JSD
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
RU | C11 | sing | 2.21Å | 2.21Å | |
RU | C12 | sing | 2.19Å | 2.19Å | |
RU | C13 | sing | 2.19Å | 2.19Å | |
RU | C14 | sing | 2.18Å | 2.18Å | |
RU | C15 | sing | 2.20Å | 2.20Å | |
RU | C16 | sing | 2.20Å | 2.20Å | |
RU | C17 | sing | 2.18Å | 2.18Å | |
RU | C18 | sing | 2.16Å | 2.16Å | |
RU | C19 | sing | 2.18Å | 2.18Å | |
RU | C20 | sing | 2.19Å | 2.19Å | |
C11 | C12 | sing | 1.39Å | 1.39Å | |
C11 | C15 | sing | 1.38Å | 1.38Å | |
C12 | C13 | sing | 1.38Å | 1.38Å | |
C13 | C14 | sing | 1.38Å | 1.38Å | |
C14 | C15 | sing | 1.37Å | 1.37Å | |
C16 | C17 | sing | 1.38Å | 1.38Å | |
C16 | C20 | sing | 1.39Å | 1.39Å | |
C17 | C18 | sing | 1.40Å | 1.40Å | |
C18 | C19 | sing | 1.40Å | 1.40Å | |
C18 | C24 | sing | 1.49Å | 1.49Å | |
C19 | C20 | sing | 1.39Å | 1.39Å | |
C24 | C25 | sing | 1.52Å | 1.52Å | |
C24 | O28 | doub | 1.22Å | 1.22Å | |
C25 | C26 | sing | 1.52Å | 1.52Å | |
C26 | C27 | sing | 1.52Å | 1.52Å | |
C27 | O29 | doub | 1.23Å | 1.23Å | |
C27 | N30 | sing | 1.33Å | 1.33Å | |
N30 | C31 | sing | 1.46Å | 1.46Å | |
C31 | C34 | sing | 1.56Å | 1.56Å | |
N33 | C34 | sing | 1.45Å | 1.45Å | |
N33 | C51 | sing | 1.44Å | 1.44Å | |
C34 | S49 | sing | 1.79Å | 1.79Å | |
S49 | C50 | sing | 1.78Å | 1.78Å | |
C50 | C51 | sing | 1.55Å | 1.55Å | |
C50 | C52 | sing | 1.54Å | 1.54Å | |
C50 | C53 | sing | 1.54Å | 1.54Å | |
C51 | C63 | sing | 1.48Å | 1.48Å | |
C63 | O64 | doub | 1.21Å | 1.21Å | |
C63 | O65 | sing | 1.30Å | 1.30Å | |
C25 | H10 | sing | 1.10Å | 1.10Å | |
C25 | H11 | sing | 1.10Å | 1.10Å | |
C26 | H12 | sing | 1.10Å | 1.10Å | |
C26 | H13 | sing | 1.10Å | 1.10Å | |
N30 | H14 | sing | 1.00Å | 1.00Å | |
C31 | H15 | sing | 1.10Å | 1.10Å | |
C31 | H16 | sing | 1.10Å | 1.10Å | |
N33 | H17 | sing | 1.00Å | 1.00Å | |
C34 | H19 | sing | 1.10Å | 1.10Å | |
C51 | H20 | sing | 1.10Å | 1.10Å | |
C52 | H21 | sing | 1.10Å | 1.10Å | |
C52 | H22 | sing | 1.10Å | 1.10Å | |
C52 | H23 | sing | 1.10Å | 1.10Å | |
C53 | H24 | sing | 1.10Å | 1.10Å | |
C53 | H25 | sing | 1.10Å | 1.10Å | |
C53 | H26 | sing | 1.10Å | 1.10Å | |
O65 | H27 | sing | 0.95Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C11 | RU | C12 | 36.8° | 36.8° |
C11 | RU | C13 | 61.3° | 61.3° |
C11 | RU | C14 | 61.5° | 61.5° |
C11 | RU | C15 | 36.6° | 36.6° |
