GWQ
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C46 | C47 | doub | 1.35Å | 1.36Å | Aromatic |
C46 | C44 | sing | 1.41Å | 1.49Å | Aromatic |
C47 | C48 | sing | 1.41Å | 1.48Å | Aromatic |
C43 | C44 | doub | 1.40Å | 1.30Å | Aromatic |
C43 | C42 | sing | 1.37Å | 1.44Å | Aromatic |
C44 | C45 | sing | 1.42Å | 1.44Å | Aromatic |
C42 | C41 | doub | 1.39Å | 1.35Å | Aromatic |
C48 | C51 | doub | 1.40Å | 1.31Å | Aromatic |
C48 | C49 | sing | 1.42Å | 1.44Å | Aromatic |
C45 | C49 | sing | 1.44Å | 1.34Å | Aromatic |
C45 | N40 | doub | 1.31Å | 1.39Å | Aromatic |
C51 | C52 | sing | 1.37Å | 1.45Å | Aromatic |
C41 | N40 | sing | 1.32Å | 1.40Å | Aromatic |
C49 | N50 | doub | 1.31Å | 1.38Å | Aromatic |
N40 | RU1 | sing | 2.04Å | 2.00Å | |
C28 | C27 | doub | 1.39Å | 1.34Å | Aromatic |
C28 | C29 | sing | 1.37Å | 1.44Å | Aromatic |
C27 | N26 | sing | 1.32Å | 1.41Å | Aromatic |
C52 | C53 | doub | 1.39Å | 1.36Å | Aromatic |
N50 | C53 | sing | 1.32Å | 1.41Å | Aromatic |
N50 | RU1 | sing | 2.04Å | 2.03Å | |
C29 | C31 | doub | 1.40Å | 1.30Å | Aromatic |
N26 | RU1 | sing | 2.03Å | 2.01Å | |
N26 | C30 | doub | 1.31Å | 1.39Å | Aromatic |
RU1 | N17 | sing | 2.04Å | 2.01Å | |
RU1 | N22 | sing | 2.03Å | 2.01Å | |
RU1 | N39 | sing | 2.03Å | 2.01Å | |
C16 | N17 | doub | 1.32Å | 1.41Å | Aromatic |
C16 | C15 | sing | 1.39Å | 1.35Å | Aromatic |
N17 | C18 | sing | 1.31Å | 1.39Å | Aromatic |
C31 | C30 | sing | 1.42Å | 1.43Å | Aromatic |
C31 | C32 | sing | 1.41Å | 1.49Å | Aromatic |
C30 | C38 | sing | 1.44Å | 1.34Å | Aromatic |
N22 | C23 | doub | 1.33Å | 1.41Å | Aromatic |
N22 | C19 | sing | 1.32Å | 1.38Å | Aromatic |
C15 | C14 | doub | 1.38Å | 1.50Å | Aromatic |
C23 | C24 | sing | 1.39Å | 1.34Å | Aromatic |
C18 | C19 | doub | 1.44Å | 1.40Å | Aromatic |
C18 | C13 | sing | 1.41Å | 1.37Å | Aromatic |
C19 | C20 | sing | 1.41Å | 1.38Å | Aromatic |
N39 | C38 | doub | 1.32Å | 1.39Å | Aromatic |
N39 | C37 | sing | 1.32Å | 1.41Å | Aromatic |
C38 | C34 | sing | 1.42Å | 1.44Å | Aromatic |
C32 | C33 | doub | 1.35Å | 1.36Å | Aromatic |
C24 | C25 | doub | 1.38Å | 1.49Å | Aromatic |
C14 | C13 | sing | 1.39Å | 1.35Å | Aromatic |
C13 | C10 | doub | 1.47Å | 1.39Å | Aromatic |
C20 | C25 | sing | 1.39Å | 1.35Å | Aromatic |
C20 | C11 | doub | 1.47Å | 1.38Å | Aromatic |
C10 | C11 | sing | 1.46Å | 1.42Å | Aromatic |
C10 | N09 | sing | 1.32Å | 1.32Å | Aromatic |
C37 | C36 | doub | 1.39Å | 1.35Å | Aromatic |
C33 | C34 | sing | 1.41Å | 1.49Å | Aromatic |
C34 | C35 | doub | 1.40Å | 1.31Å | Aromatic |
C11 | N12 | sing | 1.32Å | 1.35Å | Aromatic |
N09 | C07 | doub | 1.33Å | 1.33Å | Aromatic |
N12 | C08 | doub | 1.33Å | 1.33Å | Aromatic |
C36 | C35 | sing | 1.37Å | 1.45Å | Aromatic |
C07 | C08 | sing | 1.46Å | 1.39Å | Aromatic |
C07 | C06 | sing | 1.41Å | 1.43Å | Aromatic |
C08 | C05 | sing | 1.41Å | 1.47Å | Aromatic |
C06 | C03 | doub | 1.38Å | 1.31Å | Aromatic |
C05 | C04 | doub | 1.36Å | 1.34Å | Aromatic |
C03 | C04 | sing | 1.41Å | 1.48Å | Aromatic |
C03 | C02 | sing | 1.43Å | 1.42Å | |
C02 | N01 | trip | 1.14Å | 1.15Å | |
