DMM
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | doub | 1.39Å | 1.40Å | Aromatic |
C1 | C20 | sing | 1.39Å | 1.36Å | Aromatic |
C1 | H1 | sing | 1.08Å | 1.10Å | |
C2 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
C2 | H2 | sing | 1.08Å | 1.10Å | |
C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
C3 | H3 | sing | 1.08Å | 1.10Å | |
C4 | O4 | sing | 1.36Å | 1.38Å | |
C4 | C5 | sing | 1.40Å | 1.40Å | Aromatic |
O4 | C21 | sing | 1.43Å | 1.45Å | |
C5 | C6 | sing | 1.48Å | 1.38Å | |
C5 | C20 | doub | 1.41Å | 1.41Å | Aromatic |
C6 | O6 | doub | 1.22Å | 1.38Å | |
C6 | C7 | sing | 1.47Å | 1.41Å | |
C7 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
C7 | C18 | sing | 1.41Å | 1.43Å | Aromatic |
C8 | O8 | sing | 1.36Å | 1.41Å | |
C8 | C9 | sing | 1.40Å | 1.42Å | Aromatic |
O8 | HO8 | sing | 0.97Å | 0.95Å | |
C9 | C10 | sing | 1.51Å | 1.47Å | |
C9 | C16 | doub | 1.37Å | 1.38Å | Aromatic |
C10 | O10 | sing | 1.43Å | 1.41Å | |
C10 | C11 | sing | 1.53Å | 1.54Å | |
C10 | H10 | sing | 1.09Å | 1.11Å | |
O10 | C1' | sing | 1.43Å | 1.39Å | |
C11 | C12 | sing | 1.53Å | 1.59Å | |
C11 | H111 | sing | 1.09Å | 1.11Å | |
C11 | H112 | sing | 1.09Å | 1.11Å | |
C12 | O12 | sing | 1.43Å | 1.46Å | |
C12 | C13 | sing | 1.51Å | 1.52Å | |
C12 | C15 | sing | 1.53Å | 1.57Å | |
O12 | HO12 | sing | 0.97Å | 0.95Å | |
C13 | O13 | doub | 1.21Å | 1.38Å | |
C13 | C14 | sing | 1.51Å | 1.54Å | |
C14 | O14 | sing | 1.43Å | 1.43Å | |
C14 | H141 | sing | 1.09Å | 1.11Å | |
C14 | H142 | sing | 1.09Å | 1.11Å | |
O14 | HO14 | sing | 0.97Å | 0.95Å | |
C15 | C16 | sing | 1.51Å | 1.52Å | |
C15 | H151 | sing | 1.09Å | 1.11Å | |
C15 | H152 | sing | 1.09Å | 1.11Å | |
C16 | C17 | sing | 1.40Å | 1.40Å | Aromatic |
C17 | O17 | sing | 1.36Å | 1.36Å | |
C17 | C18 | doub | 1.39Å | 1.41Å | Aromatic |
O17 | HO17 | sing | 0.97Å | 0.95Å | |
C18 | C19 | sing | 1.47Å | 1.40Å | |
C19 | O19 | doub | 1.21Å | 1.31Å | |
C19 | C20 | sing | 1.48Å | 1.40Å | |
C21 | H211 | sing | 1.09Å | 1.11Å | |
C21 | H212 | sing | 1.09Å | 1.11Å | |
C21 | H213 | sing | 1.09Å | 1.12Å | |
C1' | C2' | sing | 1.53Å | 1.56Å | |
C1' | O5' | sing | 1.43Å | 1.40Å | |
C1' | H1' | sing | 1.09Å | 1.11Å | |
C2' | C3' | sing | 1.53Å | 1.58Å | |
C2' | H2'1 | sing | 1.09Å | 1.11Å | |
C2' | H2'2 | sing | 1.09Å | 1.11Å | |
C3' | C4' | sing | 1.53Å | 1.50Å | |
C3' | N3' | sing | 1.47Å | 1.51Å | |
C3' | H3' | sing | 1.09Å | 1.12Å | |
C4' | O4' | sing | 1.43Å | 1.39Å | |
C4' | C5' | sing | 1.53Å | 1.52Å | |
C4' | H4' | sing | 1.09Å | 1.12Å | |
O4' | HO4' | sing | 0.97Å | 0.95Å | |
C5' | O5' | sing | 1.43Å | 1.49Å | |
C5' | C6' | sing | 1.53Å | 1.52Å | |
C5' | H5' | sing | 1.09Å | 1.12Å | |
C6' | H6'1 | sing | 1.09Å | 1.11Å | |
C6' | H6'2 | sing | 1.09Å | 1.11Å | |
C6' | H6'3 | sing | 1.09Å | 1.12Å | |
N3' | C33 | sing | 1.47Å | 1.50Å | |
