KYH
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N31 | C29 | doub | 1.30Å | 1.31Å | |
N30 | C29 | sing | 1.37Å | 1.33Å | |
C29 | N28 | sing | 1.37Å | 1.37Å | |
N28 | C27 | sing | 1.47Å | 1.50Å | |
C27 | C26 | sing | 1.53Å | 1.56Å | |
C26 | C25 | sing | 1.53Å | 1.54Å | |
C25 | C24 | sing | 1.53Å | 1.56Å | |
C24 | N19 | sing | 1.47Å | 1.48Å | |
N19 | C18 | sing | 1.47Å | 1.51Å | |
N19 | C20 | sing | 1.47Å | 1.49Å | |
C18 | C17 | sing | 1.53Å | 1.43Å | |
C20 | C21 | sing | 1.53Å | 1.56Å | |
C21 | C22 | sing | 1.53Å | 1.56Å | |
N23 | C22 | sing | 1.47Å | 1.50Å | |
C15 | N14 | doub | 1.30Å | 1.38Å | Aromatic |
C15 | N06 | sing | 1.36Å | 1.33Å | Aromatic |
C17 | O16 | sing | 1.44Å | 1.50Å | |
C17 | C02 | sing | 1.54Å | 1.57Å | |
N14 | C13 | sing | 1.35Å | 1.37Å | Aromatic |
O16 | C05 | sing | 1.44Å | 1.29Å | |
C02 | C03 | sing | 1.55Å | 1.25Å | |
C02 | O01 | sing | 1.43Å | 1.52Å | |
C03 | C05 | sing | 1.55Å | 1.65Å | |
C03 | O04 | sing | 1.43Å | 1.50Å | |
N06 | C05 | sing | 1.46Å | 1.45Å | |
N06 | C07 | sing | 1.37Å | 1.39Å | Aromatic |
C13 | C07 | doub | 1.41Å | 1.37Å | Aromatic |
C13 | C11 | sing | 1.40Å | 1.45Å | Aromatic |
N12 | C11 | sing | 1.38Å | 1.48Å | |
C07 | N08 | sing | 1.33Å | 1.38Å | Aromatic |
C11 | N10 | doub | 1.33Å | 1.33Å | Aromatic |
N08 | C09 | doub | 1.32Å | 1.34Å | Aromatic |
N10 | C09 | sing | 1.32Å | 1.35Å | Aromatic |
C17 | H1 | sing | 1.09Å | 1.10Å | |
C15 | H2 | sing | 1.08Å | 1.08Å | |
C22 | H3 | sing | 1.09Å | 1.10Å | |
C22 | H4 | sing | 1.09Å | 1.10Å | |
C20 | H5 | sing | 1.09Å | 1.10Å | |
C20 | H6 | sing | 1.09Å | 1.10Å | |
C21 | H7 | sing | 1.09Å | 1.10Å | |
C21 | H8 | sing | 1.09Å | 1.10Å | |
C24 | H9 | sing | 1.09Å | 1.10Å | |
C24 | H10 | sing | 1.09Å | 1.10Å | |
C25 | H11 | sing | 1.09Å | 1.10Å | |
C25 | H12 | sing | 1.09Å | 1.10Å | |
C27 | H13 | sing | 1.09Å | 1.10Å | |
C27 | H14 | sing | 1.09Å | 1.10Å | |
N28 | H15 | sing | 0.97Å | 1.00Å | |
C02 | H16 | sing | 1.09Å | 1.10Å | |
C03 | H17 | sing | 1.09Å | 1.10Å | |
C05 | H18 | sing | 1.09Å | 1.10Å | |
C09 | H19 | sing | 1.08Å | 1.08Å | |
C18 | H20 | sing | 1.09Å | 1.10Å | |
C18 | H21 | sing | 1.09Å | 1.10Å | |
C26 | H22 | sing | 1.09Å | 1.10Å | |
C26 | H23 | sing | 1.09Å | 1.10Å | |
N12 | H24 | sing | 0.97Å | 1.00Å | |
N12 | H25 | sing | 0.97Å | 1.00Å | |