C51 | H1 | sing | 1.08Å | 1.08Å | |
C52 | H2 | sing | 1.08Å | 1.08Å | |
C14 | H3 | sing | 1.08Å | 1.08Å | |
C15 | H4 | sing | 1.08Å | 1.08Å | |
C04 | H5 | sing | 1.08Å | 1.08Å | |
C05 | H6 | sing | 1.08Å | 1.08Å | |
C06 | H7 | sing | 1.08Å | 1.08Å | |
C16 | H8 | sing | 1.08Å | 1.08Å | |
C23 | H9 | sing | 1.08Å | 1.08Å | |
C24 | H10 | sing | 1.08Å | 1.08Å | |
C25 | H11 | sing | 1.08Å | 1.08Å | |
C27 | H12 | sing | 1.08Å | 1.08Å | |
C28 | H13 | sing | 1.08Å | 1.08Å | |
C29 | H14 | sing | 1.08Å | 1.08Å | |
C32 | H15 | sing | 1.08Å | 1.08Å | |
C33 | H16 | sing | 1.08Å | 1.08Å | |
C35 | H17 | sing | 1.08Å | 1.08Å | |
C36 | H18 | sing | 1.08Å | 1.08Å | |
C37 | H19 | sing | 1.08Å | 1.08Å | |
C41 | H20 | sing | 1.08Å | 1.08Å | |
C42 | H21 | sing | 1.08Å | 1.08Å | |
C43 | H22 | sing | 1.08Å | 1.08Å | |
C46 | H23 | sing | 1.08Å | 1.08Å | |
C47 | H24 | sing | 1.08Å | 1.08Å | |
C53 | H25 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C47 | C46 | C44 | 120.8° | 121.2° |
C46 | C47 | C48 | 120.7° | 121.3° |
C47 | C46 | H23 | 119.6° | 119.3° |
C46 | C47 | H24 | 119.6° | 119.3° |
C46 | C44 | C43 | 123.7° | 122.2° |
C46 | C44 | C45 | 116.8° | 119.5° |
C44 | C46 | H23 | 119.6° | 119.5° |
C47 | C48 | C51 | 123.3° | 122.2° |
C47 | C48 | C49 | 116.8° | 119.6° |
C48 | C47 | H24 | 119.6° | 119.4° |
C44 | C43 | C42 | 121.3° | 118.3° |
C43 | C44 | C45 | 119.5° | 118.3° |
C44 | C43 | H22 | 119.4° | 120.8° |
C43 | C42 | C41 | 121.4° | 120.0° |
C43 | C42 | H21 | 119.3° | 120.1° |
C42 | C43 | H22 | 119.3° | 120.9° |
C44 | C45 | C49 | 122.1° | 119.4° |
C44 | C45 | N40 | 118.7° | 121.1° |
C42 | C41 | N40 | 117.5° | 121.2° |
C42 | C41 | H20 | 121.2° | 119.4° |
C41 | C42 | H21 | 119.3° | 119.9° |
C51 | C48 | C49 | 119.8° | 118.2° |
C48 | C51 | C52 | 120.9° | 118.2° |
C48 | C51 | H1 | 119.5° | 120.9° |
C48 | C49 | C45 | 122.7° | 119.0° |
C48 | C49 | N50 | 119.4° | 121.3° |
C49 | C45 | N40 | 119.3° | 119.5° |
C45 | C49 | N50 | 118.0° | 119.7° |
C45 | N40 | C41 | 121.6° | 121.1° |
C45 | N40 | RU1 | 109.8° | 108.4° |
C51 | C52 | C53 | 120.7° | 120.2° |
C52 | C51 | H1 | 119.6° | 120.9° |
C51 | C52 | H2 | 119.6° | 120.0° |
C41 | N40 | RU1 | 128.6° | 130.6° |
N40 | C41 | H20 | 121.3° | 119.4° |
C49 | N50 | C53 | 120.7° | 120.9° |
C49 | N50 | RU1 | 110.1° | 108.2° |
N40 | RU1 | N50 | 82.8° | 84.3° |
N40 | RU1 | N26 | 93.9° | 91.6° |
N40 | RU1 | N17 | 92.4° | 89.2° |
N40 | RU1 | N22 | 98.5° | 89.1° |
N40 | RU1 | N39 | 175.1° | 174.9° |
C27 | C28 | C29 | 120.7° | 120.0° |
C28 | C27 | N26 | 117.6° | 121.3° |
C28 | C27 | H12 | 121.2° | 119.3° |
C27 | C28 | H13 | 119.6° | 119.9° |
C28 | C29 | C31 | 122.2° | 118.2° |
C29 | C28 | H13 | 119.6° | 120.1° |
C28 | C29 | H14 | 118.9° | 121.0° |
C27 | N26 | RU1 | 128.8° | 130.9° |
C27 | N26 | C30 | 121.8° | 120.9° |
N26 | C27 | H12 | 121.2° | 119.4° |
C52 | C53 | N50 | 118.4° | 121.2° |
C53 | C52 | H2 | 119.6° | 119.8° |
C52 | C53 | H25 | 120.8° | 119.4° |
C53 | N50 | RU1 | 129.1° | 130.9° |
N50 | C53 | H25 | 120.8° | 119.4° |