N3' | C53 | sing | 1.47Å | 1.42Å | |
C33 | C23 | sing | 1.53Å | 1.54Å | |
C33 | H331 | sing | 1.09Å | 1.12Å | |
C33 | H332 | sing | 1.09Å | 1.11Å | |
C23 | O16 | sing | 1.43Å | 1.42Å | |
C23 | O23 | sing | 1.43Å | 1.43Å | |
C23 | H23 | sing | 1.09Å | 1.12Å | |
O16 | C63 | sing | 1.43Å | 1.51Å | |
C63 | C53 | sing | 1.53Å | 1.41Å | |
C63 | H631 | sing | 1.09Å | 1.11Å | |
C63 | H632 | sing | 1.09Å | 1.11Å | |
C53 | H531 | sing | 1.09Å | 1.11Å | |
C53 | H532 | sing | 1.09Å | 1.12Å | |
O23 | C73 | sing | 1.43Å | 1.44Å | |
C73 | H731 | sing | 1.09Å | 1.11Å | |
C73 | H732 | sing | 1.09Å | 1.12Å | |
C73 | H733 | sing | 1.09Å | 1.11Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | C20 | 122.5° | 119.9° |
C2 | C1 | H1 | 120.3° | 120.1° |
C1 | C2 | C3 | 118.9° | 120.6° |
C1 | C2 | H2 | 121.3° | 119.7° |
C20 | C1 | H1 | 117.2° | 120.0° |
C1 | C20 | C5 | 119.1° | 119.7° |
C1 | C20 | C19 | 119.9° | 120.6° |
C3 | C2 | H2 | 119.7° | 119.7° |
C2 | C3 | C4 | 119.0° | 120.4° |
C2 | C3 | H3 | 120.1° | 119.8° |
C4 | C3 | H3 | 120.9° | 119.8° |
C3 | C4 | O4 | 113.5° | 120.2° |
C3 | C4 | C5 | 122.0° | 119.7° |
O4 | C4 | C5 | 124.5° | 120.2° |
C4 | O4 | C21 | 114.8° | 106.8° |
C4 | C5 | C6 | 124.0° | 120.7° |
C4 | C5 | C20 | 118.2° | 119.6° |
O4 | C21 | H211 | 114.9° | 109.4° |
O4 | C21 | H212 | 110.2° | 109.4° |
O4 | C21 | H213 | 110.2° | 109.5° |
C6 | C5 | C20 | 117.5° | 119.7° |
C5 | C6 | O6 | 116.4° | 120.3° |
C5 | C6 | C7 | 124.5° | 119.2° |
C5 | C20 | C19 | 120.7° | 119.7° |
O6 | C6 | C7 | 119.0° | 120.4° |
C6 | C7 | C8 | 123.3° | 120.8° |
C6 | C7 | C18 | 116.0° | 119.7° |
C8 | C7 | C18 | 120.8° | 119.5° |
C7 | C8 | O8 | 125.2° | 119.8° |
C7 | C8 | C9 | 120.8° | 120.5° |
C7 | C18 | C17 | 117.6° | 119.4° |
C7 | C18 | C19 | 121.1° | 119.8° |
O8 | C8 | C9 | 114.1° | 119.7° |
C8 | O8 | HO8 | 125.1° | 106.8° |
C8 | C9 | C10 | 117.6° | 117.3° |
C8 | C9 | C16 | 118.8° | 120.1° |
C10 | C9 | C16 | 123.5° | 122.6° |
C9 | C10 | O10 | 106.7° | 109.3° |
C9 | C10 | C11 | 116.8° | 110.7° |
C9 | C10 | H10 | 108.4° | 109.2° |
C9 | C16 | C15 | 120.2° | 122.5° |
C9 | C16 | C17 | 121.2° | 120.1° |
O10 | C10 | C11 | 114.8° | 109.3° |
O10 | C10 | H10 | 110.7° | 109.2° |
C10 | O10 | C1' | 129.2° | 106.9° |
C11 | C10 | H10 | 99.1° | 109.1° |
C10 | C11 | C12 | 107.7° | 108.3° |
C10 | C11 | H111 | 112.9° | 109.8° |
C10 | C11 | H112 | 112.9° | 109.6° |
O10 | C1' | C2' | 112.2° | 109.4° |
O10 | C1' | O5' | 112.5° | 109.4° |
O10 | C1' | H1' | 107.4° | 109.4° |
C12 | C11 | H111 | 112.9° | 109.7° |
C12 | C11 | H112 | 112.9° | 109.7° |
C11 | C12 | O12 | 118.2° | 109.7° |
C11 | C12 | C13 | 111.0° | 109.7° |
C11 | C12 | C15 | 108.2° | 108.3° |
H111 | C11 | H112 | 97.6° | 109.7° |
O12 | C12 | C13 | 107.4° | 109.7° |
O12 | C12 | C15 | 102.3° | 109.7° |
C12 | O12 | HO12 | 118.2° | 106.8° |