N23 | H27 | sing | 1.01Å | 1.00Å | |
N23 | H28 | sing | 1.01Å | 1.00Å | |
N30 | H30 | sing | 0.97Å | 1.00Å | |
N30 | H31 | sing | 0.97Å | 1.00Å | |
N31 | H32 | sing | 0.97Å | 1.00Å | |
O01 | H33 | sing | 0.97Å | 0.95Å | |
O04 | H34 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N31 | C29 | N30 | 118.0° | 120.0° |
N31 | C29 | N28 | 119.8° | 120.0° |
C29 | N31 | H32 | 112.0° | 120.0° |
N30 | C29 | N28 | 122.2° | 120.0° |
C29 | N30 | H30 | 120.0° | 120.0° |
C29 | N30 | H31 | 120.0° | 120.0° |
C29 | N28 | C27 | 123.1° | 120.0° |
C29 | N28 | H15 | 118.4° | 120.0° |
N28 | C27 | C26 | 114.9° | 109.5° |
N28 | C27 | H13 | 108.1° | 109.4° |
N28 | C27 | H14 | 108.1° | 109.5° |
C27 | N28 | H15 | 118.5° | 120.0° |
C27 | C26 | C25 | 112.1° | 109.4° |
C26 | C27 | H13 | 108.1° | 109.4° |
C26 | C27 | H14 | 108.1° | 109.5° |
C27 | C26 | H22 | 108.8° | 109.5° |
C27 | C26 | H23 | 108.8° | 109.5° |
C26 | C25 | C24 | 109.4° | 109.5° |
C26 | C25 | H11 | 109.5° | 109.5° |
C26 | C25 | H12 | 109.5° | 109.5° |
C25 | C26 | H22 | 108.8° | 109.5° |
C25 | C26 | H23 | 108.8° | 109.4° |
C25 | C24 | N19 | 113.5° | 109.5° |
C25 | C24 | H9 | 108.5° | 109.5° |
C25 | C24 | H10 | 108.4° | 109.4° |
C24 | C25 | H11 | 109.5° | 109.4° |
C24 | C25 | H12 | 109.5° | 109.4° |
C24 | N19 | C18 | 105.7° | 111.0° |
C24 | N19 | C20 | 109.9° | 111.0° |
N19 | C24 | H9 | 108.4° | 109.5° |
N19 | C24 | H10 | 108.5° | 109.5° |
C18 | N19 | C20 | 109.0° | 111.0° |
N19 | C18 | C17 | 111.3° | 109.5° |
N19 | C18 | H20 | 109.0° | 109.5° |
N19 | C18 | H21 | 109.0° | 109.5° |
N19 | C20 | C21 | 108.4° | 109.5° |
N19 | C20 | H5 | 109.8° | 109.5° |
N19 | C20 | H6 | 109.7° | 109.5° |
C18 | C17 | O16 | 107.7° | 109.8° |
C18 | C17 | C02 | 113.4° | 109.9° |
C18 | C17 | H1 | 111.1° | 110.0° |
C17 | C18 | H20 | 109.0° | 109.4° |
C17 | C18 | H21 | 109.0° | 109.5° |
C20 | C21 | C22 | 112.8° | 109.5° |
C21 | C20 | H5 | 109.8° | 109.5° |
C21 | C20 | H6 | 109.8° | 109.5° |
C20 | C21 | H7 | 108.7° | 109.5° |
C20 | C21 | H8 | 108.7° | 109.4° |
C21 | C22 | N23 | 112.3° | 109.5° |
C21 | C22 | H3 | 108.7° | 109.4° |
C21 | C22 | H4 | 108.8° | 109.4° |
C22 | C21 | H7 | 108.7° | 109.5° |
C22 | C21 | H8 | 108.6° | 109.4° |
N23 | C22 | H3 | 108.8° | 109.5° |
N23 | C22 | H4 | 108.7° | 109.5° |
C22 | N23 | H27 | 109.5° | 111.0° |
C22 | N23 | H28 | 109.5° | 111.0° |
