LB5
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
C | C1 | sing | 1.51Å | 1.50Å | |
C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
C1 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
N1 | C9 | doub | 1.31Å | 1.32Å | Aromatic |
N1 | N | sing | 1.40Å | 1.37Å | Aromatic |
C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
C6 | C5 | sing | 1.39Å | 1.40Å | Aromatic |
C6 | N | sing | 1.40Å | 1.44Å | |
C9 | C8 | sing | 1.41Å | 1.41Å | Aromatic |
N | C7 | sing | 1.34Å | 1.35Å | Aromatic |
C8 | C7 | doub | 1.38Å | 1.38Å | Aromatic |
C8 | C10 | sing | 1.47Å | 1.48Å | |
N2 | C10 | sing | 1.35Å | 1.34Å | |
N2 | C11 | sing | 1.47Å | 1.45Å | |
C10 | O2 | doub | 1.22Å | 1.23Å | |
C11 | C12 | sing | 1.51Å | 1.50Å | |
C12 | S | sing | 1.71Å | 1.76Å | Aromatic |
C12 | N3 | doub | 1.29Å | 1.31Å | Aromatic |
S | C14 | sing | 1.76Å | 1.73Å | Aromatic |
N3 | C13 | sing | 1.31Å | 1.39Å | Aromatic |
C21 | C22 | sing | 1.53Å | 1.52Å | |
C21 | C20 | sing | 1.53Å | 1.54Å | |
C14 | C13 | doub | 1.36Å | 1.36Å | Aromatic |
C14 | C15 | sing | 1.47Å | 1.49Å | |
O1 | C15 | doub | 1.22Å | 1.22Å | |
C22 | C23 | sing | 1.53Å | 1.49Å | |
C20 | C19 | sing | 1.53Å | 1.53Å | |
C15 | N4 | sing | 1.35Å | 1.34Å | |
C23 | C24 | sing | 1.53Å | 1.52Å | |
N4 | C16 | sing | 1.47Å | 1.47Å | |
C19 | C24 | sing | 1.53Å | 1.52Å | |
C19 | C18 | sing | 1.53Å | 1.56Å | |
C17 | C18 | sing | 1.53Å | 1.51Å | |
C17 | C16 | sing | 1.53Å | 1.54Å | |
C16 | C25 | sing | 1.51Å | 1.54Å | |
C25 | N5 | sing | 1.35Å | 1.34Å | |
C25 | O | doub | 1.21Å | 1.24Å | |
C2 | H1 | sing | 1.08Å | 1.08Å | |
C4 | H2 | sing | 1.08Å | 1.08Å | |
N4 | H3 | sing | 0.97Å | 1.00Å | |
C5 | H4 | sing | 1.08Å | 1.08Å | |
C7 | H5 | sing | 1.08Å | 1.08Å | |
C9 | H6 | sing | 1.08Å | 1.08Å | |
C3 | H7 | sing | 1.08Å | 1.08Å | |
C | H8 | sing | 1.09Å | 1.10Å | |
C | H9 | sing | 1.09Å | 1.10Å | |
C | H10 | sing | 1.09Å | 1.10Å | |
N2 | H11 | sing | 0.97Å | 1.00Å | |
C11 | H12 | sing | 1.09Å | 1.10Å | |
C11 | H13 | sing | 1.09Å | 1.10Å | |
C13 | H14 | sing | 1.08Å | 1.08Å | |
C16 | H15 | sing | 1.09Å | 1.10Å | |
N5 | H16 | sing | 0.97Å | 1.00Å | |
N5 | H17 | sing | 0.97Å | 1.00Å | |
C17 | H18 | sing | 1.09Å | 1.10Å | |
C17 | 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 | |
C24 | H23 | sing | 1.09Å | 1.10Å | |
C24 | H24 | sing | 1.09Å | 1.10Å | |
C23 | H25 | sing | 1.09Å | 1.10Å | |