C13 | C12 | C15 | 109.2° | 109.7° |
C12 | C13 | O13 | 119.0° | 120.0° |
C12 | C13 | C14 | 121.2° | 120.0° |
C12 | C15 | C16 | 113.6° | 110.7° |
C12 | C15 | H151 | 110.7° | 109.2° |
C12 | C15 | H152 | 110.7° | 109.3° |
O13 | C13 | C14 | 119.5° | 120.0° |
C13 | C14 | O14 | 111.4° | 109.5° |
C13 | C14 | H141 | 111.5° | 109.4° |
C13 | C14 | H142 | 111.5° | 109.5° |
O14 | C14 | H141 | 111.5° | 109.4° |
O14 | C14 | H142 | 111.5° | 109.5° |
C14 | O14 | HO14 | 111.4° | 106.8° |
H141 | C14 | H142 | 98.9° | 109.5° |
C16 | C15 | H151 | 110.7° | 109.2° |
C16 | C15 | H152 | 110.7° | 109.2° |
C15 | C16 | C17 | 118.6° | 117.4° |
H151 | C15 | H152 | 99.6° | 109.2° |
C16 | C17 | O17 | 115.2° | 119.8° |
C16 | C17 | C18 | 120.9° | 120.5° |
O17 | C17 | C18 | 123.9° | 119.8° |
C17 | O17 | HO17 | 115.1° | 106.7° |
C17 | C18 | C19 | 121.4° | 120.8° |
C18 | C19 | O19 | 123.7° | 120.5° |
C18 | C19 | C20 | 120.0° | 119.1° |
O19 | C19 | C20 | 116.2° | 120.4° |
H211 | C21 | H212 | 110.3° | 109.5° |
H211 | C21 | H213 | 110.3° | 109.5° |
H212 | C21 | H213 | 100.0° | 109.5° |
C2' | C1' | O5' | 114.9° | 109.8° |
C2' | C1' | H1' | 104.6° | 109.4° |
C1' | C2' | C3' | 108.2° | 109.0° |
C1' | C2' | H2'1 | 112.7° | 109.5° |
C1' | C2' | H2'2 | 112.7° | 109.5° |
O5' | C1' | H1' | 104.3° | 109.4° |
C1' | O5' | C5' | 113.4° | 107.6° |
C3' | C2' | H2'1 | 112.7° | 109.6° |
C3' | C2' | H2'2 | 112.7° | 109.5° |
C2' | C3' | C4' | 111.3° | 108.8° |
C2' | C3' | N3' | 111.9° | 109.6° |
C2' | C3' | H3' | 109.8° | 109.6° |
H2'1 | C2' | H2'2 | 97.8° | 109.7° |
C4' | C3' | N3' | 117.6° | 109.5° |
C4' | C3' | H3' | 102.9° | 109.6° |
C3' | C4' | O4' | 116.5° | 109.5° |
C3' | C4' | C5' | 118.4° | 109.0° |
C3' | C4' | H4' | 94.9° | 109.8° |
N3' | C3' | H3' | 102.2° | 109.6° |
C3' | N3' | C33 | 113.8° | 106.7° |
C3' | N3' | C53 | 115.9° | 106.7° |
O4' | C4' | C5' | 99.8° | 109.5° |
O4' | C4' | H4' | 115.2° | 109.5° |
C4' | O4' | HO4' | 116.4° | 106.8° |
C5' | C4' | H4' | 113.1° | 109.5° |
C4' | C5' | O5' | 108.1° | 109.9° |
C4' | C5' | C6' | 113.1° | 109.4° |
C4' | C5' | H5' | 108.3° | 109.3° |
O5' | C5' | C6' | 110.4° | 109.4° |
O5' | C5' | H5' | 111.1° | 109.4° |
C6' | C5' | H5' | 105.9° | 109.4° |
C5' | C6' | H6'1 | 113.1° | 109.5° |
C5' | C6' | H6'2 | 110.9° | 109.5° |
C5' | C6' | H6'3 | 110.8° | 109.4° |
H6'1 | C6' | H6'2 | 110.9° | 109.5° |
H6'1 | C6' | H6'3 | 110.9° | 109.5° |
H6'2 | C6' | H6'3 | 99.4° | 109.5° |
C33 | N3' | C53 | 114.5° | 106.7° |
N3' | C33 | C23 | 109.4° | 109.5° |
N3' | C33 | H331 | 112.2° | 109.5° |
N3' | C33 | H332 | 112.3° | 109.4° |
N3' | C53 | C63 | 121.5° | 109.5° |
N3' | C53 | H531 | 107.9° | 109.5° |
N3' | C53 | H532 | 107.9° | 109.5° |
C23 | C33 | H331 | 112.2° | 109.5° |
C23 | C33 | H332 | 112.3° | 109.5° |
C33 | C23 | O16 | 109.3° | 109.7° |