N14 | C15 | N06 | 108.8° | 110.0° |
C15 | N14 | C13 | 107.8° | 109.5° |
N14 | C15 | H2 | 125.6° | 125.0° |
C15 | N06 | C05 | 125.4° | 126.3° |
C15 | N06 | C07 | 108.2° | 107.4° |
N06 | C15 | H2 | 125.6° | 125.0° |
O16 | C17 | C02 | 105.3° | 107.3° |
C17 | O16 | C05 | 106.9° | 106.9° |
O16 | C17 | H1 | 110.0° | 109.9° |
C17 | C02 | C03 | 105.0° | 104.2° |
C17 | C02 | O01 | 107.8° | 110.5° |
C02 | C17 | H1 | 109.2° | 109.9° |
C17 | C02 | H16 | 108.4° | 110.5° |
N14 | C13 | C07 | 107.4° | 107.1° |
N14 | C13 | C11 | 134.6° | 134.7° |
O16 | C05 | C03 | 106.4° | 103.5° |
O16 | C05 | N06 | 110.9° | 110.7° |
O16 | C05 | H18 | 112.1° | 110.6° |
C03 | C02 | O01 | 113.3° | 110.4° |
C02 | C03 | C05 | 104.3° | 102.1° |
C02 | C03 | O04 | 116.3° | 110.9° |
C03 | C02 | H16 | 113.2° | 110.5° |
C02 | C03 | H17 | 112.3° | 110.9° |
O01 | C02 | H16 | 108.9° | 110.6° |
C02 | O01 | H33 | 109.5° | 114.0° |
C05 | C03 | O04 | 108.1° | 110.9° |
C03 | C05 | N06 | 110.8° | 110.6° |
C05 | C03 | H17 | 106.7° | 110.9° |
C03 | C05 | H18 | 107.0° | 110.6° |
O04 | C03 | H17 | 108.5° | 110.9° |
C03 | O04 | H34 | 109.5° | 114.0° |
C05 | N06 | C07 | 126.3° | 126.3° |
N06 | C05 | H18 | 109.6° | 110.6° |
N06 | C07 | C13 | 107.6° | 106.0° |
N06 | C07 | N08 | 131.8° | 134.9° |
C07 | C13 | C11 | 117.9° | 118.2° |
C13 | C07 | N08 | 120.5° | 119.1° |
C13 | C11 | N12 | 122.1° | 120.8° |
C13 | C11 | N10 | 118.9° | 118.5° |
N12 | C11 | N10 | 119.1° | 120.7° |
C11 | N12 | H24 | 109.5° | 119.9° |
C11 | N12 | H25 | 109.5° | 120.0° |
C07 | N08 | C09 | 119.4° | 120.7° |
C11 | N10 | C09 | 121.4° | 121.2° |
N08 | C09 | N10 | 121.8° | 122.4° |
N08 | C09 | H19 | 119.1° | 118.8° |
N10 | C09 | H19 | 119.1° | 118.8° |
H3 | C22 | H4 | 109.5° | 109.5° |
H5 | C20 | H6 | 109.5° | 109.4° |
H7 | C21 | H8 | 109.4° | 109.5° |
H9 | C24 | H10 | 109.5° | 109.4° |
H11 | C25 | H12 | 109.5° | 109.5° |
H13 | C27 | H14 | 109.5° | 109.5° |
H20 | C18 | H21 | 109.5° | 109.5° |
H22 | C26 | H23 | 109.5° | 109.5° |
H24 | N12 | H25 | 109.5° | 120.1° |
H27 | N23 | H28 | 109.5° | 111.0° |
H30 | N30 | H31 | 120.0° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N31 | C29 | N30 | N28 | 179.4° | 179.9° |
N31 | C29 | N28 | C27 | 178.9° | 180.0° |
N31 | C29 | N28 | H15 | 1.1° | 0.0° |
N31 | C29 | N30 | H30 | 179.4° | 180.0° |