N50 | RU1 | N26 | 88.1° | 92.6° |
N50 | RU1 | N17 | 94.9° | 90.4° |
N50 | RU1 | N22 | 178.1° | 171.5° |
N50 | RU1 | N39 | 92.9° | 92.4° |
C29 | C31 | C30 | 119.3° | 118.4° |
C29 | C31 | C32 | 123.4° | 122.1° |
C31 | C29 | H14 | 118.9° | 120.8° |
RU1 | N26 | C30 | 109.4° | 108.2° |
N26 | RU1 | N17 | 173.4° | 176.9° |
N26 | RU1 | N22 | 93.1° | 92.8° |
N26 | RU1 | N39 | 83.6° | 84.7° |
N26 | C30 | C31 | 118.4° | 121.1° |
N26 | C30 | C38 | 119.1° | 119.5° |
N17 | RU1 | N22 | 83.8° | 84.3° |
N17 | RU1 | N39 | 90.4° | 94.7° |
RU1 | N17 | C16 | 128.7° | 130.3° |
RU1 | N17 | C18 | 110.0° | 107.8° |
N22 | RU1 | N39 | 85.8° | 94.6° |
RU1 | N22 | C23 | 127.2° | 130.5° |
RU1 | N22 | C19 | 110.3° | 107.8° |
RU1 | N39 | C38 | 109.6° | 107.9° |
RU1 | N39 | C37 | 130.4° | 131.4° |
N17 | C16 | C15 | 118.9° | 121.3° |
C16 | N17 | C18 | 121.1° | 121.9° |
N17 | C16 | H8 | 120.5° | 119.4° |
C16 | C15 | C14 | 119.0° | 119.2° |
C16 | C15 | H4 | 120.5° | 120.3° |
C15 | C16 | H8 | 120.6° | 119.3° |
N17 | C18 | C19 | 117.7° | 119.2° |
N17 | C18 | C13 | 121.4° | 119.6° |
C30 | C31 | C32 | 117.3° | 119.5° |
C31 | C30 | C38 | 122.5° | 119.4° |
C31 | C32 | C33 | 120.5° | 121.2° |
C31 | C32 | H15 | 119.7° | 119.5° |
C30 | C38 | N39 | 118.2° | 119.7° |
C30 | C38 | C34 | 122.1° | 119.0° |
C23 | N22 | C19 | 122.2° | 121.6° |
N22 | C23 | C24 | 118.7° | 121.5° |
N22 | C23 | H9 | 120.6° | 119.2° |
N22 | C19 | C18 | 117.8° | 119.5° |
N22 | C19 | C20 | 119.8° | 119.5° |
C15 | C14 | C13 | 120.0° | 118.3° |
C15 | C14 | H3 | 120.0° | 120.8° |
C14 | C15 | H4 | 120.5° | 120.5° |
C23 | C24 | C25 | 119.5° | 119.2° |
C24 | C23 | H9 | 120.7° | 119.3° |
C23 | C24 | H10 | 120.3° | 120.3° |
C19 | C18 | C13 | 121.0° | 121.2° |
C18 | C19 | C20 | 122.4° | 121.0° |
C18 | C13 | C14 | 119.6° | 119.2° |
C18 | C13 | C10 | 117.3° | 119.2° |
C19 | C20 | C25 | 120.4° | 119.5° |
C19 | C20 | C11 | 117.5° | 119.2° |
C38 | N39 | C37 | 119.9° | 120.8° |
N39 | C38 | C34 | 119.7° | 121.2° |
N39 | C37 | C36 | 118.5° | 121.3° |
N39 | C37 | H19 | 120.7° | 119.4° |
C38 | C34 | C33 | 116.8° | 119.6° |
C38 | C34 | C35 | 120.2° | 118.3° |
C32 | C33 | C34 | 120.9° | 121.3° |
C33 | C32 | H15 | 119.8° | 119.3° |
C32 | C33 | H16 | 119.6° | 119.3° |
C24 | C25 | C20 | 119.4° | 118.0° |
C25 | C24 | H10 | 120.2° | 120.5° |
C24 | C25 | H11 | 120.3° | 121.0° |
C14 | C13 | C10 | 123.1° | 121.6° |
C13 | C14 | H3 | 120.0° | 120.9° |
C13 | C10 | C11 | 122.0° | 119.1° |
C13 | C10 | N09 | 119.2° | 120.5° |
C25 | C20 | C11 | 122.1° | 121.2° |
C20 | C25 | H11 | 120.3° | 120.9° |
C20 | C11 | C10 | 119.8° | 119.4° |
C20 | C11 | N12 | 119.0° | 119.9° |
C11 | C10 | N09 | 118.7° | 120.4° |
C10 | C11 | N12 | 121.2° | 120.6° |
C10 | N09 | C07 | 119.5° | 119.3° |
C37 | C36 | C35 | 121.9° | 120.2° |
C37 | C36 | H18 | 119.1° | 119.8° |
C36 | C37 | H19 | 120.8° | 119.3° |
C33 | C34 | C35 | 123.0° | 122.1° |
C34 | C33 | H16 | 119.6° | 119.4° |
C34 | C35 | C36 | 119.7° | 118.2° |
C34 | C35 | H17 | 120.2° | 120.9° |
C11 | N12 | C08 | 118.9° | 119.3° |