C33 | C23 | O23 | 115.6° | 109.5° |
C33 | C23 | H23 | 105.1° | 109.4° |
H331 | C33 | H332 | 98.2° | 109.4° |
O16 | C23 | O23 | 108.6° | 109.4° |
O16 | C23 | H23 | 112.5° | 109.4° |
C23 | O16 | C63 | 125.7° | 107.2° |
O23 | C23 | H23 | 105.8° | 109.5° |
C23 | O23 | C73 | 120.6° | 106.8° |
O16 | C63 | C53 | 113.0° | 109.7° |
O16 | C63 | H631 | 110.9° | 109.4° |
O16 | C63 | H632 | 110.9° | 109.5° |
C53 | C63 | H631 | 110.9° | 109.4° |
C53 | C63 | H632 | 110.9° | 109.4° |
C63 | C53 | H531 | 107.9° | 109.5° |
C63 | C53 | H532 | 107.9° | 109.5° |
H631 | C63 | H632 | 99.4° | 109.4° |
H531 | C53 | H532 | 102.0° | 109.4° |
O23 | C73 | H731 | 120.7° | 109.5° |
O23 | C73 | H732 | 108.2° | 109.5° |
O23 | C73 | H733 | 108.2° | 109.5° |
H731 | C73 | H732 | 108.2° | 109.4° |
H731 | C73 | H733 | 108.2° | 109.5° |
H732 | C73 | H733 | 101.7° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | C20 | H1 | 180.0° | 180.0° |
C1 | C2 | C3 | H2 | 179.9° | 180.0° |
C1 | C2 | C3 | C4 | 1.2° | 0.0° |
C1 | C2 | C3 | H3 | 178.7° | 180.0° |
C2 | C1 | C20 | C5 | 6.2° | 0.1° |
C2 | C1 | C20 | C19 | 179.4° | 180.0° |
C20 | C1 | C2 | C3 | 2.9° | 0.0° |
C20 | C1 | C2 | H2 | 177.1° | 180.0° |
C1 | C20 | C5 | C4 | 5.3° | 0.1° |
C1 | C20 | C5 | C6 | 179.6° | 179.9° |
C1 | C20 | C5 | C19 | 174.3° | 179.9° |
C1 | C20 | C19 | C18 | 178.3° | 166.1° |
C1 | C20 | C19 | O19 | 5.2° | 13.9° |
H1 | C1 | C2 | C3 | 177.1° | 179.9° |
H1 | C1 | C2 | H2 | 2.9° | 0.0° |
H1 | C1 | C20 | C5 | 173.8° | 179.9° |
H1 | C1 | C20 | C19 | 0.6° | 0.0° |
C2 | C3 | C4 | H3 | 180.0° | 180.0° |
C2 | C3 | C4 | O4 | 178.9° | 180.0° |
C2 | C3 | C4 | C5 | 1.9° | 0.0° |
H2 | C2 | C3 | C4 | 178.8° | 180.0° |
H2 | C2 | C3 | H3 | 1.2° | 0.0° |
C3 | C4 | O4 | C5 | 179.1° | 180.0° |
C3 | C4 | O4 | C21 | 9.1° | 0.0° |
C3 | C4 | C5 | C6 | 176.1° | 179.9° |
C3 | C4 | C5 | C20 | 1.4° | 0.1° |
H3 | C3 | C4 | O4 | 1.1° | 0.0° |
H3 | C3 | C4 | C5 | 178.1° | 180.0° |
O4 | C4 | C5 | C6 | 3.0° | 0.1° |
O4 | C4 | C5 | C20 | 177.7° | 179.9° |
C4 | O4 | C21 | H211 | 180.0° | 180.0° |
C4 | O4 | C21 | H212 | 54.7° | 60.0° |
C4 | O4 | C21 | H213 | 54.7° | 60.0° |
C5 | C4 | O4 | C21 | 170.0° | 180.0° |
C4 | C5 | C6 | C20 | 174.7° | 180.0° |
C4 | C5 | C6 | O6 | 5.1° | 13.8° |
C4 | C5 | C6 | C7 | 178.3° | 166.3° |
C4 | C5 | C20 | C19 | 179.6° | 180.0° |
O4 | C21 | H211 | H212 | 125.3° | 119.9° |
O4 | C21 | H211 | H213 | 125.3° | 120.0° |
O4 | C21 | H212 | H213 | 116.0° | 120.0° |
C5 | C6 | O6 | C7 | 176.8° | 179.9° |
C5 | C6 | C7 | C8 | 179.4° | 166.3° |
C5 | C6 | C7 | C18 | 0.5° | 13.7° |
C6 | C5 | C20 | C19 | 5.3° | 0.0° |
C20 | C5 | C6 | O6 | 179.8° | 166.2° |
C20 | C5 | C6 | C7 | 3.6° | 13.7° |
C5 | C20 | C19 | C18 | 4.1° | 13.8° |
C5 | C20 | C19 | O19 | 179.4° | 166.2° |
O6 | C6 | C7 | C8 | 2.9° | 13.8° |
O6 | C6 | C7 | C18 | 177.0° | 166.2° |