C11 | RU | C16 | 112.8° | 112.8° |
C11 | RU | C17 | 120.9° | 120.9° |
C11 | RU | C18 | 151.4° | 151.4° |
C11 | RU | C19 | 168.5° | 168.5° |
C11 | RU | C20 | 132.5° | 132.5° |
RU | C11 | C12 | 70.9° | 70.9° |
RU | C11 | C15 | 71.3° | 71.3° |
C12 | RU | C13 | 36.9° | 36.9° |
C12 | RU | C14 | 61.8° | 61.8° |
C12 | RU | C15 | 61.2° | 61.2° |
C12 | RU | C16 | 121.5° | 121.5° |
C12 | RU | C17 | 150.4° | 150.4° |
C12 | RU | C18 | 171.1° | 171.1° |
C12 | RU | C19 | 135.3° | 135.3° |
C12 | RU | C20 | 115.4° | 115.4° |
RU | C12 | C11 | 72.4° | 72.4° |
RU | C12 | C13 | 71.5° | 71.5° |
C13 | RU | C14 | 37.0° | 37.0° |
C13 | RU | C15 | 61.0° | 61.0° |
C13 | RU | C16 | 152.8° | 152.8° |
C13 | RU | C17 | 170.3° | 170.3° |
C13 | RU | C18 | 136.2° | 136.2° |
C13 | RU | C19 | 118.0° | 118.0° |
C13 | RU | C20 | 125.2° | 125.2° |
RU | C13 | C12 | 71.6° | 71.6° |
RU | C13 | C14 | 71.2° | 71.2° |
C14 | RU | C15 | 36.6° | 36.6° |
C14 | RU | C16 | 167.1° | 167.1° |
C14 | RU | C17 | 134.1° | 134.1° |
C14 | RU | C18 | 116.3° | 116.3° |
C14 | RU | C19 | 125.8° | 125.8° |
C14 | RU | C20 | 155.6° | 155.6° |
RU | C14 | C13 | 71.9° | 71.9° |
RU | C14 | C15 | 72.5° | 72.5° |
C15 | RU | C16 | 131.9° | 131.9° |
C15 | RU | C17 | 114.3° | 114.3° |
C15 | RU | C18 | 123.2° | 123.2° |
C15 | RU | C19 | 154.6° | 154.6° |
C15 | RU | C20 | 166.6° | 166.6° |
RU | C15 | C11 | 72.1° | 72.1° |
RU | C15 | C14 | 70.9° | 70.9° |
C16 | RU | C17 | 36.8° | 36.8° |
C16 | RU | C18 | 62.5° | 62.5° |
C16 | RU | C19 | 62.0° | 62.0° |
C16 | RU | C20 | 36.9° | 36.9° |
RU | C16 | C17 | 70.8° | 70.8° |
RU | C16 | C20 | 71.3° | 71.3° |
C17 | RU | C18 | 37.5° | 37.5° |
C17 | RU | C19 | 62.0° | 62.0° |
C17 | RU | C20 | 61.4° | 61.4° |
RU | C17 | C16 | 72.4° | 72.4° |
RU | C17 | C18 | 70.7° | 70.7° |
C18 | RU | C19 | 37.5° | 37.5° |
C18 | RU | C20 | 62.3° | 62.3° |
RU | C18 | C17 | 71.8° | 71.8° |
RU | C18 | C19 | 72.1° | 72.1° |
RU | C18 | C24 | 116.8° | 116.8° |
C19 | RU | C20 | 37.1° | 37.1° |
RU | C19 | C18 | 70.4° | 70.4° |
RU | C19 | C20 | 71.8° | 71.8° |
RU | C20 | C16 | 71.8° | 71.8° |
RU | C20 | C19 | 71.2° | 71.2° |
C12 | C11 | C15 | 107.4° | 107.4° |
C11 | C12 | C13 | 107.9° | 107.9° |
C11 | C15 | C14 | 108.7° | 108.7° |
C12 | C13 | C14 | 108.2° | 108.2° |
C13 | C14 | C15 | 107.7° | 107.7° |
C17 | C16 | C20 | 107.4° | 107.4° |