N09 | C07 | C08 | 122.7° | 120.3° |
N09 | C07 | C06 | 116.5° | 120.9° |
N12 | C08 | C07 | 119.0° | 120.0° |
N12 | C08 | C05 | 121.0° | 120.7° |
C36 | C35 | H17 | 120.2° | 120.9° |
C35 | C36 | H18 | 119.0° | 120.0° |
C08 | C07 | C06 | 120.7° | 118.8° |
C07 | C08 | C05 | 120.0° | 119.3° |
C07 | C06 | C03 | 118.7° | 119.4° |
C07 | C06 | H7 | 120.7° | 120.4° |
C08 | C05 | C04 | 118.3° | 119.9° |
C08 | C05 | H6 | 120.8° | 120.0° |
C06 | C03 | C04 | 122.6° | 121.1° |
C06 | C03 | C02 | 115.7° | 119.5° |
C03 | C06 | H7 | 120.6° | 120.2° |
C05 | C04 | C03 | 119.7° | 121.4° |
C05 | C04 | H5 | 120.2° | 119.3° |
C04 | C05 | H6 | 120.9° | 120.1° |
C04 | C03 | C02 | 121.7° | 119.4° |
C03 | C04 | H5 | 120.2° | 119.2° |
C03 | C02 | N01 | 176.5° | 180.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C47 | C46 | C44 | H23 | 180.0° | 180.0° |
C46 | C47 | C48 | H24 | 180.0° | 179.8° |
C47 | C46 | C44 | C43 | 179.6° | 179.4° |
C47 | C46 | C44 | C45 | 0.8° | 0.6° |
C46 | C47 | C48 | C51 | 179.9° | 179.5° |
C46 | C47 | C48 | C49 | 0.8° | 0.5° |
C44 | C46 | C47 | C48 | 1.1° | 0.1° |
C46 | C44 | C43 | C45 | 179.6° | 180.0° |
C46 | C44 | C43 | C42 | 179.5° | 179.8° |
C46 | C44 | C45 | C49 | 0.2° | 0.6° |
C46 | C44 | C45 | N40 | 179.1° | 179.3° |
C46 | C44 | C43 | H22 | 0.5° | 0.1° |
C44 | C46 | C47 | H24 | 178.9° | 179.9° |
C47 | C48 | C51 | C49 | 179.2° | 180.0° |
C47 | C48 | C49 | C45 | 0.2° | 0.5° |
C47 | C48 | C51 | C52 | 179.8° | 180.0° |
C47 | C48 | C49 | N50 | 179.9° | 179.4° |
C47 | C48 | C51 | H1 | 0.2° | 0.2° |
C48 | C47 | C46 | H23 | 178.9° | 179.9° |
C44 | C43 | C42 | H22 | 180.0° | 179.9° |
C44 | C43 | C42 | C41 | 0.6° | 0.1° |
C43 | C44 | C45 | C49 | 179.8° | 179.4° |
C43 | C44 | C45 | N40 | 0.5° | 0.7° |
C44 | C43 | C42 | H21 | 179.5° | 179.9° |
C43 | C44 | C46 | H23 | 0.4° | 0.6° |
C42 | C43 | C44 | C45 | 0.1° | 0.2° |
C43 | C42 | C41 | H21 | 180.0° | 180.0° |
C43 | C42 | C41 | N40 | 0.7° | 0.1° |
C43 | C42 | C41 | H20 | 179.3° | 179.9° |
C44 | C45 | C49 | C48 | 0.1° | 0.0° |
C44 | C45 | C49 | N40 | 179.2° | 179.9° |
C44 | C45 | N40 | C41 | 0.4° | 0.9° |
C44 | C45 | C49 | N50 | 179.7° | 179.9° |
C44 | C45 | N40 | RU1 | 179.0° | 178.8° |
C45 | C44 | C43 | H22 | 180.0° | 179.9° |
C45 | C44 | C46 | H23 | 179.2° | 179.4° |
C42 | C41 | N40 | C45 | 0.2° | 0.6° |
C42 | C41 | N40 | H20 | 180.0° | 179.8° |
C42 | C41 | N40 | RU1 | 178.1° | 179.0° |
C41 | C42 | C43 | H22 | 179.4° | 179.8° |
C51 | C48 | C49 | C45 | 179.5° | 179.5° |
C48 | C51 | C52 | H1 | 180.0° | 179.8° |
C51 | C48 | C49 | N50 | 0.7° | 0.6° |
C48 | C51 | C52 | C53 | 0.7° | 0.4° |
C48 | C51 | C52 | H2 | 179.3° | 179.6° |
C51 | C48 | C47 | H24 | 0.0° | 0.7° |
C48 | C49 | C45 | N50 | 179.8° | 179.9° |
C48 | C49 | C45 | N40 | 179.3° | 179.9° |
C49 | C48 | C51 | C52 | 0.6° | 0.0° |
C48 | C49 | N50 | C53 | 0.9° | 0.8° |
C48 | C49 | N50 | RU1 | 179.2° | 178.8° |
C49 | C48 | C51 | H1 | 179.4° | 179.8° |
C49 | C48 | C47 | H24 | 179.2° | 179.3° |
C49 | C45 | N40 | C41 | 179.6° | 179.2° |
C49 | C45 | N40 | RU1 | 1.8° | 1.1° |