N31 | C29 | N30 | H31 | 0.6° | 0.1° |
N30 | C29 | N28 | C27 | 1.8° | 0.1° |
N30 | C29 | N28 | H15 | 178.2° | 179.9° |
C29 | N30 | H30 | H31 | 180.0° | 179.9° |
N30 | C29 | N31 | H32 | 179.4° | 179.9° |
C29 | N28 | C27 | H15 | 180.0° | 180.0° |
C29 | N28 | C27 | C26 | 74.7° | 180.0° |
C29 | N28 | C27 | H13 | 164.5° | 60.0° |
C29 | N28 | C27 | H14 | 46.1° | 60.0° |
N28 | C29 | N30 | H30 | 0.0° | 0.1° |
N28 | C29 | N30 | H31 | 180.0° | 180.0° |
N28 | C29 | N31 | H32 | 0.0° | 0.0° |
N28 | C27 | C26 | H13 | 120.8° | 119.9° |
N28 | C27 | C26 | H14 | 120.8° | 120.0° |
N28 | C27 | C26 | C25 | 89.5° | 180.0° |
N28 | C27 | H13 | H14 | 117.6° | 120.0° |
N28 | C27 | C26 | H22 | 150.1° | 60.0° |
N28 | C27 | C26 | H23 | 30.9° | 60.1° |
C27 | C26 | C25 | H22 | 120.4° | 120.1° |
C27 | C26 | C25 | H23 | 120.4° | 120.0° |
C27 | C26 | C25 | C24 | 147.5° | 180.0° |
C27 | C26 | C25 | H11 | 92.5° | 60.0° |
C27 | C26 | C25 | H12 | 27.5° | 60.1° |
C26 | C27 | H13 | H14 | 117.5° | 120.0° |
C26 | C27 | N28 | H15 | 105.3° | 0.0° |
C27 | C26 | H22 | H23 | 118.8° | 120.0° |
C26 | C25 | C24 | H11 | 120.0° | 120.0° |
C26 | C25 | C24 | H12 | 120.0° | 120.0° |
C26 | C25 | C24 | N19 | 149.3° | 180.0° |
C26 | C25 | C24 | H9 | 90.2° | 60.0° |
C26 | C25 | C24 | H10 | 28.6° | 60.0° |
C26 | C25 | H11 | H12 | 120.0° | 120.0° |
C25 | C26 | C27 | H13 | 31.3° | 60.1° |
C25 | C26 | C27 | H14 | 149.7° | 60.0° |
C25 | C26 | H22 | H23 | 118.8° | 119.9° |
C25 | C24 | N19 | H9 | 120.6° | 120.1° |
C25 | C24 | N19 | H10 | 120.6° | 120.0° |
C25 | C24 | N19 | C18 | 139.3° | 170.0° |
C25 | C24 | N19 | C20 | 103.2° | 66.0° |
C25 | C24 | H9 | H10 | 118.1° | 120.0° |
C24 | C25 | H11 | H12 | 120.1° | 120.0° |
C24 | C25 | C26 | H22 | 27.1° | 60.0° |
C24 | C25 | C26 | H23 | 92.1° | 60.0° |
C24 | N19 | C18 | C20 | 118.1° | 124.0° |
C24 | N19 | C18 | C17 | 160.6° | 76.1° |
C24 | N19 | C20 | C21 | 117.0° | 164.3° |
C24 | N19 | C20 | H5 | 2.9° | 75.7° |
C24 | N19 | C20 | H6 | 123.2° | 44.3° |
N19 | C24 | H9 | H10 | 118.2° | 120.0° |
N19 | C24 | C25 | H11 | 29.3° | 60.0° |
N19 | C24 | C25 | H12 | 90.8° | 60.0° |
C24 | N19 | C18 | H20 | 40.4° | 43.8° |
C24 | N19 | C18 | H21 | 79.1° | 163.8° |
N19 | C18 | C17 | H20 | 120.3° | 120.0° |
N19 | C18 | C17 | H21 | 120.3° | 120.0° |
C18 | N19 | C20 | C21 | 127.6° | 71.7° |
N19 | C18 | C17 | O16 | 116.4° | 61.3° |