C16 | C17 | C18 | 109.1° | 109.1° |
C16 | C20 | C19 | 108.7° | 108.7° |
C17 | C18 | C19 | 107.0° | 107.0° |
C17 | C18 | C24 | 125.7° | 125.7° |
C19 | C18 | C24 | 126.9° | 126.9° |
C18 | C19 | C20 | 107.7° | 107.7° |
C18 | C24 | C25 | 117.6° | 117.6° |
C18 | C24 | O28 | 119.3° | 119.3° |
C25 | C24 | O28 | 122.4° | 122.4° |
C24 | C25 | C26 | 112.7° | 112.7° |
C24 | C25 | H10 | 108.7° | 108.7° |
C24 | C25 | H11 | 108.7° | 108.7° |
C25 | C26 | C27 | 111.6° | 111.6° |
C26 | C25 | H10 | 108.7° | 108.7° |
C26 | C25 | H11 | 108.6° | 108.6° |
C25 | C26 | H12 | 108.9° | 108.9° |
C25 | C26 | H13 | 108.9° | 108.9° |
C26 | C27 | O29 | 120.1° | 120.1° |
C26 | C27 | N30 | 118.0° | 118.0° |
C27 | C26 | H12 | 108.9° | 108.9° |
C27 | C26 | H13 | 109.0° | 109.0° |
O29 | C27 | N30 | 121.7° | 121.7° |
C27 | N30 | C31 | 120.6° | 120.6° |
C27 | N30 | H14 | 119.7° | 119.7° |
N30 | C31 | C34 | 112.6° | 112.6° |
C31 | N30 | H14 | 119.7° | 119.7° |
N30 | C31 | H15 | 108.7° | 108.7° |
N30 | C31 | H16 | 108.7° | 108.7° |
C31 | C34 | N33 | 112.0° | 112.0° |
C31 | C34 | S49 | 108.9° | 108.9° |
C34 | C31 | H15 | 108.7° | 108.7° |
C34 | C31 | H16 | 108.7° | 108.7° |
C31 | C34 | H19 | 109.7° | 109.7° |
C34 | N33 | C51 | 113.9° | 113.9° |
N33 | C34 | S49 | 107.9° | 107.9° |
C34 | N33 | H17 | 108.4° | 108.4° |
N33 | C34 | H19 | 111.1° | 111.1° |
N33 | C51 | C50 | 106.5° | 106.5° |
N33 | C51 | C63 | 110.3° | 110.3° |
C51 | N33 | H17 | 108.4° | 108.4° |
N33 | C51 | H20 | 110.0° | 109.9° |
C34 | S49 | C50 | 91.8° | 91.8° |
S49 | C34 | H19 | 107.1° | 107.1° |
S49 | C50 | C51 | 103.2° | 103.2° |
S49 | C50 | C52 | 111.2° | 111.2° |
S49 | C50 | C53 | 110.1° | 110.1° |
C51 | C50 | C52 | 112.8° | 112.8° |
C51 | C50 | C53 | 108.1° | 108.1° |
C50 | C51 | C63 | 112.0° | 112.0° |
C50 | C51 | H20 | 108.5° | 108.5° |
C52 | C50 | C53 | 111.2° | 111.2° |
C50 | C52 | H21 | 109.5° | 109.5° |
C50 | C52 | H22 | 109.5° | 109.5° |
C50 | C52 | H23 | 109.5° | 109.5° |
C50 | C53 | H24 | 109.5° | 109.5° |
C50 | C53 | H25 | 109.4° | 109.4° |
C50 | C53 | H26 | 109.5° | 109.5° |
C51 | C63 | O64 | 122.8° | 122.8° |
C51 | C63 | O65 | 115.8° | 115.8° |
C63 | C51 | H20 | 109.4° | 109.5° |
O64 | C63 | O65 | 121.3° | 121.3° |
C63 | O65 | H27 | 109.5° | 109.5° |
H10 | C25 | H11 | 109.5° | 109.5° |
H12 | C26 | H13 | 109.5° | 109.5° |