C45 | C49 | N50 | C53 | 179.3° | 179.3° |
C45 | C49 | N50 | RU1 | 1.0° | 1.1° |
C45 | N40 | C41 | RU1 | 178.3° | 179.7° |
N40 | C45 | C49 | N50 | 0.5° | 0.0° |
C45 | N40 | RU1 | N50 | 1.7° | 1.3° |
C45 | N40 | RU1 | N26 | 85.9° | 93.8° |
C45 | N40 | RU1 | N17 | 96.3° | 89.2° |
C45 | N40 | RU1 | N22 | 179.6° | 173.5° |
C45 | N40 | RU1 | N39 | 27.2° | 50.5° |
C45 | N40 | C41 | H20 | 179.8° | 179.6° |
C51 | C52 | C53 | H2 | 180.0° | 180.0° |
C51 | C52 | C53 | N50 | 0.8° | 0.3° |
C51 | C52 | C53 | H25 | 179.2° | 179.9° |
C41 | N40 | RU1 | N50 | 179.8° | 179.0° |
C41 | N40 | RU1 | N26 | 92.6° | 86.5° |
C41 | N40 | RU1 | N17 | 85.2° | 90.5° |
C41 | N40 | RU1 | N22 | 1.2° | 6.2° |
C41 | N40 | RU1 | N39 | 151.3° | 129.7° |
N40 | C41 | C42 | H21 | 179.3° | 179.9° |
C49 | N50 | RU1 | N40 | 1.5° | 1.2° |
C49 | N50 | C53 | C52 | 1.0° | 0.3° |
C49 | N50 | C53 | RU1 | 177.9° | 179.5° |
C49 | N50 | RU1 | N26 | 92.6° | 92.6° |
C49 | N50 | RU1 | N17 | 93.3° | 87.9° |
C49 | N50 | RU1 | N22 | 137.4° | 37.2° |
C49 | N50 | RU1 | N39 | 176.1° | 177.4° |
C49 | N50 | C53 | H25 | 179.0° | 179.5° |
N40 | RU1 | N26 | C27 | 4.3° | 4.2° |
N40 | RU1 | N50 | C53 | 179.6° | 179.2° |
N40 | RU1 | N50 | N26 | 94.1° | 91.3° |
N40 | RU1 | N50 | N17 | 91.8° | 89.1° |
N40 | RU1 | N50 | N22 | 135.9° | 38.4° |
N40 | RU1 | N50 | N39 | 177.6° | 176.2° |
N40 | RU1 | N26 | N17 | 160.3° | 104.3° |
N40 | RU1 | N26 | N22 | 98.8° | 89.1° |
N40 | RU1 | N26 | N39 | 175.8° | 176.5° |
N40 | RU1 | N26 | C30 | 174.4° | 175.8° |
N40 | RU1 | N17 | N22 | 98.3° | 89.1° |
N40 | RU1 | N17 | N39 | 175.9° | 176.7° |
N40 | RU1 | N22 | N39 | 177.7° | 176.5° |
N40 | RU1 | N17 | C16 | 81.0° | 99.0° |
N40 | RU1 | N17 | C18 | 103.6° | 79.2° |
N40 | RU1 | N22 | C23 | 89.3° | 99.0° |
N40 | RU1 | N22 | C19 | 97.1° | 79.5° |
N40 | RU1 | N39 | C38 | 57.1° | 42.7° |
N40 | RU1 | N39 | C37 | 119.3° | 137.1° |
RU1 | N40 | C41 | H20 | 1.9° | 0.7° |
C27 | C28 | C29 | H13 | 180.0° | 179.8° |
C28 | C27 | N26 | H12 | 180.0° | 179.8° |
C27 | C28 | C29 | C31 | 1.1° | 0.1° |
C28 | C27 | N26 | RU1 | 179.4° | 179.6° |
C28 | C27 | N26 | C30 | 0.8° | 0.3° |
C27 | C28 | C29 | H14 | 178.9° | 179.9° |
C29 | C28 | C27 | N26 | 1.1° | 0.0° |
C28 | C29 | C31 | H14 | 180.0° | 180.0° |
C28 | C29 | C31 | C30 | 0.7° | 0.2° |
C28 | C29 | C31 | C32 | 179.5° | 179.7° |
C29 | C28 | C27 | H12 | 178.9° | 179.8° |
C27 | N26 | RU1 | N50 | 86.9° | 88.5° |
C27 | N26 | RU1 | C30 | 178.7° | 180.0° |
C27 | N26 | RU1 | N17 | 156.0° | 100.2° |
C27 | N26 | RU1 | N22 | 94.5° | 85.0° |
C27 | N26 | RU1 | N39 | 180.0° | 179.3° |
C27 | N26 | C30 | C31 | 0.5° | 0.6° |
C27 | N26 | C30 | C38 | 179.3° | 179.4° |
N26 | C27 | C28 | H13 | 178.9° | 179.8° |
C52 | C53 | N50 | H25 | 180.0° | 179.8° |
C52 | C53 | N50 | RU1 | 178.9° | 179.2° |
C53 | C52 | C51 | H1 | 179.3° | 179.8° |
C53 | N50 | RU1 | N26 | 85.4° | 87.9° |
C53 | N50 | RU1 | N17 | 88.7° | 91.7° |
C53 | N50 | RU1 | N22 | 44.5° | 142.4° |
C53 | N50 | RU1 | N39 | 1.9° | 3.1° |
N50 | C53 | C52 | H2 | 179.2° | 179.7° |
