65.1° |
H99 | C55 | C56 | C57 | 69.7° | 65.2° |
H99 | C55 | C56 | C58 | 56.9° | 54.9° |
H99 | C55 | C56 | H100 | 173.1° | 174.9° |
C57 | C56 | C58 | H100 | 115.7° | 120.0° |
C56 | C57 | H101 | H102 | 120.0° | 120.0° |
C56 | C57 | H101 | H103 | 120.0° | 120.0° |
C56 | C57 | H102 | H103 | 120.0° | 120.0° |
C57 | C56 | C58 | H104 | 51.9° | 59.9° |
C57 | C56 | C58 | H105 | 68.1° | 180.0° |
C57 | C56 | C58 | H106 | 171.9° | 60.0° |
C58 | C56 | C57 | H101 | 53.0° | 59.9° |
C58 | C56 | C57 | H102 | 172.9° | 60.0° |
C58 | C56 | C57 | H103 | 67.1° | 180.0° |
C56 | C58 | H104 | H105 | 120.0° | 120.1° |
C56 | C58 | H104 | H106 | 120.0° | 119.9° |
C56 | C58 | H105 | H106 | 120.0° | 119.9° |
H100 | C56 | C57 | H101 | 62.7° | 180.0° |
H100 | C56 | C57 | H102 | 57.2° | 60.1° |
H100 | C56 | C57 | H103 | 177.3° | 60.0° |
H100 | C56 | C58 | H104 | 63.8° | 180.0° |
H100 | C56 | C58 | H105 | 176.2° | 59.9° |
H100 | C56 | C58 | H106 | 56.2° | 60.0° |
H101 | C57 | H102 | H103 | 120.0° | 120.0° |
H104 | C58 | H105 | H106 | 120.0° | 120.0° |
O11 | C59 | N11 | C60 | 1.7° | 6.1° |
O11 | C59 | N11 | H107 | 178.3° | 173.4° |
C60 | N11 | H107 | C59 | 180.0° | 179.5° |
N11 | C60 | C61 | C62 | 122.8° | 120.3° |
N11 | C60 | C61 | H108 | 121.8° | 119.9° |
N11 | C60 | C62 | H108 | 118.8° | 120.2° |
N11 | C60 | C61 | O12 | 23.0° | 116.0° |
N11 | C60 | C62 | H109 | 180.0° | 60.0° |
N11 | C60 | C62 | H110 | 60.0° | 180.0° |
N11 | C60 | C62 | H111 | 60.0° | 60.0° |
N11 | C60 | C61 | N1 | 160.4° | 63.9° |
H107 | N11 | C60 | C61 | 114.3° | 55.4° |
H107 | N11 | C60 | C62 | 6.4° | 65.0° |
H107 | N11 | C60 | H108 | 124.3° | 175.0° |
C61 | C60 | C62 | H108 | 115.7° | 119.8° |
C60 | C61 | O12 | N1 | 176.4° | 179.9° |
C61 | C60 | C62 | H109 | 54.5° | 60.0° |
C61 | C60 | C62 | H110 | 174.5° | 60.0° |
C61 | C60 | C62 | H111 | 65.5° | 179.9° |
C61 | C60 | N11 | C59 | 65.7° | 124.2° |
C62 | C60 | C61 | O12 | 99.8° | 123.7° |
C60 | C62 | H109 | H110 | 120.0° | 119.9° |
C60 | C62 | H109 | H111 | 120.0° | 120.0° |
C60 | C62 | H110 | H111 | 120.0° | 119.9° |
C62 | C60 | C61 | N1 | 76.9° | 56.4° |
C62 | C60 | N11 | C59 | 173.6° | 115.4° |
H108 | C60 | C61 | O12 | 144.8° | 3.9° |
H108 | C60 | C62 | H109 | 61.2° | 179.8° |
H108 | C60 | C62 | H110 | 58.8° | 59.8° |
H108 | C60 | C62 | H111 | 178.8° | 60.2° |
H108 | C60 | C61 | N1 | 38.5° | 176.2° |
H108 | C60 | N11 | C59 | 55.6° | 4.5° |
H109 | C62 | H110 | H111 | 120.0° | 120.1° |