H15 | C31 | H16 | 109.5° | 109.5° |
H21 | C52 | H22 | 109.5° | 109.5° |
H21 | C52 | H23 | 109.5° | 109.5° |
H22 | C52 | H23 | 109.5° | 109.5° |
H24 | C53 | H25 | 109.5° | 109.5° |
H24 | C53 | H26 | 109.5° | 109.5° |
H25 | C53 | H26 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C11 | RU | C12 | C13 | 116.5° | 116.5° |
C11 | RU | C12 | C14 | 79.2° | 79.2° |
C11 | RU | C12 | C15 | 37.4° | 37.4° |
C11 | RU | C12 | C16 | 86.4° | 86.4° |
C11 | RU | C12 | C17 | 51.7° | 51.7° |
C11 | RU | C12 | C18 | 159.3° | 159.3° |
C11 | RU | C12 | C19 | 167.1° | 167.1° |
C11 | RU | C12 | C20 | 128.0° | 128.0° |
C11 | RU | C13 | C14 | 79.8° | 79.8° |
C11 | RU | C13 | C15 | 42.0° | 42.0° |
C11 | RU | C13 | C16 | 84.2° | 84.2° |
C11 | RU | C13 | C17 | 105.4° | 105.4° |
C11 | RU | C13 | C18 | 151.1° | 151.1° |
C11 | RU | C13 | C19 | 166.9° | 166.9° |
C11 | RU | C13 | C20 | 123.8° | 123.8° |
C11 | RU | C14 | C15 | 36.8° | 36.8° |
C11 | RU | C14 | C16 | 66.3° | 66.3° |
C11 | RU | C14 | C17 | 106.7° | 106.7° |
C11 | RU | C14 | C18 | 147.8° | 147.8° |
C11 | RU | C14 | C19 | 169.4° | 169.4° |
C11 | RU | C14 | C20 | 131.6° | 131.6° |
C11 | RU | C15 | C16 | 70.5° | 70.5° |
C11 | RU | C15 | C17 | 109.7° | 109.7° |
C11 | RU | C15 | C18 | 151.5° | 151.5° |
C11 | RU | C15 | C19 | 174.8° | 174.8° |
C11 | RU | C15 | C20 | 41.2° | 41.2° |
C11 | RU | C16 | C17 | 111.6° | 111.6° |
C11 | RU | C16 | C18 | 148.8° | 148.8° |
C11 | RU | C16 | C19 | 168.6° | 168.6° |
C11 | RU | C16 | C20 | 131.5° | 131.5° |
C11 | RU | C17 | C18 | 154.3° | 154.3° |
C11 | RU | C17 | C19 | 167.2° | 167.2° |
C11 | RU | C17 | C20 | 124.9° | 124.9° |
C11 | RU | C18 | C19 | 166.5° | 166.5° |
C11 | RU | C18 | C20 | 129.3° | 129.3° |
C11 | RU | C19 | C20 | 28.8° | 28.8° |
C11 | RU | C18 | C24 | 70.5° | 70.5° |
C12 | RU | C13 | C14 | 117.5° | 117.5° |
C12 | RU | C13 | C15 | 79.7° | 79.7° |
C12 | RU | C13 | C16 | 46.5° | 46.5° |
C12 | RU | C13 | C17 | 143.1° | 143.1° |
C12 | RU | C13 | C18 | 171.3° | 171.3° |
C12 | RU | C13 | C19 | 129.2° | 129.2° |
C12 | RU | C13 | C20 | 86.2° | 86.2° |
C12 | RU | C14 | C15 | 78.8° | 78.8° |
C12 | RU | C14 | C16 | 108.3° | 108.3° |
C12 | RU | C14 | C17 | 148.7° | 148.7° |
C12 | RU | C14 | C18 | 170.2° | 170.2° |
C12 | RU | C14 | C19 | 127.4° | 127.4° |
C12 | RU | C14 | C20 | 89.6° | 89.6° |
C12 | RU | C15 | C16 | 108.0° | 108.0° |