N50 | RU1 | N26 | N17 | 117.0° | 171.3° |
N50 | RU1 | N26 | N22 | 178.5° | 173.5° |
N50 | RU1 | N26 | N39 | 93.1° | 92.2° |
N50 | RU1 | N26 | C30 | 91.7° | 91.4° |
N50 | RU1 | N17 | N22 | 178.7° | 173.4° |
N50 | RU1 | N17 | N39 | 92.9° | 92.4° |
N50 | RU1 | N22 | N39 | 46.6° | 145.3° |
N50 | RU1 | N17 | C16 | 2.0° | 14.7° |
N50 | RU1 | N17 | C18 | 173.4° | 163.5° |
N50 | RU1 | N22 | C23 | 135.0° | 137.2° |
N50 | RU1 | N22 | C19 | 38.6° | 41.3° |
N50 | RU1 | N39 | C38 | 85.8° | 91.7° |
N50 | RU1 | N39 | C37 | 90.7° | 88.1° |
RU1 | N50 | C53 | H25 | 1.2° | 1.0° |
C29 | C31 | C30 | N26 | 0.4° | 0.6° |
C29 | C31 | C30 | C32 | 179.8° | 179.9° |
C29 | C31 | C30 | C38 | 179.3° | 179.5° |
C29 | C31 | C32 | C33 | 179.3° | 179.5° |
C31 | C29 | C28 | H13 | 178.9° | 179.8° |
C29 | C31 | C32 | H15 | 0.7° | 0.5° |
N26 | RU1 | N17 | N22 | 62.0° | 15.3° |
N26 | RU1 | N17 | N39 | 23.8° | 78.9° |
N26 | RU1 | N22 | N39 | 83.3° | 84.9° |
N26 | RU1 | N17 | C16 | 118.7° | 156.6° |
N26 | RU1 | N17 | C18 | 56.7° | 25.2° |
RU1 | N26 | C30 | C31 | 179.3° | 179.3° |
RU1 | N26 | C30 | C38 | 0.5° | 0.6° |
N26 | RU1 | N22 | C23 | 5.0° | 7.4° |
N26 | RU1 | N22 | C19 | 168.6° | 171.1° |
N26 | RU1 | N39 | C38 | 2.0° | 0.7° |
N26 | RU1 | N39 | C37 | 178.4° | 179.5° |
RU1 | N26 | C27 | H12 | 0.6° | 0.2° |
C30 | N26 | RU1 | N17 | 25.3° | 79.9° |
C30 | N26 | RU1 | N22 | 86.8° | 95.1° |
C30 | N26 | RU1 | N39 | 1.4° | 0.7° |
N26 | C30 | C31 | C38 | 179.8° | 179.9° |
N26 | C30 | C31 | C32 | 179.7° | 179.3° |
N26 | C30 | C38 | N39 | 1.3° | 0.0° |
N26 | C30 | C38 | C34 | 179.4° | 179.8° |
C30 | N26 | C27 | H12 | 179.1° | 179.9° |
N17 | RU1 | N22 | N39 | 90.8° | 94.3° |
RU1 | N17 | C16 | C18 | 174.9° | 178.0° |
RU1 | N17 | C16 | C15 | 176.0° | 174.8° |
N17 | RU1 | N22 | C23 | 179.2° | 171.8° |
N17 | RU1 | N22 | C19 | 5.6° | 9.8° |
RU1 | N17 | C18 | C19 | 4.1° | 8.6° |
RU1 | N17 | C18 | C13 | 176.6° | 169.8° |
N17 | RU1 | N39 | C38 | 179.3° | 177.7° |
N17 | RU1 | N39 | C37 | 4.2° | 2.5° |
RU1 | N17 | C16 | H8 | 4.0° | 5.2° |
N22 | RU1 | N17 | C16 | 179.4° | 171.8° |
N22 | RU1 | N17 | C18 | 5.3° | 10.0° |
RU1 | N22 | C23 | C19 | 172.9° | 178.3° |
RU1 | N22 | C23 | C24 | 174.8° | 175.4° |
RU1 | N22 | C19 | C18 | 5.0° | 8.1° |
RU1 | N22 | C19 | C20 | 176.1° | 170.5° |
N22 | RU1 | N39 | C38 | 95.6° | 93.1° |
N22 | RU1 | N39 | C37 | 88.0° | 87.1° |
RU1 | N22 | C23 | H9 | 5.2° | 5.4° |
N39 | RU1 | N17 | C16 | 94.9° | 77.7° |
N39 | RU1 | N17 | C18 | 80.5° | 104.1° |
RU1 | N39 | C38 | C30 | 2.3° | 0.6° |
N39 | RU1 | N22 | C23 | 88.4° | 77.5° |
N39 | RU1 | N22 | C19 | 85.2° | 104.0° |
RU1 | N39 | C38 | C37 | 176.9° | 179.8° |
RU1 | N39 | C38 | C34 | 179.5° | 179.2° |
RU1 | N39 | C37 | C36 | 178.9° | 179.5° |
RU1 | N39 | C37 | H19 | 1.1° | 0.4° |
N17 | C16 | C15 | H8 | 180.0° | 179.9° |
N17 | C16 | C15 | C14 | 0.5° | 2.0° |
C16 | N17 | C18 | C19 | 179.9° | 173.0° |
C16 | N17 | C18 | C13 | 0.8° | 8.6° |
N17 | C16 | C15 | H4 | 179.5° | 178.5° |
C15 | C16 | N17 | C18 | 1.1° | 3.2° |
C16 | C15 | C14 | H4 | 180.0° | 179.4° |