C6 | C7 | C8 | C18 | 179.9° | 180.0° |
C6 | C7 | C8 | O8 | 0.2° | 0.1° |
C6 | C7 | C8 | C9 | 179.6° | 179.8° |
C6 | C7 | C18 | C17 | 179.4° | 179.8° |
C6 | C7 | C18 | C19 | 0.9° | 0.1° |
C7 | C8 | O8 | C9 | 179.5° | 180.0° |
C7 | C8 | O8 | HO8 | 180.0° | 84.6° |
C7 | C8 | C9 | C10 | 177.6° | 179.7° |
C7 | C8 | C9 | C16 | 0.8° | 0.1° |
C8 | C7 | C18 | C17 | 0.5° | 0.2° |
C8 | C7 | C18 | C19 | 179.2° | 179.9° |
C18 | C7 | C8 | O8 | 179.7° | 179.9° |
C18 | C7 | C8 | C9 | 0.3° | 0.1° |
C7 | C18 | C17 | C16 | 0.3° | 0.0° |
C7 | C18 | C17 | O17 | 178.4° | 180.0° |
C7 | C18 | C17 | C19 | 179.7° | 179.9° |
C7 | C18 | C19 | O19 | 177.1° | 166.2° |
C7 | C18 | C19 | C20 | 0.9° | 13.8° |
O8 | C8 | C9 | C10 | 1.8° | 0.3° |
O8 | C8 | C9 | C16 | 178.7° | 179.9° |
C9 | C8 | O8 | HO8 | 0.6° | 95.4° |
C8 | C9 | C10 | C16 | 176.7° | 179.8° |
C8 | C9 | C10 | O10 | 63.0° | 42.1° |
C8 | C9 | C10 | C11 | 167.1° | 162.5° |
C8 | C9 | C10 | H10 | 56.3° | 77.3° |
C8 | C9 | C16 | C15 | 179.4° | 179.7° |
C8 | C9 | C16 | C17 | 1.6° | 0.3° |
C9 | C10 | O10 | C11 | 131.1° | 121.3° |
C9 | C10 | O10 | H10 | 117.7° | 119.4° |
C9 | C10 | C11 | H10 | 116.0° | 120.2° |
C9 | C10 | O10 | C1' | 144.6° | 130.6° |
C9 | C10 | C11 | C12 | 42.2° | 51.1° |
C9 | C10 | C11 | H111 | 83.0° | 170.9° |
C9 | C10 | C11 | H112 | 167.5° | 68.5° |
C10 | C9 | C16 | C15 | 3.9° | 0.6° |
C10 | C9 | C16 | C17 | 178.3° | 179.5° |
C16 | C9 | C10 | O10 | 120.3° | 138.1° |
C16 | C9 | C10 | C11 | 9.6° | 17.7° |
C16 | C9 | C10 | H10 | 120.4° | 102.5° |
C9 | C16 | C15 | C12 | 18.0° | 17.6° |
C9 | C16 | C15 | C17 | 177.9° | 179.9° |
C9 | C16 | C15 | H151 | 107.3° | 137.9° |
C9 | C16 | C15 | H152 | 143.2° | 102.7° |
C9 | C16 | C17 | O17 | 177.4° | 179.8° |
C9 | C16 | C17 | C18 | 1.4° | 0.2° |
O10 | C10 | C11 | H10 | 118.0° | 119.3° |
O10 | C10 | C11 | C12 | 83.8° | 171.5° |
O10 | C10 | C11 | H111 | 151.0° | 68.7° |
O10 | C10 | C11 | H112 | 41.5° | 51.9° |
C10 | O10 | C1' | C2' | 154.1° | 166.3° |
C10 | O10 | C1' | O5' | 74.5° | 73.3° |
C10 | O10 | C1' | H1' | 39.7° | 46.5° |
C11 | C10 | O10 | C1' | 84.3° | 108.1° |
C10 | C11 | C12 | H111 | 125.3° | 119.8° |
C10 | C11 | C12 | H112 | 125.2° | 119.6° |
C10 | C11 | H111 | H112 | 118.8° | 120.6° |
C10 | C11 | C12 | O12 | 54.2° | 170.6° |
C10 | C11 | C12 | C13 | 178.9° | 50.0° |
C10 | C11 | C12 | C15 | 61.3° | 69.8° |
H10 | C10 | O10 | C1' | 26.9° | 11.2° |
H10 | C10 | C11 | C12 | 158.2° | 69.1° |
H10 | C10 | C11 | H111 | 33.0° | 50.6° |
H10 | C10 | C11 | H112 | 76.5° | 171.2° |
O10 | C1' | C2' | O5' | 130.2° | 120.1° |
O10 | C1' | C2' | H1' | 116.1° | 119.8° |
O10 | C1' | O5' | H1' | 116.1° | 119.8° |
O10 | C1' | C2' | C3' | 75.8° | 58.8° |
O10 | C1' | C2' | H2'1 | 158.9° | 61.0° |
O10 | C1' | C2' | H2'2 | 49.4° | 178.7° |
O10 | C1' | O5' | C5' | 67.8° | 52.5° |
