6MM
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C | C1 | sing | 1.53Å | 1.51Å | |
C1 | O | sing | 1.43Å | 1.42Å | |
C1 | O5 | sing | 1.44Å | 1.44Å | |
C1 | C2 | sing | 1.53Å | 1.51Å | |
O | C3 | sing | 1.44Å | 1.41Å | |
O4 | C20 | sing | 1.44Å | 1.43Å | |
O4 | C17 | sing | 1.43Å | 1.43Å | |
C19 | C17 | sing | 1.53Å | 1.51Å | |
O5 | C4 | sing | 1.44Å | 1.42Å | |
C3 | C4 | sing | 1.54Å | 1.52Å | |
C20 | C4 | sing | 1.53Å | 1.53Å | |
C20 | C16 | sing | 1.56Å | 1.54Å | |
C4 | O1 | sing | 1.42Å | 1.42Å | |
C17 | C18 | sing | 1.53Å | 1.51Å | |
C17 | O3 | sing | 1.43Å | 1.43Å | |
C16 | O3 | sing | 1.44Å | 1.42Å | |
C16 | C5 | sing | 1.54Å | 1.53Å | |
O1 | C5 | sing | 1.44Å | 1.44Å | |
C5 | C6 | sing | 1.53Å | 1.52Å | |
C6 | N | sing | 1.47Å | 1.45Å | |
N | C7 | sing | 1.38Å | 1.34Å | |
C7 | N5 | doub | 1.31Å | 1.35Å | Aromatic |
C7 | N1 | sing | 1.36Å | 1.33Å | Aromatic |
N5 | C15 | sing | 1.36Å | 1.39Å | Aromatic |
N1 | C8 | sing | 1.39Å | 1.39Å | Aromatic |
C15 | C8 | doub | 1.41Å | 1.40Å | Aromatic |
C15 | C14 | sing | 1.39Å | 1.38Å | Aromatic |
C8 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
C14 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
C9 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
C13 | C10 | sing | 1.42Å | 1.40Å | Aromatic |
C13 | N4 | sing | 1.36Å | 1.39Å | |
C10 | C11 | sing | 1.47Å | 1.47Å | |
N4 | C12 | doub | 1.31Å | 1.33Å | |
C11 | O2 | doub | 1.22Å | 1.23Å | |
C11 | N2 | sing | 1.35Å | 1.38Å | |
C12 | N2 | sing | 1.37Å | 1.36Å | |
C12 | N3 | sing | 1.37Å | 1.33Å | |
C2 | H1 | sing | 1.09Å | 1.10Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H3 | sing | 1.09Å | 1.10Å | |
C3 | H4 | sing | 1.09Å | 1.10Å | |
C3 | H5 | sing | 1.09Å | 1.10Å | |
C5 | H6 | sing | 1.09Å | 1.10Å | |
C6 | H7 | sing | 1.09Å | 1.10Å | |
C6 | H8 | sing | 1.09Å | 1.10Å | |
N2 | H9 | sing | 0.97Å | 1.00Å | |
N3 | H10 | sing | 0.97Å | 1.00Å | |
N3 | H11 | sing | 0.97Å | 1.00Å | |
C9 | H12 | sing | 1.08Å | 1.08Å | |
C14 | H13 | sing | 1.08Å | 1.08Å | |
N1 | H14 | sing | 0.97Å | 1.00Å | |
N | H16 | sing | 0.97Å | 1.00Å | |
C16 | H17 | sing | 1.09Å | 1.10Å | |
C20 | H18 | sing | 1.09Å | 1.10Å | |
C18 | H19 | sing | 1.09Å | 1.10Å | |
C18 | H20 | sing | 1.09Å | 1.10Å | |