N19 | C18 | C17 | C02 | 127.5° | 179.1° |
N19 | C18 | C17 | H1 | 4.1° | 59.8° |
C18 | N19 | C20 | H5 | 112.6° | 48.3° |
C18 | N19 | C20 | H6 | 7.7° | 168.3° |
C18 | N19 | C24 | H9 | 100.1° | 70.0° |
C18 | N19 | C24 | H10 | 18.7° | 50.0° |
N19 | C18 | H20 | H21 | 119.1° | 120.0° |
C20 | N19 | C18 | C17 | 42.5° | 159.9° |
N19 | C20 | C21 | H5 | 119.8° | 120.0° |
N19 | C20 | C21 | H6 | 119.8° | 120.0° |
N19 | C20 | C21 | C22 | 172.4° | 177.4° |
N19 | C20 | H5 | H6 | 120.5° | 120.0° |
N19 | C20 | C21 | H7 | 67.0° | 62.5° |
N19 | C20 | C21 | H8 | 51.9° | 57.5° |
C20 | N19 | C24 | H9 | 17.4° | 54.0° |
C20 | N19 | C24 | H10 | 136.2° | 174.0° |
C20 | N19 | C18 | H20 | 77.7° | 80.2° |
C20 | N19 | C18 | H21 | 162.8° | 39.9° |
C18 | C17 | O16 | C02 | 121.3° | 119.4° |
C18 | C17 | O16 | H1 | 121.2° | 121.1° |
C18 | C17 | C02 | H1 | 124.4° | 121.1° |
C18 | C17 | O16 | C05 | 120.8° | 146.0° |
C18 | C17 | C02 | C03 | 93.3° | 121.5° |
C18 | C17 | C02 | O01 | 145.7° | 119.9° |
C18 | C17 | C02 | H16 | 28.0° | 2.8° |
C17 | C18 | H20 | H21 | 119.2° | 120.0° |
C20 | C21 | C22 | H7 | 120.5° | 120.0° |
C20 | C21 | C22 | H8 | 120.5° | 119.9° |
C20 | C21 | C22 | N23 | 135.0° | 180.0° |
C20 | C21 | C22 | H3 | 14.6° | 60.0° |
C20 | C21 | C22 | H4 | 104.6° | 59.9° |
C21 | C20 | H5 | H6 | 120.5° | 120.0° |
C20 | C21 | H7 | H8 | 118.5° | 120.0° |
C21 | C22 | N23 | H3 | 120.4° | 119.9° |
C21 | C22 | N23 | H4 | 120.4° | 120.0° |
C21 | C22 | H3 | H4 | 118.7° | 119.9° |
C22 | C21 | C20 | H5 | 52.6° | 57.4° |
C22 | C21 | C20 | H6 | 67.8° | 62.6° |
C22 | C21 | H7 | H8 | 118.5° | 120.0° |
C21 | C22 | N23 | H27 | 180.0° | 180.0° |
C21 | C22 | N23 | H28 | 60.0° | 56.1° |
N23 | C22 | H3 | H4 | 118.7° | 120.1° |
N23 | C22 | C21 | H7 | 104.5° | 60.0° |
N23 | C22 | C21 | H8 | 14.5° | 60.0° |
C22 | N23 | H27 | H28 | 120.0° | 123.9° |
N14 | C15 | N06 | H2 | 180.0° | 179.6° |
N14 | C15 | N06 | C05 | 179.2° | 180.0° |
N14 | C15 | N06 | C07 | 0.2° | 0.2° |
C15 | N14 | C13 | C07 | 0.9° | 0.3° |
C15 | N14 | C13 | C11 | 179.3° | 179.9° |
N06 | C15 | N14 | C13 | 0.4° | 0.3° |
C15 | N06 | C05 | O16 | 67.7° | 19.1° |
C15 | N06 | C05 | C03 | 50.2° | 95.1° |
C15 | N06 | C05 | C07 | 178.8° | 179.8° |
C15 | N06 | C07 | C13 | 0.8° | 0.1° |
C15 | N06 | C07 | N08 | 179.4° | 180.0° |
C15 | N06 | C05 | H18 | 168.0° | 142.0° |