C23 | H26 | sing | 1.09Å | 1.10Å | |
C22 | H27 | sing | 1.09Å | 1.10Å | |
C22 | H28 | sing | 1.09Å | 1.10Å | |
C21 | H29 | sing | 1.09Å | 1.10Å | |
C21 | H30 | sing | 1.09Å | 1.10Å | |
C20 | H31 | sing | 1.09Å | 1.10Å | |
C20 | H32 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C3 | C2 | C1 | 121.2° | 120.1° |
C2 | C3 | C4 | 120.2° | 120.1° |
C3 | C2 | H1 | 119.4° | 120.0° |
C2 | C3 | H7 | 119.9° | 120.0° |
C2 | C1 | C | 120.2° | 120.0° |
C2 | C1 | C6 | 117.5° | 120.0° |
C1 | C2 | H1 | 119.4° | 119.9° |
C | C1 | C6 | 122.2° | 120.0° |
C1 | C | H8 | 109.5° | 109.5° |
C1 | C | H9 | 109.5° | 109.4° |
C1 | C | H10 | 109.5° | 109.4° |
C3 | C4 | C5 | 120.2° | 120.0° |
C3 | C4 | H2 | 119.9° | 120.0° |
C4 | C3 | H7 | 119.9° | 119.9° |
C1 | C6 | C5 | 121.7° | 119.8° |
C1 | C6 | N | 119.2° | 120.1° |
C9 | N1 | N | 104.2° | 108.9° |
N1 | C9 | C8 | 112.4° | 108.1° |
N1 | C9 | H6 | 123.8° | 126.0° |
N1 | N | C6 | 119.6° | 125.7° |
N1 | N | C7 | 112.1° | 108.5° |
C4 | C5 | C6 | 119.1° | 120.0° |
C5 | C4 | H2 | 119.9° | 120.0° |
C4 | C5 | H4 | 120.4° | 120.0° |
C5 | C6 | N | 119.0° | 120.1° |
C6 | C5 | H4 | 120.4° | 120.0° |
C6 | N | C7 | 128.1° | 125.8° |
C9 | C8 | C7 | 104.0° | 107.2° |
C9 | C8 | C10 | 131.8° | 126.4° |
C8 | C9 | H6 | 123.8° | 126.0° |
N | C7 | C8 | 107.2° | 107.4° |
N | C7 | H5 | 126.4° | 126.3° |
C7 | C8 | C10 | 124.2° | 126.4° |
C8 | C7 | H5 | 126.4° | 126.3° |
C8 | C10 | N2 | 116.7° | 120.0° |
C8 | C10 | O2 | 120.7° | 120.0° |
C10 | N2 | C11 | 121.4° | 120.0° |
N2 | C10 | O2 | 122.4° | 120.0° |
C10 | N2 | H11 | 119.3° | 120.0° |
N2 | C11 | C12 | 115.7° | 109.5° |
C11 | N2 | H11 | 119.3° | 120.0° |
N2 | C11 | H12 | 107.9° | 109.5° |
N2 | C11 | H13 | 107.9° | 109.5° |
C11 | C12 | S | 121.4° | 124.8° |
C11 | C12 | N3 | 122.8° | 124.8° |
C12 | C11 | H12 | 107.9° | 109.5° |
C12 | C11 | H13 | 107.9° | 109.4° |
S | C12 | N3 | 115.7° | 110.4° |
C12 | S | C14 | 87.9° | 90.3° |
C12 | N3 | C13 | 109.5° | 117.4° |
S | C14 | C13 | 110.8° | 107.7° |
S | C14 | C15 | 118.5° | 126.1° |
N3 | C13 | C14 | 116.0° | 114.2° |
N3 | C13 | H14 | 122.0° | 122.9° |
C22 | C21 | C20 | 110.8° | 109.5° |
C21 | C22 | C23 | 110.6° | 109.4° |
C21 | C22 | H27 | 109.2° | 109.5° |
C21 | C22 | H28 | 109.2° | 109.5° |
C22 | C21 | H29 | 109.1° | 109.5° |
C22 | C21 | H30 | 109.1° | 109.5° |
C21 | C20 | C19 | 111.5° | 109.5° |
C20 | C21 | H29 | 109.1° | 109.4° |