C18 | H21 | sing | 1.09Å | 1.10Å | |
C19 | H22 | sing | 1.09Å | 1.10Å | |
C19 | H23 | sing | 1.09Å | 1.10Å | |
C19 | H24 | sing | 1.09Å | 1.10Å | |
C | H25 | sing | 1.09Å | 1.10Å | |
C | H26 | sing | 1.09Å | 1.10Å | |
C | H27 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C | C1 | O | 109.9° | 109.6° |
C | C1 | O5 | 109.3° | 109.6° |
C | C1 | C2 | 113.0° | 109.5° |
C1 | C | H25 | 109.5° | 109.4° |
C1 | C | H26 | 109.5° | 109.5° |
C1 | C | H27 | 109.5° | 109.5° |
O | C1 | O5 | 105.6° | 108.9° |
O | C1 | C2 | 109.5° | 109.6° |
C1 | O | C3 | 109.0° | 107.3° |
O5 | C1 | C2 | 109.3° | 109.6° |
C1 | O5 | C4 | 110.1° | 104.7° |
C1 | C2 | H1 | 109.5° | 109.5° |
C1 | C2 | H2 | 109.4° | 109.5° |
C1 | C2 | H3 | 109.5° | 109.5° |
O | C3 | C4 | 104.1° | 103.0° |
O | C3 | H4 | 110.8° | 110.7° |
O | C3 | H5 | 110.8° | 110.9° |
C20 | O4 | C17 | 109.1° | 105.7° |
O4 | C20 | C4 | 115.3° | 108.9° |
O4 | C20 | C16 | 105.1° | 102.1° |
O4 | C20 | H18 | 111.4° | 114.5° |
O4 | C17 | C19 | 109.7° | 109.6° |
O4 | C17 | C18 | 109.6° | 109.6° |
O4 | C17 | O3 | 105.1° | 108.9° |
C19 | C17 | C18 | 113.2° | 109.6° |
C19 | C17 | O3 | 109.7° | 109.5° |
C17 | C19 | H22 | 109.5° | 109.5° |
C17 | C19 | H23 | 109.5° | 109.5° |
C17 | C19 | H24 | 109.5° | 109.4° |
O5 | C4 | C3 | 103.6° | 103.0° |
O5 | C4 | C20 | 111.9° | 110.9° |
O5 | C4 | O1 | 109.5° | 111.7° |
C3 | C4 | C20 | 117.2° | 110.7° |
C3 | C4 | O1 | 109.4° | 111.4° |
C4 | C3 | H4 | 110.8° | 110.7° |
C4 | C3 | H5 | 110.8° | 110.7° |
C4 | C20 | C16 | 105.0° | 102.2° |
C20 | C4 | O1 | 105.2° | 109.1° |
C4 | C20 | H18 | 109.9° | 113.8° |
C20 | C16 | O3 | 104.5° | 103.6° |
C20 | C16 | C5 | 106.5° | 101.5° |
C20 | C16 | H17 | 111.3° | 114.5° |
C16 | C20 | H18 | 109.8° | 114.1° |
C4 | O1 | C5 | 111.8° | 109.6° |
C18 | C17 | O3 | 109.2° | 109.6° |
C17 | C18 | H19 | 109.5° | 109.4° |
C17 | C18 | H20 | 109.5° | 109.5° |
C17 | C18 | H21 | 109.5° | 109.5° |
C17 | O3 | C16 | 109.0° | 108.0° |
O3 | C16 | C5 | 109.6° | 109.3° |
O3 | C16 | H17 | 113.1° | 113.4° |
C16 | C5 | O1 | 104.4° | 105.8° |
C16 | C5 | C6 | 113.4° | 110.2° |
C16 | C5 | H6 | 109.8° | 110.3° |
C5 | C16 | H17 | 111.4° | 113.5° |
O1 | C5 | C6 | 107.9° | 110.2° |
O1 | C5 | H6 | 111.1° | 110.2° |
C5 | C6 | N | 114.1° | 109.5° |