O16 | C17 | C02 | H1 | 118.0° | 119.5° |
O16 | C17 | C02 | C03 | 24.2° | 2.1° |
O16 | C17 | C02 | O01 | 96.7° | 120.7° |
C17 | O16 | C05 | C03 | 17.5° | 40.1° |
C17 | O16 | C05 | N06 | 138.1° | 158.6° |
O16 | C17 | C02 | H16 | 145.5° | 116.6° |
C17 | O16 | C05 | H18 | 99.1° | 78.4° |
O16 | C17 | C18 | H20 | 3.8° | 178.8° |
O16 | C17 | C18 | H21 | 123.3° | 58.8° |
C02 | C17 | O16 | C05 | 0.5° | 26.6° |
C17 | C02 | C03 | O01 | 117.3° | 118.7° |
C17 | C02 | C03 | H16 | 118.0° | 118.7° |
C17 | C02 | O01 | H16 | 117.4° | 122.7° |
C17 | C02 | C03 | C05 | 32.7° | 20.9° |
C17 | C02 | C03 | O04 | 151.7° | 139.0° |
C17 | C02 | C03 | H17 | 82.4° | 97.3° |
C02 | C17 | C18 | H20 | 112.3° | 60.9° |
C02 | C17 | C18 | H21 | 7.2° | 59.1° |
C17 | C02 | O01 | H33 | 180.0° | 180.0° |
N14 | C13 | C07 | N06 | 1.0° | 0.2° |
N14 | C13 | C07 | C11 | 178.7° | 179.8° |
N14 | C13 | C11 | N12 | 1.5° | 0.3° |
N14 | C13 | C07 | N08 | 179.1° | 179.8° |
N14 | C13 | C11 | N10 | 177.9° | 179.7° |
C13 | N14 | C15 | H2 | 179.6° | 180.0° |
O16 | C05 | C03 | C02 | 35.1° | 37.0° |
O16 | C05 | C03 | N06 | 120.7° | 118.6° |
O16 | C05 | C03 | H18 | 120.0° | 118.5° |
O16 | C05 | C03 | O04 | 159.5° | 155.2° |
O16 | C05 | N06 | H18 | 124.3° | 123.0° |
O16 | C05 | N06 | C07 | 111.1° | 161.1° |
C05 | O16 | C17 | H1 | 118.0° | 92.9° |
O16 | C05 | C03 | H17 | 84.0° | 81.2° |
C03 | C02 | O01 | H16 | 127.0° | 122.6° |
C02 | C03 | C05 | O04 | 124.4° | 118.2° |
C02 | C03 | C05 | H17 | 119.1° | 118.2° |
C02 | C03 | O04 | H17 | 127.8° | 123.7° |
C02 | C03 | C05 | N06 | 155.7° | 155.7° |
C03 | C02 | C17 | H1 | 142.3° | 117.4° |
C02 | C03 | C05 | H18 | 84.9° | 81.5° |
C03 | C02 | O01 | H33 | 64.4° | 65.3° |
C02 | C03 | O04 | H34 | 180.0° | 61.5° |
O01 | C02 | C03 | C05 | 84.5° | 97.8° |
O01 | C02 | C03 | O04 | 34.4° | 20.4° |
O01 | C02 | C17 | H1 | 21.3° | 1.2° |
O01 | C02 | C03 | H17 | 160.3° | 144.0° |
C05 | C03 | O04 | H17 | 115.3° | 123.6° |
C03 | C05 | N06 | H18 | 117.8° | 122.9° |
C03 | C05 | N06 | C07 | 131.0° | 84.8° |
C05 | C03 | C02 | H16 | 150.8° | 139.6° |
C05 | C03 | O04 | H34 | 63.1° | 174.2° |
O04 | C03 | C05 | N06 | 79.9° | 86.1° |
O04 | C03 | C02 | H16 | 90.3° | 102.3° |
O04 | C03 | C05 | H18 | 39.5° | 36.7° |
C05 | N06 | C07 | C13 | 179.7° | 179.8° |
C05 | N06 | C07 | N08 | 0.4° | 0.2° |