C20 | C21 | H30 | 109.2° | 109.5° |
C21 | C20 | H31 | 109.0° | 109.5° |
C21 | C20 | H32 | 109.0° | 109.5° |
C13 | C14 | C15 | 130.6° | 126.1° |
C14 | C13 | H14 | 122.0° | 122.9° |
C14 | C15 | O1 | 121.1° | 120.0° |
C14 | C15 | N4 | 116.0° | 120.0° |
O1 | C15 | N4 | 122.7° | 120.0° |
C22 | C23 | C24 | 111.6° | 109.5° |
C22 | C23 | H25 | 109.0° | 109.4° |
C22 | C23 | H26 | 108.9° | 109.5° |
C23 | C22 | H27 | 109.2° | 109.5° |
C23 | C22 | H28 | 109.2° | 109.5° |
C20 | C19 | C24 | 109.2° | 109.4° |
C20 | C19 | C18 | 114.2° | 109.5° |
C20 | C19 | H22 | 107.7° | 109.5° |
C19 | C20 | H31 | 109.0° | 109.5° |
C19 | C20 | H32 | 109.0° | 109.5° |
C15 | N4 | C16 | 122.1° | 119.9° |
C15 | N4 | H3 | 118.9° | 120.0° |
C23 | C24 | C19 | 112.8° | 109.5° |
C23 | C24 | H23 | 108.6° | 109.5° |
C23 | C24 | H24 | 108.6° | 109.5° |
C24 | C23 | H25 | 108.9° | 109.5° |
C24 | C23 | H26 | 108.9° | 109.5° |
N4 | C16 | C17 | 108.5° | 109.4° |
N4 | C16 | C25 | 109.4° | 109.4° |
C16 | N4 | H3 | 119.0° | 120.0° |
N4 | C16 | H15 | 108.9° | 109.5° |
C24 | C19 | C18 | 110.2° | 109.5° |
C24 | C19 | H22 | 107.8° | 109.4° |
C19 | C24 | H23 | 108.6° | 109.5° |
C19 | C24 | H24 | 108.6° | 109.4° |
C19 | C18 | C17 | 117.7° | 109.4° |
C19 | C18 | H20 | 107.4° | 109.5° |
C19 | C18 | H21 | 107.4° | 109.5° |
C18 | C19 | H22 | 107.5° | 109.6° |
C18 | C17 | C16 | 117.5° | 109.5° |
C18 | C17 | H18 | 107.4° | 109.5° |
C18 | C17 | H19 | 107.4° | 109.5° |
C17 | C18 | H20 | 107.4° | 109.5° |
C17 | C18 | H21 | 107.4° | 109.4° |
C17 | C16 | C25 | 113.8° | 109.4° |
C17 | C16 | H15 | 108.0° | 109.5° |
C16 | C17 | H18 | 107.5° | 109.5° |
C16 | C17 | H19 | 107.4° | 109.4° |
C16 | C25 | N5 | 117.0° | 120.0° |
C16 | C25 | O | 120.1° | 120.1° |
C25 | C16 | H15 | 108.1° | 109.5° |
N5 | C25 | O | 122.6° | 120.0° |
C25 | N5 | H16 | 120.0° | 120.0° |
C25 | N5 | H17 | 120.0° | 120.0° |
H8 | C | H9 | 109.4° | 109.5° |
H8 | C | H10 | 109.5° | 109.5° |
H9 | C | H10 | 109.5° | 109.5° |
H12 | C11 | H13 | 109.5° | 109.5° |
H16 | N5 | H17 | 120.0° | 120.0° |
H18 | C17 | H19 | 109.5° | 109.5° |
H20 | C18 | H21 | 109.5° | 109.5° |
H23 | C24 | H24 | 109.5° | 109.4° |
H25 | C23 | H26 | 109.5° | 109.5° |
H27 | C22 | H28 | 109.5° | 109.5° |
H29 | C21 | H30 | 109.5° | 109.4° |
H31 | C20 | H32 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C3 | C2 | C1 | H1 | 180.0° | 179.6° |
C3 | C2 | C1 | C | 177.1° | 180.0° |