C6 | C5 | H6 | 110.0° | 110.2° |
C5 | C6 | H7 | 108.3° | 109.5° |
C5 | C6 | H8 | 108.3° | 109.5° |
C6 | N | C7 | 123.7° | 120.0° |
N | C6 | H7 | 108.3° | 109.4° |
N | C6 | H8 | 108.3° | 109.5° |
C6 | N | H16 | 105.8° | 120.0° |
N | C7 | N5 | 122.8° | 125.0° |
N | C7 | N1 | 124.2° | 125.0° |
C7 | N | H16 | 105.8° | 120.0° |
N5 | C7 | N1 | 113.0° | 110.0° |
C7 | N5 | C15 | 107.0° | 109.8° |
C7 | N1 | C8 | 105.0° | 107.2° |
C7 | N1 | H14 | 127.5° | 126.4° |
N5 | C15 | C8 | 105.7° | 107.0° |
N5 | C15 | C14 | 132.0° | 132.9° |
N1 | C8 | C15 | 109.3° | 106.1° |
N1 | C8 | C9 | 130.3° | 133.4° |
C8 | N1 | H14 | 127.5° | 126.4° |
C8 | C15 | C14 | 122.2° | 120.2° |
C15 | C8 | C9 | 120.2° | 120.5° |
C15 | C14 | C13 | 117.7° | 119.7° |
C15 | C14 | H13 | 121.1° | 120.2° |
C8 | C9 | C10 | 118.2° | 119.5° |
C8 | C9 | H12 | 120.9° | 120.2° |
C14 | C13 | C10 | 120.7° | 119.8° |
C14 | C13 | N4 | 117.2° | 121.3° |
C13 | C14 | H13 | 121.1° | 120.1° |
C9 | C10 | C13 | 120.9° | 120.4° |
C9 | C10 | C11 | 120.5° | 121.5° |
C10 | C9 | H12 | 120.9° | 120.2° |
C10 | C13 | N4 | 122.0° | 118.9° |
C13 | C10 | C11 | 118.5° | 118.1° |
C13 | N4 | C12 | 118.1° | 121.6° |
C10 | C11 | O2 | 124.5° | 121.2° |
C10 | C11 | N2 | 114.8° | 117.6° |
N4 | C12 | N2 | 122.6° | 123.1° |
N4 | C12 | N3 | 119.8° | 118.5° |
O2 | C11 | N2 | 120.8° | 121.2° |
C11 | N2 | C12 | 124.1° | 120.6° |
C11 | N2 | H9 | 118.0° | 119.7° |
N2 | C12 | N3 | 117.6° | 118.4° |
C12 | N2 | H9 | 117.9° | 119.7° |
C12 | N3 | H10 | 120.0° | 120.0° |
C12 | N3 | H11 | 120.0° | 120.0° |
H1 | C2 | H2 | 109.4° | 109.5° |
H1 | C2 | H3 | 109.5° | 109.5° |
H2 | C2 | H3 | 109.5° | 109.4° |
H4 | C3 | H5 | 109.5° | 110.6° |
H7 | C6 | H8 | 109.5° | 109.5° |
H10 | N3 | H11 | 120.0° | 120.0° |
H19 | C18 | H20 | 109.5° | 109.5° |
H19 | C18 | H21 | 109.5° | 109.5° |
H20 | C18 | H21 | 109.5° | 109.5° |
H22 | C19 | H23 | 109.4° | 109.5° |
H22 | C19 | H24 | 109.5° | 109.5° |
H23 | C19 | H24 | 109.4° | 109.5° |
H25 | C | H26 | 109.4° | 109.4° |
H25 | C | H27 | 109.5° | 109.5° |
H26 | C | H27 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C | C1 | O | O5 | 117.7° | 119.9° |
C | C1 | O | C2 | 124.7° | 120.2° |
C | C1 | O5 | C2 | 124.1° | 120.2° |
C | C1 | O | C3 | 99.5° | 120.5° |