C12 | RU | C15 | C17 | 147.2° | 147.2° |
C12 | RU | C15 | C18 | 171.0° | 171.0° |
C12 | RU | C15 | C19 | 137.3° | 137.3° |
C12 | RU | C15 | C20 | 78.7° | 78.7° |
C12 | RU | C16 | C17 | 152.0° | 152.0° |
C12 | RU | C16 | C18 | 170.8° | 170.8° |
C12 | RU | C16 | C19 | 128.2° | 128.2° |
C12 | RU | C16 | C20 | 91.1° | 91.1° |
C12 | RU | C17 | C18 | 172.5° | 172.5° |
C12 | RU | C17 | C19 | 134.0° | 134.0° |
C12 | RU | C17 | C20 | 91.7° | 91.7° |
C12 | RU | C18 | C19 | 39.8° | 39.8° |
C12 | RU | C18 | C20 | 77.0° | 77.0° |
C12 | RU | C19 | C20 | 70.9° | 70.9° |
C12 | RU | C18 | C24 | 83.2° | 83.2° |
C13 | RU | C14 | C15 | 116.0° | 116.0° |
C13 | RU | C14 | C16 | 145.5° | 145.5° |
C13 | RU | C14 | C17 | 174.2° | 174.2° |
C13 | RU | C14 | C18 | 133.0° | 133.0° |
C13 | RU | C14 | C19 | 90.3° | 90.3° |
C13 | RU | C14 | C20 | 52.5° | 52.5° |
C13 | RU | C15 | C16 | 150.3° | 150.3° |
C13 | RU | C15 | C17 | 170.5° | 170.5° |
C13 | RU | C15 | C18 | 128.6° | 128.6° |
C13 | RU | C15 | C19 | 94.9° | 94.9° |
C13 | RU | C15 | C20 | 121.0° | 121.0° |
C13 | RU | C16 | C17 | 177.3° | 177.3° |
C13 | RU | C16 | C18 | 140.2° | 140.2° |
C13 | RU | C16 | C19 | 97.5° | 97.5° |
C13 | RU | C16 | C20 | 60.4° | 60.4° |
C13 | RU | C17 | C18 | 54.3° | 54.3° |
C13 | RU | C17 | C19 | 92.9° | 92.9° |
C13 | RU | C17 | C20 | 135.2° | 135.2° |
C13 | RU | C18 | C19 | 75.9° | 75.9° |
C13 | RU | C18 | C20 | 113.1° | 113.1° |
C13 | RU | C19 | C20 | 112.2° | 112.2° |
C13 | RU | C18 | C24 | 47.1° | 47.1° |
C14 | RU | C15 | C16 | 171.5° | 171.5° |
C14 | RU | C15 | C17 | 132.3° | 132.3° |
C14 | RU | C15 | C18 | 90.5° | 90.5° |
C14 | RU | C15 | C19 | 56.8° | 56.8° |
C14 | RU | C15 | C20 | 159.2° | 159.2° |
C14 | RU | C16 | C17 | 50.8° | 50.8° |
C14 | RU | C16 | C18 | 88.0° | 88.0° |
C14 | RU | C16 | C19 | 130.6° | 130.6° |
C14 | RU | C16 | C20 | 167.7° | 167.7° |
C14 | RU | C17 | C18 | 75.6° | 75.6° |
C14 | RU | C17 | C19 | 114.1° | 114.1° |
C14 | RU | C17 | C20 | 156.4° | 156.4° |
C14 | RU | C18 | C19 | 115.4° | 115.4° |
C14 | RU | C18 | C20 | 152.6° | 152.6° |
C14 | RU | C19 | C20 | 155.1° | 155.1° |
C14 | RU | C18 | C24 | 7.6° | 7.6° |
C15 | RU | C16 | C17 | 74.0° | 74.0° |
C15 | RU | C16 | C18 | 111.2° | 111.2° |
C15 | RU | C16 | C19 | 153.9° | 153.9° |
C15 | RU | C16 | C20 | 169.1° | 169.1° |