C05 | N06 | C15 | H2 | 0.8° | 0.3° |
N06 | C05 | C03 | H17 | 36.7° | 37.5° |
N06 | C07 | C13 | N08 | 179.9° | 180.0° |
N06 | C07 | C13 | C11 | 179.7° | 180.0° |
N06 | C07 | N08 | C09 | 179.2° | 180.0° |
C07 | N06 | C15 | H2 | 179.8° | 179.8° |
C07 | N06 | C05 | H18 | 13.2° | 38.1° |
C07 | C13 | C11 | N12 | 179.8° | 180.0° |
C07 | C13 | C11 | N10 | 0.3° | 0.0° |
C13 | C07 | N08 | C09 | 1.0° | 0.0° |
C13 | C11 | N12 | N10 | 179.4° | 180.0° |
C11 | C13 | C07 | N08 | 0.4° | 0.0° |
C13 | C11 | N10 | C09 | 0.5° | 0.0° |
C13 | C11 | N12 | H24 | 179.5° | 0.0° |
C13 | C11 | N12 | H25 | 59.4° | 180.0° |
N12 | C11 | N10 | C09 | 180.0° | 179.9° |
C11 | N12 | H24 | H25 | 120.0° | 180.0° |
C07 | N08 | C09 | N10 | 0.8° | 0.0° |
C07 | N08 | C09 | H19 | 179.2° | 180.0° |
C11 | N10 | C09 | N08 | 0.0° | 0.0° |
C11 | N10 | C09 | H19 | 180.0° | 180.0° |
N10 | C11 | N12 | H24 | 0.0° | 180.0° |
N10 | C11 | N12 | H25 | 120.0° | 0.0° |
N08 | C09 | N10 | H19 | 180.0° | 180.0° |
H1 | C17 | C02 | H16 | 96.5° | 123.9° |
H1 | C17 | C18 | H20 | 124.3° | 60.1° |
H1 | C17 | C18 | H21 | 116.2° | 179.9° |
H3 | C22 | C21 | H7 | 135.1° | 60.0° |
H3 | C22 | C21 | H8 | 105.9° | 180.0° |
H3 | C22 | N23 | H27 | 59.6° | 60.0° |
H3 | C22 | N23 | H28 | 179.6° | 176.0° |
H4 | C22 | C21 | H7 | 15.9° | 180.0° |
H4 | C22 | C21 | H8 | 134.9° | 60.0° |
H4 | C22 | N23 | H27 | 59.6° | 60.0° |
H4 | C22 | N23 | H28 | 60.4° | 63.9° |
H5 | C20 | C21 | H7 | 173.1° | 177.5° |
H5 | C20 | C21 | H8 | 67.9° | 62.5° |
H6 | C20 | C21 | H7 | 52.8° | 57.5° |
H6 | C20 | C21 | H8 | 171.7° | 177.5° |
H9 | C24 | C25 | H11 | 149.9° | 60.0° |
H9 | C24 | C25 | H12 | 29.8° | 180.0° |
H10 | C24 | C25 | H11 | 91.3° | 180.0° |
H10 | C24 | C25 | H12 | 148.6° | 60.0° |
H11 | C25 | C26 | H22 | 147.1° | 180.0° |
H11 | C25 | C26 | H23 | 27.9° | 60.0° |
H12 | C25 | C26 | H22 | 92.9° | 60.0° |
H12 | C25 | C26 | H23 | 147.9° | 180.0° |
H13 | C27 | N28 | H15 | 15.5° | 120.0° |
H13 | C27 | C26 | H22 | 89.1° | 60.0° |
H13 | C27 | C26 | H23 | 151.7° | 180.0° |
H14 | C27 | N28 | H15 | 133.9° | 120.0° |
H14 | C27 | C26 | H22 | 29.4° | 180.0° |
H14 | C27 | C26 | H23 | 89.9° | 60.0° |
H16 | C02 | C03 | H17 | 35.6° | 21.4° |
H16 | C02 | O01 | H33 | 62.6° | 57.3° |
H17 | C03 | C05 | H18 | 156.0° | 160.3° |
H17 | C03 | O04 | H34 | 52.2° | 62.2° |