C12 | C11 | H111 | H112 | 118.8° | 120.5° |
C11 | C12 | O12 | C13 | 126.4° | 120.6° |
C11 | C12 | O12 | C15 | 118.6° | 118.8° |
C11 | C12 | C13 | C15 | 119.2° | 118.8° |
C11 | C12 | O12 | HO12 | 180.0° | 180.0° |
C11 | C12 | C13 | O13 | 93.1° | 95.6° |
C11 | C12 | C13 | C14 | 93.0° | 84.5° |
C11 | C12 | C15 | C16 | 50.4° | 51.0° |
C11 | C12 | C15 | H151 | 74.8° | 171.3° |
C11 | C12 | C15 | H152 | 175.7° | 69.3° |
H111 | C11 | C12 | O12 | 179.5° | 50.8° |
H111 | C11 | C12 | C13 | 55.8° | 69.8° |
H111 | C11 | C12 | C15 | 64.0° | 170.5° |
H112 | C11 | C12 | O12 | 71.0° | 69.8° |
H112 | C11 | C12 | C13 | 53.7° | 169.6° |
H112 | C11 | C12 | C15 | 173.5° | 49.9° |
O12 | C12 | C13 | C15 | 110.2° | 120.6° |
O12 | C12 | C13 | O13 | 136.3° | 143.9° |
O12 | C12 | C13 | C14 | 37.6° | 36.0° |
O12 | C12 | C15 | C16 | 75.1° | 170.7° |
O12 | C12 | C15 | H151 | 159.7° | 69.0° |
O12 | C12 | C15 | H152 | 50.2° | 50.4° |
C13 | C12 | O12 | HO12 | 53.6° | 59.4° |
C12 | C13 | O13 | C14 | 174.0° | 179.9° |
C12 | C13 | C14 | O14 | 164.0° | 180.0° |
C12 | C13 | C14 | H141 | 38.7° | 60.1° |
C12 | C13 | C14 | H142 | 70.7° | 60.0° |
C13 | C12 | C15 | C16 | 171.3° | 68.7° |
C13 | C12 | C15 | H151 | 46.1° | 51.6° |
C13 | C12 | C15 | H152 | 63.4° | 171.0° |
C15 | C12 | O12 | HO12 | 61.3° | 61.2° |
C15 | C12 | C13 | O13 | 26.1° | 23.3° |
C15 | C12 | C13 | C14 | 147.9° | 156.6° |
C12 | C15 | C16 | H151 | 125.2° | 120.3° |
C12 | C15 | C16 | H152 | 125.3° | 120.3° |
C12 | C15 | H151 | H152 | 116.6° | 119.5° |
C12 | C15 | C16 | C17 | 160.0° | 162.4° |
O13 | C13 | C14 | O14 | 22.1° | 0.1° |
O13 | C13 | C14 | H141 | 147.3° | 120.0° |
O13 | C13 | C14 | H142 | 103.2° | 119.9° |
C13 | C14 | O14 | H141 | 125.3° | 119.9° |
C13 | C14 | O14 | H142 | 125.3° | 120.1° |
C13 | C14 | H141 | H142 | 117.3° | 120.1° |
C13 | C14 | O14 | HO14 | 180.0° | 179.9° |
O14 | C14 | H141 | H142 | 117.4° | 120.0° |
H141 | C14 | O14 | HO14 | 54.7° | 60.0° |
H142 | C14 | O14 | HO14 | 54.8° | 60.0° |
C16 | C15 | H151 | H152 | 116.6° | 119.3° |
C15 | C16 | C17 | O17 | 0.5° | 0.3° |
C15 | C16 | C17 | C18 | 179.3° | 179.7° |
H151 | C15 | C16 | C17 | 74.8° | 42.1° |
H152 | C15 | C16 | C17 | 34.7° | 77.2° |
C16 | C17 | O17 | C18 | 178.7° | 180.0° |
C16 | C17 | O17 | HO17 | 179.9° | 90.0° |
C16 | C17 | C18 | C19 | 180.0° | 179.9° |
O17 | C17 | C18 | C19 | 1.3° | 0.1° |
C18 | C17 | O17 | HO17 | 1.2° | 90.0° |
C17 | C18 | C19 | O19 | 2.6° | 13.9° |
C17 | C18 | C19 | C20 | 178.8° | 166.1° |
C18 | C19 | O19 | C20 | 176.3° | 180.0° |
H211 | C21 | H212 | H213 | 116.1° | 120.1° |
C2' | C1' | O5' | H1' | 113.9° | 120.1° |
C1' | C2' | C3' | H2'1 | 125.3° | 119.8° |
C1' | C2' | C3' | H2'2 | 125.2° | 119.8° |
C1' | C2' | H2'1 | H2'2 | 118.6° | 120.2° |
C1' | C2' | C3' | C4' | 43.8° | 53.7° |
C1' | C2' | C3' | N3' | 177.7° | 173.5° |