C15 | RU | C17 | C18 | 113.4° | 113.4° |
C15 | RU | C17 | C19 | 152.0° | 152.0° |
C15 | RU | C17 | C20 | 165.7° | 165.7° |
C15 | RU | C18 | C19 | 157.0° | 157.0° |
C15 | RU | C18 | C20 | 165.7° | 165.7° |
C15 | RU | C19 | C20 | 166.9° | 166.9° |
C15 | RU | C18 | C24 | 34.1° | 34.1° |
C16 | RU | C17 | C18 | 118.4° | 118.4° |
C16 | RU | C17 | C19 | 79.8° | 79.8° |
C16 | RU | C17 | C20 | 37.5° | 37.5° |
C16 | RU | C18 | C19 | 79.0° | 79.0° |
C16 | RU | C18 | C20 | 41.8° | 41.8° |
C16 | RU | C19 | C20 | 36.9° | 36.9° |
C16 | RU | C18 | C24 | 158.0° | 158.0° |
C17 | RU | C18 | C19 | 115.5° | 115.5° |
C17 | RU | C18 | C20 | 78.3° | 78.3° |
C17 | RU | C19 | C20 | 78.8° | 78.8° |
C17 | RU | C18 | C24 | 121.5° | 121.5° |
C18 | RU | C19 | C20 | 117.2° | 117.2° |
RU | C18 | C19 | C24 | 110.5° | 110.5° |
RU | C18 | C24 | C25 | 81.2° | 81.2° |
RU | C18 | C24 | O28 | 107.9° | 107.9° |
C20 | RU | C18 | C24 | 160.2° | 160.2° |
C11 | C12 | C13 | C14 | 1.5° | 1.5° |
C12 | C11 | C15 | C14 | 0.3° | 0.3° |
C15 | C11 | C12 | C13 | 0.8° | 0.8° |
C11 | C15 | C14 | C13 | 1.2° | 1.2° |
C12 | C13 | C14 | C15 | 1.7° | 1.7° |
C16 | C17 | C18 | C19 | 1.3° | 1.3° |
C16 | C17 | C18 | C24 | 173.1° | 173.1° |
C17 | C16 | C20 | C19 | 0.1° | 0.1° |
C20 | C16 | C17 | C18 | 0.7° | 0.7° |
C16 | C20 | C19 | C18 | 0.9° | 0.9° |
C17 | C18 | C19 | C24 | 174.2° | 174.2° |
C17 | C18 | C19 | C20 | 1.3° | 1.3° |
C17 | C18 | C24 | C25 | 5.0° | 5.0° |
C17 | C18 | C24 | O28 | 165.9° | 165.9° |
C19 | C18 | C24 | C25 | 168.2° | 168.2° |
C19 | C18 | C24 | O28 | 20.9° | 20.9° |
C24 | C18 | C19 | C20 | 172.9° | 172.9° |
C18 | C24 | C25 | O28 | 170.6° | 170.6° |
C18 | C24 | C25 | C26 | 150.9° | 150.9° |
C18 | C24 | C25 | H10 | 30.4° | 30.4° |
C18 | C24 | C25 | H11 | 88.6° | 88.6° |
C24 | C25 | C26 | H10 | 120.5° | 120.5° |
C24 | C25 | C26 | H11 | 120.5° | 120.5° |
C24 | C25 | C26 | C27 | 177.1° | 177.1° |
C24 | C25 | H10 | H11 | 118.6° | 118.6° |
C24 | C25 | C26 | H12 | 56.8° | 56.8° |
C24 | C25 | C26 | H13 | 62.5° | 62.5° |
O28 | C24 | C25 | C26 | 19.6° | 19.6° |
O28 | C24 | C25 | H10 | 140.1° | 140.1° |
O28 | C24 | C25 | H11 | 100.8° | 100.8° |
C25 | C26 | C27 | H12 | 120.3° | 120.3° |
C25 | C26 | C27 | H13 | 120.3° | 120.3° |
C25 | C26 | C27 | O29 | 0.1° | 0.1° |
C25 | C26 | C27 | N30 | 175.3° | 175.3° |