C | C1 | O5 | C4 | 117.5° | 143.1° |
C | C1 | C2 | H1 | 180.0° | 178.8° |
C | C1 | C2 | H2 | 60.0° | 61.1° |
C | C1 | C2 | H3 | 60.0° | 58.9° |
C1 | C | H25 | H26 | 120.0° | 120.0° |
C1 | C | H25 | H27 | 120.0° | 120.0° |
C1 | C | H26 | H27 | 120.0° | 120.1° |
O | C1 | O5 | C2 | 117.7° | 119.9° |
O | C1 | O5 | C4 | 0.6° | 23.2° |
C1 | O | C3 | C4 | 27.4° | 20.5° |
O | C1 | C2 | H1 | 57.1° | 58.5° |
O | C1 | C2 | H2 | 177.1° | 178.6° |
O | C1 | C2 | H3 | 62.9° | 61.5° |
C1 | O | C3 | H4 | 146.5° | 97.9° |
C1 | O | C3 | H5 | 91.7° | 139.0° |
O | C1 | C | H25 | 180.0° | 61.5° |
O | C1 | C | H26 | 60.0° | 178.6° |
O | C1 | C | H27 | 60.0° | 58.5° |
O5 | C1 | O | C3 | 18.2° | 0.6° |
C1 | O5 | C4 | C3 | 15.4° | 34.8° |
C1 | O5 | C4 | C20 | 142.7° | 153.3° |
C1 | O5 | C4 | O1 | 101.2° | 84.8° |
O5 | C1 | C2 | H1 | 58.1° | 60.9° |
O5 | C1 | C2 | H2 | 61.9° | 59.1° |
O5 | C1 | C2 | H3 | 178.1° | 179.1° |
O5 | C1 | C | H25 | 64.6° | 179.1° |
O5 | C1 | C | H26 | 55.4° | 59.2° |
O5 | C1 | C | H27 | 175.4° | 60.9° |
C2 | C1 | O | C3 | 135.8° | 119.3° |
C2 | C1 | O5 | C4 | 118.3° | 96.7° |
C1 | C2 | H1 | H2 | 120.0° | 120.1° |
C1 | C2 | H1 | H3 | 120.0° | 120.0° |
C1 | C2 | H2 | H3 | 120.0° | 120.0° |
C2 | C1 | C | H25 | 57.3° | 58.9° |
C2 | C1 | C | H26 | 177.3° | 61.1° |
C2 | C1 | C | H27 | 62.7° | 178.8° |
O | C3 | C4 | O5 | 25.8° | 34.3° |
O | C3 | C4 | H4 | 119.1° | 118.4° |
O | C3 | C4 | H5 | 119.2° | 118.5° |
O | C3 | C4 | C20 | 149.6° | 152.9° |
O | C3 | C4 | O1 | 90.8° | 85.5° |
O | C3 | H4 | H5 | 122.5° | 123.3° |
C20 | O4 | C17 | C19 | 93.0° | 95.8° |
O4 | C20 | C4 | O5 | 143.3° | 147.5° |
O4 | C20 | C4 | C3 | 23.7° | 33.9° |
O4 | C20 | C4 | C16 | 115.1° | 107.4° |
O4 | C20 | C4 | H18 | 126.8° | 129.1° |
O4 | C20 | C16 | H18 | 119.9° | 124.1° |
O4 | C20 | C4 | O1 | 98.0° | 89.1° |
C20 | O4 | C17 | C18 | 142.1° | 143.8° |
C20 | O4 | C17 | O3 | 24.9° | 23.9° |
O4 | C20 | C16 | O3 | 3.9° | 31.4° |
O4 | C20 | C16 | C5 | 119.9° | 82.0° |
O4 | C20 | C16 | H17 | 118.5° | 155.4° |
O4 | C17 | C19 | C18 | 122.7° | 120.4° |
O4 | C17 | C19 | O3 | 115.0° | 119.4° |
C17 | O4 | C20 | C4 | 128.0° | 140.8° |
C17 | O4 | C20 | C16 | 12.9° | 33.3° |
O4 | C17 | C18 | O3 | 114.7° | 119.4° |
O4 | C17 | O3 | C16 | 27.7° | 2.7° |