C1' | C2' | C3' | H3' | 69.5° | 66.2° |
C2' | C1' | O5' | C5' | 62.2° | 67.6° |
O5' | C1' | C2' | C3' | 54.4° | 61.3° |
O5' | C1' | C2' | H2'1 | 70.9° | 178.9° |
O5' | C1' | C2' | H2'2 | 179.6° | 58.6° |
C1' | O5' | C5' | C4' | 55.2° | 67.5° |
C1' | O5' | C5' | C6' | 179.4° | 172.3° |
C1' | O5' | C5' | H5' | 63.4° | 52.5° |
H1' | C1' | C2' | C3' | 168.1° | 178.6° |
H1' | C1' | C2' | H2'1 | 42.8° | 58.8° |
H1' | C1' | C2' | H2'2 | 66.7° | 61.5° |
H1' | C1' | O5' | C5' | 176.1° | 172.3° |
C3' | C2' | H2'1 | H2'2 | 118.6° | 120.3° |
C2' | C3' | C4' | N3' | 131.0° | 119.8° |
C2' | C3' | C4' | H3' | 117.6° | 119.9° |
C2' | C3' | N3' | H3' | 117.5° | 120.3° |
C2' | C3' | C4' | O4' | 73.2° | 66.3° |
C2' | C3' | C4' | C5' | 45.8° | 53.5° |
C2' | C3' | C4' | H4' | 165.4° | 173.4° |
C2' | C3' | N3' | C33 | 169.9° | 60.3° |
C2' | C3' | N3' | C53 | 54.2° | 174.1° |
H2'1 | C2' | C3' | C4' | 81.5° | 173.5° |
H2'1 | C2' | C3' | N3' | 52.4° | 66.7° |
H2'1 | C2' | C3' | H3' | 165.2° | 53.6° |
H2'2 | C2' | C3' | C4' | 169.1° | 66.2° |
H2'2 | C2' | C3' | N3' | 57.0° | 53.6° |
H2'2 | C2' | C3' | H3' | 55.8° | 173.9° |
C4' | C3' | N3' | H3' | 111.8° | 120.3° |
C3' | C4' | O4' | C5' | 128.7° | 119.4° |
C3' | C4' | O4' | H4' | 109.9° | 120.4° |
C3' | C4' | C5' | H4' | 109.7° | 120.1° |
C3' | C4' | O4' | HO4' | 180.0° | 179.4° |
C3' | C4' | C5' | O5' | 48.8° | 61.0° |
C3' | C4' | C5' | C6' | 171.4° | 178.8° |
C3' | C4' | C5' | H5' | 71.6° | 59.1° |
C4' | C3' | N3' | C33 | 39.1° | 179.7° |
C4' | C3' | N3' | C53 | 175.0° | 66.6° |
N3' | C3' | C4' | O4' | 57.8° | 53.5° |
N3' | C3' | C4' | C5' | 176.9° | 173.3° |
N3' | C3' | C4' | H4' | 63.6° | 66.7° |
C3' | N3' | C33 | C53 | 136.5° | 113.8° |
C3' | N3' | C33 | C23 | 167.3° | 173.1° |
C3' | N3' | C33 | H331 | 67.5° | 53.0° |
C3' | N3' | C33 | H332 | 42.0° | 66.9° |
C3' | N3' | C53 | C63 | 174.3° | 173.0° |
C3' | N3' | C53 | H531 | 60.4° | 53.0° |
C3' | N3' | C53 | H532 | 49.1° | 66.9° |
H3' | C3' | C4' | O4' | 169.2° | 173.9° |
H3' | C3' | C4' | C5' | 71.8° | 66.4° |
H3' | C3' | C4' | H4' | 47.8° | 53.6° |
H3' | C3' | N3' | C33 | 72.7° | 60.0° |
H3' | C3' | N3' | C53 | 63.2° | 53.7° |
O4' | C4' | C5' | H4' | 122.9° | 120.2° |
O4' | C4' | C5' | O5' | 78.6° | 58.7° |
O4' | C4' | C5' | C6' | 43.9° | 61.5° |
O4' | C4' | C5' | H5' | 161.0° | 178.8° |
C5' | C4' | O4' | HO4' | 51.3° | 60.0° |
C4' | C5' | O5' | C6' | 124.2° | 120.2° |
C4' | C5' | O5' | H5' | 118.6° | 120.0° |
C4' | C5' | C6' | H5' | 118.4° | 119.7° |
C4' | C5' | C6' | H6'1 | 180.0° | 179.5° |
C4' | C5' | C6' | H6'2 | 54.7° | 60.5° |
C4' | C5' | C6' | H6'3 | 54.8° | 59.5° |
H4' | C4' | O4' | HO4' | 70.1° | 60.2° |
H4' | C4' | C5' | O5' | 158.5° | 178.9° |
H4' | C4' | C5' | C6' | 79.0° | 58.7° |
H4' | C4' | C5' | H5' | 38.0° | 61.0° |
O5' | C5' | C6' | H5' | 120.3° | 119.8° |