C16 | C15 | C14 | C13 | 0.4° | 1.4° |
C16 | C15 | C14 | H3 | 179.7° | 177.4° |
N17 | C18 | C19 | N22 | 0.7° | 0.4° |
N17 | C18 | C19 | C13 | 179.3° | 178.3° |
N17 | C18 | C19 | C20 | 179.5° | 178.9° |
N17 | C18 | C13 | C14 | 0.1° | 9.0° |
N17 | C18 | C13 | C10 | 179.7° | 170.7° |
C18 | N17 | C16 | H8 | 178.9° | 176.8° |
C31 | C30 | C38 | N39 | 178.9° | 179.9° |
C31 | C30 | C38 | C34 | 0.8° | 0.1° |
C30 | C31 | C32 | C33 | 0.5° | 0.6° |
C30 | C31 | C29 | H14 | 179.3° | 179.8° |
C30 | C31 | C32 | H15 | 179.5° | 179.4° |
C32 | C31 | C30 | C38 | 0.5° | 0.6° |
C31 | C32 | C33 | H15 | 180.0° | 180.0° |
C31 | C32 | C33 | C34 | 0.8° | 0.1° |
C32 | C31 | C29 | H14 | 0.5° | 0.3° |
C31 | C32 | C33 | H16 | 179.2° | 180.0° |
C30 | C38 | N39 | C34 | 178.1° | 179.8° |
C30 | C38 | N39 | C37 | 179.2° | 179.5° |
C30 | C38 | C34 | C33 | 1.1° | 0.4° |
C30 | C38 | C34 | C35 | 179.7° | 179.5° |
N22 | C23 | C24 | H9 | 180.0° | 179.1° |
C23 | N22 | C19 | C18 | 179.0° | 173.2° |
C23 | N22 | C19 | C20 | 2.1° | 8.2° |
N22 | C23 | C24 | C25 | 0.5° | 2.5° |
N22 | C23 | C24 | H10 | 179.5° | 177.5° |
C19 | N22 | C23 | C24 | 1.8° | 2.8° |
N22 | C19 | C18 | C20 | 178.9° | 178.6° |
N22 | C19 | C18 | C13 | 178.6° | 178.0° |
N22 | C19 | C20 | C25 | 0.9° | 8.3° |
N22 | C19 | C20 | C11 | 178.7° | 170.5° |
C19 | N22 | C23 | H9 | 178.2° | 176.3° |
C15 | C14 | C13 | C18 | 0.6° | 3.9° |
C15 | C14 | C13 | H3 | 180.0° | 178.8° |
C15 | C14 | C13 | C10 | 179.8° | 175.8° |
C14 | C15 | C16 | H8 | 179.5° | 178.0° |
C23 | C24 | C25 | H10 | 180.0° | 180.0° |
C23 | C24 | C25 | C20 | 0.5° | 2.1° |
C23 | C24 | C25 | H11 | 179.5° | 178.3° |
C19 | C18 | C13 | C14 | 179.2° | 172.7° |
C19 | C18 | C13 | C10 | 0.4° | 7.6° |
C18 | C19 | C20 | C25 | 179.8° | 173.1° |
C18 | C19 | C20 | C11 | 0.1° | 8.1° |
C13 | C18 | C19 | C20 | 0.2° | 0.6° |
C18 | C13 | C14 | C10 | 179.6° | 179.6° |
C18 | C13 | C10 | C11 | 0.4° | 8.2° |
C18 | C13 | C10 | N09 | 180.0° | 169.8° |
C18 | C13 | C14 | H3 | 179.4° | 177.3° |
C19 | C20 | C25 | C24 | 0.3° | 3.1° |
C19 | C20 | C25 | C11 | 179.7° | 178.8° |
C19 | C20 | C11 | C10 | 0.2° | 7.2° |
C19 | C20 | C11 | N12 | 178.8° | 170.5° |
C19 | C20 | C25 | H11 | 179.7° | 176.5° |
C38 | N39 | C37 | C36 | 2.8° | 0.3° |
N39 | C38 | C34 | C33 | 179.2° | 179.4° |
N39 | C38 | C34 | C35 | 1.6° | 0.6° |
C38 | N39 | C37 | H19 | 177.2° | 179.8° |
C37 | N39 | C38 | C34 | 2.6° | 0.6° |
N39 | C37 | C36 | H19 | 180.0° | 179.8° |
N39 | C37 | C36 | C35 | 1.9° | 0.0° |
N39 | C37 | C36 | H18 | 178.1° | 180.0° |
C38 | C34 | C33 | C32 | 1.1° | 0.5° |
C38 | C34 | C33 | C35 | 179.2° | 180.0° |
C38 | C34 | C35 | C36 | 0.7° | 0.3° |
C38 | C34 | C33 | H16 | 178.9° | 179.5° |
C38 | C34 | C35 | H17 | 179.3° | 179.7° |
C32 | C33 | C34 | H16 | 180.0° | 180.0° |
C32 | C33 | C34 | C35 | 179.7° | 179.5° |
C24 | C25 | C20 | H11 | 180.0° | 179.7° |
C24 | C25 | C20 | C11 | 180.0° | 175.6° |
C25 | C24 | C23 | H9 | 179.5° | 178.4° |
C14 | C13 | C10 | C11 | 179.1° | 172.2° |
C14 | C13 | C10 | N09 | 0.4° | 9.9° |