C17 | O4 | C20 | H18 | 106.0° | 90.5° |
O4 | C17 | C18 | H19 | 180.0° | 60.0° |
O4 | C17 | C18 | H20 | 60.0° | 180.0° |
O4 | C17 | C18 | H21 | 60.0° | 60.0° |
O4 | C17 | C19 | H22 | 180.0° | 60.0° |
O4 | C17 | C19 | H23 | 60.0° | 180.0° |
O4 | C17 | C19 | H24 | 60.0° | 60.0° |
C19 | C17 | C18 | O3 | 122.5° | 120.2° |
C19 | C17 | O3 | C16 | 90.3° | 117.1° |
C19 | C17 | C18 | H19 | 57.2° | 60.4° |
C19 | C17 | C18 | H20 | 177.2° | 59.6° |
C19 | C17 | C18 | H21 | 62.8° | 179.7° |
C17 | C19 | H22 | H23 | 120.0° | 120.0° |
C17 | C19 | H22 | H24 | 120.0° | 120.0° |
C17 | C19 | H23 | H24 | 120.0° | 120.0° |
O5 | C4 | C3 | C20 | 123.8° | 118.5° |
O5 | C4 | C3 | O1 | 116.7° | 119.8° |
O5 | C4 | C20 | O1 | 118.8° | 123.4° |
O5 | C4 | C20 | C16 | 101.6° | 105.0° |
O5 | C4 | O1 | C5 | 92.6° | 125.9° |
O5 | C4 | C3 | H4 | 145.0° | 84.0° |
O5 | C4 | C3 | H5 | 93.3° | 152.9° |
O5 | C4 | C20 | H18 | 16.4° | 18.5° |
C3 | C4 | C20 | O1 | 121.7° | 123.0° |
C3 | C4 | C20 | C16 | 138.9° | 141.3° |
C3 | C4 | O1 | C5 | 154.5° | 119.6° |
C4 | C3 | H4 | H5 | 122.4° | 123.2° |
C3 | C4 | C20 | H18 | 103.1° | 95.2° |
C4 | C20 | C16 | H18 | 118.1° | 123.3° |
C4 | C20 | C16 | O3 | 118.1° | 144.0° |
C4 | C20 | C16 | C5 | 2.1° | 30.7° |
C20 | C4 | O1 | C5 | 27.8° | 3.0° |
C20 | C4 | C3 | H4 | 91.2° | 34.5° |
C20 | C4 | C3 | H5 | 30.5° | 88.6° |
C4 | C20 | C16 | H17 | 119.5° | 92.0° |
C16 | C20 | C4 | O1 | 17.1° | 18.3° |
C20 | C16 | O3 | C17 | 19.4° | 17.7° |
C20 | C16 | O3 | C5 | 113.8° | 107.6° |
C20 | C16 | O3 | H17 | 121.2° | 124.7° |
C20 | C16 | C5 | H17 | 121.5° | 123.3° |
C20 | C16 | C5 | O1 | 13.5° | 33.8° |
C20 | C16 | C5 | C6 | 103.7° | 152.9° |
C20 | C16 | C5 | H6 | 132.7° | 85.3° |
C4 | O1 | C5 | C16 | 26.2° | 23.7° |
C4 | O1 | C5 | C6 | 94.8° | 142.7° |
O1 | C4 | C3 | H4 | 28.3° | 156.2° |
O1 | C4 | C3 | H5 | 150.0° | 33.1° |
C4 | O1 | C5 | H6 | 144.5° | 95.5° |
O1 | C4 | C20 | H18 | 135.2° | 141.8° |
C18 | C17 | O3 | C16 | 145.2° | 122.6° |
C17 | C18 | H19 | H20 | 120.0° | 120.0° |
C17 | C18 | H19 | H21 | 120.0° | 120.0° |
C17 | C18 | H20 | H21 | 120.0° | 120.0° |
C18 | C17 | C19 | H22 | 57.2° | 179.6° |
C18 | C17 | C19 | H23 | 62.7° | 59.6° |
C18 | C17 | C19 | H24 | 177.3° | 60.4° |
C17 | O3 | C16 | C5 | 133.2° | 89.9° |