C26 | C25 | H10 | H11 | 118.5° | 118.5° |
C25 | C26 | H12 | H13 | 119.0° | 119.0° |
C26 | C27 | O29 | N30 | 175.3° | 175.3° |
C26 | C27 | N30 | C31 | 179.7° | 179.7° |
C27 | C26 | C25 | H10 | 62.4° | 62.4° |
C27 | C26 | C25 | H11 | 56.6° | 56.6° |
C27 | C26 | H12 | H13 | 119.1° | 119.1° |
C26 | C27 | N30 | H14 | 0.3° | 0.3° |
O29 | C27 | N30 | C31 | 4.3° | 4.3° |
O29 | C27 | C26 | H12 | 120.4° | 120.4° |
O29 | C27 | C26 | H13 | 120.2° | 120.2° |
O29 | C27 | N30 | H14 | 175.7° | 175.7° |
C27 | N30 | C31 | H14 | 180.0° | 180.0° |
C27 | N30 | C31 | C34 | 180.0° | 180.0° |
N30 | C27 | C26 | H12 | 55.0° | 55.0° |
N30 | C27 | C26 | H13 | 64.4° | 64.4° |
C27 | N30 | C31 | H15 | 59.6° | 59.6° |
C27 | N30 | C31 | H16 | 59.5° | 59.5° |
N30 | C31 | C34 | H15 | 120.4° | 120.4° |
N30 | C31 | C34 | H16 | 120.5° | 120.5° |
N30 | C31 | C34 | N33 | 57.8° | 57.8° |
N30 | C31 | C34 | S49 | 61.4° | 61.4° |
N30 | C31 | H15 | H16 | 118.6° | 118.6° |
N30 | C31 | C34 | H19 | 178.3° | 178.3° |
C31 | C34 | N33 | S49 | 119.8° | 119.8° |
C31 | C34 | N33 | H19 | 123.1° | 123.1° |
C31 | C34 | N33 | C51 | 118.6° | 118.6° |
C31 | C34 | S49 | H19 | 118.5° | 118.5° |
C31 | C34 | S49 | C50 | 142.9° | 142.9° |
C34 | C31 | N30 | H14 | 0.0° | 0.0° |
C34 | C31 | H15 | H16 | 118.6° | 118.6° |
C31 | C34 | N33 | H17 | 2.1° | 2.1° |
C34 | N33 | C51 | H17 | 120.7° | 120.7° |
N33 | C34 | S49 | H19 | 119.7° | 119.7° |
N33 | C34 | S49 | C50 | 21.2° | 21.2° |
C34 | N33 | C51 | C50 | 27.8° | 27.8° |
C34 | N33 | C51 | C63 | 149.6° | 149.6° |
N33 | C34 | C31 | H15 | 62.6° | 62.6° |
N33 | C34 | C31 | H16 | 178.3° | 178.3° |
C34 | N33 | C51 | H20 | 89.6° | 89.6° |
C51 | N33 | C34 | S49 | 1.3° | 1.3° |
N33 | C51 | C50 | S49 | 41.2° | 41.2° |
N33 | C51 | C50 | C63 | 120.7° | 120.7° |
N33 | C51 | C50 | H20 | 118.4° | 118.3° |
N33 | C51 | C50 | C52 | 78.9° | 78.9° |
N33 | C51 | C50 | C53 | 157.8° | 157.8° |
N33 | C51 | C63 | H20 | 121.1° | 121.1° |
N33 | C51 | C63 | O64 | 27.2° | 27.2° |
N33 | C51 | C63 | O65 | 148.9° | 148.9° |
C51 | N33 | C34 | H19 | 118.4° | 118.4° |
C34 | S49 | C50 | C51 | 35.4° | 35.4° |
C34 | S49 | C50 | C52 | 85.8° | 85.8° |
C34 | S49 | C50 | C53 | 150.6° | 150.6° |
S49 | C34 | C31 | H15 | 178.1° | 178.1° |
S49 | C34 | C31 | H16 | 59.0° | 59.0° |
S49 | C34 | N33 | H17 | 121.9° | 121.9° |
S49 | C50 | C51 | C52 | 120.1° | 120.1° |