C13 | C14 | C15 | H4 | 179.6° | 179.1° |
C13 | C10 | C11 | C20 | 0.3° | 0.8° |
C13 | C10 | C11 | N09 | 179.6° | 178.0° |
C13 | C10 | C11 | N12 | 179.0° | 178.6° |
C13 | C10 | N09 | C07 | 179.5° | 175.1° |
C10 | C13 | C14 | H3 | 0.2° | 3.1° |
C25 | C20 | C11 | C10 | 179.8° | 174.0° |
C25 | C20 | C11 | N12 | 1.5° | 8.3° |
C20 | C25 | C24 | H10 | 179.5° | 177.9° |
C20 | C11 | C10 | N12 | 178.6° | 177.7° |
C20 | C11 | C10 | N09 | 179.9° | 177.2° |
C20 | C11 | N12 | C08 | 179.6° | 174.5° |
C11 | C20 | C25 | H11 | 0.1° | 4.7° |
C11 | C10 | N09 | C07 | 0.9° | 2.9° |
C10 | C11 | N12 | C08 | 0.9° | 3.2° |
N09 | C10 | C11 | N12 | 1.5° | 0.6° |
C10 | N09 | C07 | C08 | 0.0° | 3.6° |
C10 | N09 | C07 | C06 | 179.0° | 175.3° |
C37 | C36 | C35 | C34 | 0.9° | 0.0° |
C37 | C36 | C35 | H18 | 180.0° | 179.9° |
C37 | C36 | C35 | H17 | 179.1° | 179.9° |
C33 | C34 | C35 | C36 | 179.9° | 179.7° |
C34 | C33 | C32 | H15 | 179.2° | 179.9° |
C33 | C34 | C35 | H17 | 0.1° | 0.3° |
C34 | C35 | C36 | H17 | 180.0° | 180.0° |
C35 | C34 | C33 | H16 | 0.3° | 0.5° |
C34 | C35 | C36 | H18 | 179.1° | 180.0° |
C11 | N12 | C08 | C07 | 0.1° | 2.5° |
C11 | N12 | C08 | C05 | 179.8° | 176.2° |
N09 | C07 | C08 | N12 | 0.6° | 0.9° |
N09 | C07 | C08 | C06 | 178.9° | 178.9° |
N09 | C07 | C08 | C05 | 179.7° | 179.7° |
N09 | C07 | C06 | C03 | 179.6° | 177.6° |
N09 | C07 | C06 | H7 | 0.4° | 1.5° |
N12 | C08 | C07 | C05 | 179.8° | 178.7° |
N12 | C08 | C07 | C06 | 179.5° | 178.0° |
N12 | C08 | C05 | C04 | 179.5° | 176.6° |
N12 | C08 | C05 | H6 | 0.5° | 2.8° |
C35 | C36 | C37 | H19 | 178.1° | 179.9° |
C08 | C07 | C06 | C03 | 0.6° | 1.3° |
C07 | C08 | C05 | C04 | 0.2° | 2.2° |
C07 | C08 | C05 | H6 | 179.8° | 178.5° |
C08 | C07 | C06 | H7 | 179.4° | 179.5° |
C06 | C07 | C08 | C05 | 0.8° | 0.7° |
C07 | C06 | C03 | H7 | 180.0° | 179.1° |
C07 | C06 | C03 | C04 | 0.5° | 2.0° |
C07 | C06 | C03 | C02 | 178.8° | 177.7° |
C08 | C05 | C04 | H6 | 180.0° | 179.4° |
C08 | C05 | C04 | C03 | 1.3° | 1.5° |
C08 | C05 | C04 | H5 | 178.7° | 178.2° |
C06 | C03 | C04 | C05 | 1.4° | 0.6° |
C06 | C03 | C04 | C02 | 178.3° | 179.7° |
C06 | C03 | C02 | N01 | 4.0° | 14.6° |
C06 | C03 | C04 | H5 | 178.6° | 179.6° |
C05 | C04 | C03 | H5 | 180.0° | 179.8° |
C05 | C04 | C03 | C02 | 179.7° | 179.1° |
C04 | C03 | C02 | N01 | 177.6° | 165.6° |
C03 | C04 | C05 | H6 | 178.7° | 179.1° |
C04 | C03 | C06 | H7 | 179.5° | 178.8° |
C02 | C03 | C04 | H5 | 0.3° | 0.6° |
C02 | C03 | C06 | H7 | 1.2° | 1.4° |
H1 | C51 | C52 | H2 | 0.7° | 0.2° |
H2 | C52 | C53 | H25 | 0.8° | 0.1° |
H3 | C14 | C15 | H4 | 0.3° | 2.0° |
H4 | C15 | C16 | H8 | 0.5° | 1.4° |
H5 | C04 | C05 | H6 | 1.2° | 1.1° |
H9 | C23 | C24 | H10 | 0.5° | 1.6° |
H10 | C24 | C25 | H11 | 0.5° | 1.7° |
H12 | C27 | C28 | H13 | 1.1° | 0.4° |
H13 | C28 | C29 | H14 | 1.1° | 0.2° |
H15 | C32 | C33 | H16 | 0.8° | 0.1° |
H17 | C35 | C36 | H18 | 0.9° | 0.0° |
H18 | C36 | C37 | H19 | 1.9° | 0.2° |
H20 | C41 | C42 | H21 | 0.6° | 0.1° |
H21 | C42 | C43 | H22 | 0.6° | 0.2° |
H23 | C46 | C47 | H24 | 1.1° | 0.1° |