O5' | C5' | C6' | H6'1 | 58.8° | 59.9° |
O5' | C5' | C6' | H6'2 | 66.6° | 60.0° |
O5' | C5' | C6' | H6'3 | 176.0° | 180.0° |
C5' | C6' | H6'1 | H6'2 | 125.3° | 120.0° |
C5' | C6' | H6'1 | H6'3 | 125.2° | 120.0° |
C5' | C6' | H6'2 | H6'3 | 116.7° | 119.9° |
H5' | C5' | C6' | H6'1 | 61.6° | 59.9° |
H5' | C5' | C6' | H6'2 | 173.1° | 179.9° |
H5' | C5' | C6' | H6'3 | 63.7° | 60.2° |
H6'1 | C6' | H6'2 | H6'3 | 116.8° | 120.1° |
N3' | C33 | C23 | H331 | 125.2° | 120.1° |
N3' | C33 | C23 | H332 | 125.3° | 120.0° |
N3' | C33 | H331 | H332 | 118.2° | 119.9° |
N3' | C33 | C23 | O16 | 50.5° | 62.9° |
N3' | C33 | C23 | O23 | 72.3° | 177.1° |
N3' | C33 | C23 | H23 | 171.5° | 57.1° |
C33 | N3' | C53 | C63 | 38.7° | 59.3° |
C33 | N3' | C53 | H531 | 164.0° | 60.8° |
C33 | N3' | C53 | H532 | 86.5° | 179.3° |
C53 | N3' | C33 | C23 | 56.2° | 59.3° |
C53 | N3' | C33 | H331 | 69.0° | 60.8° |
C53 | N3' | C33 | H332 | 178.5° | 179.3° |
N3' | C53 | C63 | O16 | 14.7° | 62.9° |
N3' | C53 | C63 | H531 | 125.3° | 120.1° |
N3' | C53 | C63 | H532 | 125.2° | 120.0° |
N3' | C53 | C63 | H631 | 139.9° | 177.1° |
N3' | C53 | C63 | H632 | 110.6° | 57.2° |
N3' | C53 | H531 | H532 | 113.5° | 120.0° |
C23 | C33 | H331 | H332 | 118.2° | 120.0° |
C33 | C23 | O16 | O23 | 126.9° | 120.0° |
C33 | C23 | O16 | H23 | 116.3° | 120.0° |
C33 | C23 | O23 | H23 | 115.8° | 120.0° |
C33 | C23 | O16 | C63 | 31.6° | 63.2° |
C33 | C23 | O23 | C73 | 172.8° | 179.9° |
H331 | C33 | C23 | O16 | 74.7° | 57.1° |
H331 | C33 | C23 | O23 | 162.5° | 62.9° |
H331 | C33 | C23 | H23 | 46.3° | 177.2° |
H332 | C33 | C23 | O16 | 175.8° | 177.1° |
H332 | C33 | C23 | O23 | 53.0° | 57.0° |
H332 | C33 | C23 | H23 | 63.2° | 62.9° |
O16 | C23 | O23 | H23 | 121.0° | 119.9° |
C23 | O16 | C63 | C53 | 12.6° | 63.2° |
C23 | O16 | C63 | H631 | 137.9° | 176.7° |
C23 | O16 | C63 | H632 | 112.7° | 56.8° |
O16 | C23 | O23 | C73 | 49.7° | 59.9° |
O23 | C23 | O16 | C63 | 95.3° | 176.7° |
C23 | O23 | C73 | H731 | 180.0° | 180.0° |
C23 | O23 | C73 | H732 | 54.7° | 60.0° |
C23 | O23 | C73 | H733 | 54.7° | 59.9° |
H23 | C23 | O16 | C63 | 147.9° | 56.8° |
H23 | C23 | O23 | C73 | 71.3° | 60.0° |
O16 | C63 | C53 | H631 | 125.2° | 120.0° |
O16 | C63 | C53 | H632 | 125.3° | 120.1° |
O16 | C63 | H631 | H632 | 116.8° | 119.9° |
O16 | C63 | C53 | H531 | 140.0° | 57.2° |
O16 | C63 | C53 | H532 | 110.5° | 177.1° |
C53 | C63 | H631 | H632 | 116.8° | 119.9° |
C63 | C53 | H531 | H532 | 113.5° | 119.9° |
H631 | C63 | C53 | H531 | 94.8° | 62.9° |
H631 | C63 | C53 | H532 | 14.7° | 57.0° |
H632 | C63 | C53 | H531 | 14.7° | 177.2° |
H632 | C63 | C53 | H532 | 124.2° | 62.9° |
O23 | C73 | H731 | H732 | 125.3° | 120.0° |
O23 | C73 | H731 | H733 | 125.3° | 120.1° |
O23 | C73 | H732 | H733 | 113.8° | 120.0° |
H731 | C73 | H732 | H733 | 113.8° | 120.0° |