S49 | C50 | C51 | C53 | 116.6° | 116.6° |
S49 | C50 | C52 | C53 | 123.0° | 123.0° |
S49 | C50 | C51 | C63 | 161.9° | 161.9° |
C50 | S49 | C34 | H19 | 98.6° | 98.6° |
S49 | C50 | C51 | H20 | 77.2° | 77.1° |
S49 | C50 | C52 | H21 | 180.0° | 180.0° |
S49 | C50 | C52 | H22 | 60.0° | 60.0° |
S49 | C50 | C52 | H23 | 60.0° | 60.0° |
S49 | C50 | C53 | H24 | 180.0° | 180.0° |
S49 | C50 | C53 | H25 | 60.0° | 60.0° |
S49 | C50 | C53 | H26 | 60.0° | 60.0° |
C51 | C50 | C52 | C53 | 121.6° | 121.6° |
C50 | C51 | C63 | H20 | 120.4° | 120.4° |
C50 | C51 | C63 | O64 | 91.3° | 91.3° |
C50 | C51 | C63 | O65 | 92.6° | 92.6° |
C50 | C51 | N33 | H17 | 148.5° | 148.5° |
C51 | C50 | C52 | H21 | 64.7° | 64.7° |
C51 | C50 | C52 | H22 | 55.3° | 55.3° |
C51 | C50 | C52 | H23 | 175.3° | 175.3° |
C51 | C50 | C53 | H24 | 68.0° | 68.0° |
C51 | C50 | C53 | H25 | 172.0° | 172.0° |
C51 | C50 | C53 | H26 | 52.0° | 52.0° |
C52 | C50 | C51 | C63 | 41.8° | 41.8° |
C52 | C50 | C51 | H20 | 162.8° | 162.8° |
C50 | C52 | H21 | H22 | 120.0° | 120.0° |
C50 | C52 | H21 | H23 | 120.0° | 120.0° |
C50 | C52 | H22 | H23 | 120.0° | 120.0° |
C52 | C50 | C53 | H24 | 56.3° | 56.3° |
C52 | C50 | C53 | H25 | 63.7° | 63.7° |
C52 | C50 | C53 | H26 | 176.3° | 176.3° |
C53 | C50 | C51 | C63 | 81.6° | 81.6° |
C53 | C50 | C51 | H20 | 39.4° | 39.4° |
C53 | C50 | C52 | H21 | 57.0° | 57.0° |
C53 | C50 | C52 | H22 | 177.0° | 177.0° |
C53 | C50 | C52 | H23 | 63.0° | 63.0° |
C50 | C53 | H24 | H25 | 120.0° | 120.0° |
C50 | C53 | H24 | H26 | 120.0° | 120.0° |
C50 | C53 | H25 | H26 | 120.0° | 120.0° |
C51 | C63 | O64 | O65 | 175.9° | 175.9° |
C63 | C51 | N33 | H17 | 89.8° | 89.8° |
C51 | C63 | O65 | H27 | 176.1° | 176.1° |
O64 | C63 | C51 | H20 | 148.3° | 148.3° |
O64 | C63 | O65 | H27 | 0.0° | 0.0° |
O65 | C63 | C51 | H20 | 27.8° | 27.8° |
H10 | C25 | C26 | H12 | 177.3° | 177.3° |
H10 | C25 | C26 | H13 | 58.0° | 58.0° |
H11 | C25 | C26 | H12 | 63.7° | 63.7° |
H11 | C25 | C26 | H13 | 177.0° | 177.0° |
H14 | N30 | C31 | H15 | 120.4° | 120.4° |
H14 | N30 | C31 | H16 | 120.5° | 120.5° |
H15 | C31 | C34 | H19 | 61.3° | 61.3° |
H16 | C31 | C34 | H19 | 57.8° | 57.8° |
H17 | N33 | C34 | H19 | 121.0° | 121.0° |
H17 | N33 | C51 | H20 | 31.0° | 31.1° |
H21 | C52 | H22 | H23 | 120.0° | 120.0° |
H24 | C53 | H25 | H26 | 120.0° | 120.0° |