C17 | O3 | C16 | H17 | 101.8° | 142.3° |
O3 | C17 | C18 | H19 | 65.3° | 179.5° |
O3 | C17 | C18 | H20 | 54.7° | 60.6° |
O3 | C17 | C18 | H21 | 174.7° | 59.5° |
O3 | C17 | C19 | H22 | 65.0° | 59.4° |
O3 | C17 | C19 | H23 | 175.0° | 60.6° |
O3 | C17 | C19 | H24 | 55.1° | 179.4° |
O3 | C16 | C5 | H17 | 126.0° | 127.7° |
O3 | C16 | C5 | O1 | 99.0° | 142.8° |
O3 | C16 | C5 | C6 | 143.8° | 98.1° |
O3 | C16 | C5 | H6 | 20.3° | 23.7° |
O3 | C16 | C20 | H18 | 123.8° | 92.7° |
C16 | C5 | O1 | C6 | 121.0° | 119.1° |
C16 | C5 | O1 | H6 | 118.3° | 119.2° |
C16 | C5 | C6 | H6 | 123.4° | 121.9° |
C16 | C5 | C6 | N | 174.1° | 176.2° |
C16 | C5 | C6 | H7 | 53.4° | 56.2° |
C16 | C5 | C6 | H8 | 65.2° | 63.8° |
C5 | C16 | C20 | H18 | 120.1° | 154.0° |
O1 | C5 | C6 | H6 | 121.4° | 121.8° |
O1 | C5 | C6 | N | 70.7° | 67.5° |
O1 | C5 | C6 | H7 | 168.6° | 172.5° |
O1 | C5 | C6 | H8 | 49.9° | 52.5° |
O1 | C5 | C16 | H17 | 135.1° | 89.5° |
C5 | C6 | N | H7 | 120.7° | 120.0° |
C5 | C6 | N | H8 | 120.7° | 120.0° |
C5 | C6 | N | C7 | 92.1° | 180.0° |
C5 | C6 | H7 | H8 | 117.9° | 120.0° |
C5 | C6 | N | H16 | 145.9° | 0.0° |
C6 | C5 | C16 | H17 | 17.8° | 29.6° |
C6 | N | C7 | H16 | 121.9° | 180.0° |
C6 | N | C7 | N5 | 0.4° | 180.0° |
C6 | N | C7 | N1 | 176.2° | 0.6° |
N | C6 | C5 | H6 | 50.7° | 54.3° |
N | C6 | H7 | H8 | 117.9° | 120.0° |
N | C7 | N5 | N1 | 176.9° | 179.5° |
N | C7 | N5 | C15 | 176.2° | 180.0° |
N | C7 | N1 | C8 | 175.8° | 179.8° |
C7 | N | C6 | H7 | 28.6° | 60.0° |
C7 | N | C6 | H8 | 147.2° | 60.0° |
N | C7 | N1 | H14 | 4.2° | 0.1° |
N5 | C7 | N1 | C8 | 1.0° | 0.3° |
C7 | N5 | C15 | C8 | 0.0° | 0.5° |
C7 | N5 | C15 | C14 | 175.8° | 179.9° |
N5 | C7 | N1 | H14 | 179.0° | 179.6° |
N5 | C7 | N | H16 | 121.6° | 0.1° |
N1 | C7 | N5 | C15 | 0.7° | 0.5° |
C7 | N1 | C8 | H14 | 180.0° | 179.9° |
C7 | N1 | C8 | C15 | 1.0° | 0.0° |
C7 | N1 | C8 | C9 | 174.5° | 179.6° |
N1 | C7 | N | H16 | 61.9° | 179.4° |
N5 | C15 | C8 | N1 | 0.6° | 0.3° |
N5 | C15 | C8 | C14 | 176.3° | 179.6° |
N5 | C15 | C8 | C9 | 175.4° | 180.0° |
N5 | C15 | C14 | C13 | 172.9° | 179.9° |
N5 | C15 | C14 | H13 | 7.1° | 0.2° |
N1 | C8 | C15 | C9 | 176.0° | 179.6° |
N1 | C8 | C15 | C14 | 176.9° | 180.0° |
N1 | C8 | C9 | C10 | 173.4° | 179.6° |
N1 | C8 | C9 | H12 | 6.6° | 0.4° |
C8 | C15 | C14 | C13 | 2.3° | 0.4° |
C15 | C8 | C9 | C10 | 1.6° | 0.1° |
C15 | C8 | C9 | H12 | 178.3° | 180.0° |
C8 | C15 | C14 | H13 | 177.7° | 179.7° |
C15 | C8 | N1 | H14 | 179.1° | 180.0° |
C14 | C15 | C8 | C9 | 0.9° | 0.4° |
C15 | C14 | C13 | H13 | 180.0° | 179.9° |
C15 | C14 | C13 | C10 | 1.1° | 0.0° |
C15 | C14 | C13 | N4 | 174.9° | 180.0° |
C8 | C9 | C10 | H12 | 180.0° | 180.0° |
C8 | C9 | C10 | C13 | 2.8° | 0.3° |
C8 | C9 | C10 | C11 | 173.6° | 180.0° |
C9 | C8 | N1 | H14 | 5.5° | 0.5° |
C14 | C13 | C10 | C9 | 1.4° | 0.3° |
C14 | C13 | C10 | N4 | 175.8° | 180.0° |
C14 | C13 | C10 | C11 | 175.0° | 180.0° |
C14 | C13 | N4 | C12 | 174.1° | 180.0° |
C9 | C10 | C13 | C11 | 176.5° | 179.7° |
C9 | C10 | C13 | N4 | 177.2° | 179.7° |
C9 | C10 | C11 | O2 | 4.5° | 0.2° |
C9 | C10 | C11 | N2 | 175.5° | 179.7° |
C10 | C13 | N4 | C12 | 1.9° | 0.0° |
C13 | C10 | C11 | O2 | 179.0° | 179.9° |
C13 | C10 | C11 | N2 | 1.0° | 0.0° |
C13 | C10 | C9 | H12 | 177.2° | 179.7° |
C10 | C13 | C14 | H13 | 178.9° | 179.9° |
N4 | C13 | C10 | C11 | 0.8° | 0.0° |
C13 | N4 | C12 | N2 | 1.1° | 0.0° |
C13 | N4 | C12 | N3 | 178.6° | 180.0° |
N4 | C13 | C14 | H13 | 5.1° | 0.1° |
C10 | C11 | O2 | N2 | 180.0° | 179.9° |
C10 | C11 | N2 | C12 | 1.8° | 0.0° |
C10 | C11 | N2 | H9 | 178.1° | 180.0° |
C11 | C10 | C9 | H12 | 6.4° | 0.0° |
N4 | C12 | N2 | C11 | 0.8° | 0.0° |
N4 | C12 | N2 | N3 | 179.8° | 180.0° |
N4 | C12 | N2 | H9 | 179.2° | 180.0° |
N4 | C12 | N3 | H10 | 0.0° | 180.0° |
N4 | C12 | N3 | H11 | 180.0° | 0.0° |
O2 | C11 | N2 | C12 | 178.2° | 179.9° |
O2 | C11 | N2 | H9 | 1.9° | 0.1° |
C11 | N2 | C12 | H9 | 180.0° | 180.0° |
C11 | N2 | C12 | N3 | 179.4° | 180.0° |
N2 | C12 | N3 | H10 | 179.8° | 0.0° |
N2 | C12 | N3 | H11 | 0.2° | 180.0° |
N3 | C12 | N2 | H9 | 0.6° | 0.0° |
C12 | N3 | H10 | H11 | 180.0° | 179.9° |
H1 | C2 | H2 | H3 | 120.0° | 120.0° |
H6 | C5 | C6 | H7 | 70.0° | 65.7° |
H6 | C5 | C6 | H8 | 171.3° | 174.3° |
H6 | C5 | C16 | H17 | 105.7° | 151.4° |
H7 | C6 | N | H16 | 93.4° | 120.0° |
H8 | C6 | N | H16 | 25.3° | 120.0° |
H17 | C16 | C20 | H18 | 1.5° | 31.3° |
H19 | C18 | H20 | H21 | 120.0° | 120.0° |
H22 | C19 | H23 | H24 | 120.0° | 120.1° |
H25 | C | H26 | H27 | 120.0° | 120.0° |