C2 | C3 | C4 | H7 | 180.0° | 180.0° |
C3 | C2 | C1 | C6 | 0.2° | 0.1° |
C2 | C3 | C4 | C5 | 0.3° | 0.0° |
C2 | C3 | C4 | H2 | 179.7° | 180.0° |
C2 | C1 | C | C6 | 177.1° | 179.9° |
C1 | C2 | C3 | C4 | 0.5° | 0.1° |
C2 | C1 | C6 | C5 | 1.0° | 0.1° |
C2 | C1 | C6 | N | 176.8° | 180.0° |
C1 | C2 | C3 | H7 | 179.5° | 179.9° |
C2 | C1 | C | H8 | 88.6° | 95.2° |
C2 | C1 | C | H9 | 151.4° | 144.7° |
C2 | C1 | C | H10 | 31.4° | 24.8° |
C | C1 | C6 | C5 | 176.1° | 180.0° |
C | C1 | C6 | N | 6.1° | 0.1° |
C | C1 | C2 | H1 | 2.9° | 0.3° |
C1 | C | H8 | H9 | 120.0° | 120.0° |
C1 | C | H8 | H10 | 120.0° | 120.0° |
C1 | C | H9 | H10 | 120.0° | 119.9° |
C3 | C4 | C5 | H2 | 180.0° | 180.0° |
C3 | C4 | C5 | C6 | 0.6° | 0.0° |
C4 | C3 | C2 | H1 | 179.5° | 179.7° |
C3 | C4 | C5 | H4 | 179.4° | 180.0° |
C1 | C6 | N | N1 | 76.3° | 47.4° |
C1 | C6 | C5 | C4 | 1.2° | 0.0° |
C1 | C6 | C5 | N | 177.8° | 179.9° |
C1 | C6 | N | C7 | 109.3° | 132.6° |
C6 | C1 | C2 | H1 | 179.8° | 179.7° |
C1 | C6 | C5 | H4 | 178.7° | 180.0° |
C6 | C1 | C | H8 | 88.5° | 84.7° |
C6 | C1 | C | H9 | 31.5° | 35.4° |
C6 | C1 | C | H10 | 151.5° | 155.3° |
C9 | N1 | N | C6 | 172.2° | 180.0° |
N1 | C9 | C8 | H6 | 180.0° | 180.0° |
C9 | N1 | N | C7 | 3.0° | 0.0° |
N1 | C9 | C8 | C7 | 0.2° | 0.0° |
N1 | C9 | C8 | C10 | 179.0° | 180.0° |
N1 | N | C6 | C5 | 101.6° | 132.7° |
N1 | N | C6 | C7 | 174.4° | 180.0° |
N | N1 | C9 | C8 | 1.9° | 0.0° |
N1 | N | C7 | C8 | 3.0° | 0.0° |
N1 | N | C7 | H5 | 177.0° | 180.0° |
N | N1 | C9 | H6 | 178.1° | 180.0° |
C4 | C5 | C6 | H4 | 180.0° | 180.0° |
C4 | C5 | C6 | N | 176.5° | 180.0° |
C5 | C4 | C3 | H7 | 179.7° | 180.0° |
C5 | C6 | N | C7 | 72.8° | 47.3° |
C6 | C5 | C4 | H2 | 179.4° | 180.0° |
C6 | N | C7 | C8 | 171.8° | 180.0° |
N | C6 | C5 | H4 | 3.5° | 0.0° |
C6 | N | C7 | H5 | 8.2° | 0.0° |
C9 | C8 | C7 | N | 1.7° | 0.0° |
C9 | C8 | C7 | C10 | 178.9° | 180.0° |
C9 | C8 | C10 | N2 | 3.1° | 0.0° |
C9 | C8 | C10 | O2 | 173.1° | 180.0° |
C9 | C8 | C7 | H5 | 178.4° | 180.0° |
N | C7 | C8 | H5 | 180.0° | 179.9° |
N | C7 | C8 | C10 | 177.3° | 180.0° |
C7 | C8 | C10 | N2 | 175.5° | 180.0° |
C7 | C8 | C10 | O2 | 8.3° | 0.0° |
C7 | C8 | C9 | H6 | 179.8° | 180.0° |
C8 | C10 | N2 | O2 | 176.2° | 180.0° |
C8 | C10 | N2 | C11 | 170.8° | 180.0° |
C10 | C8 | C7 | H5 | 2.7° | 0.0° |
C10 | C8 | C9 | H6 | 1.0° | 0.0° |
C8 | C10 | N2 | H11 | 9.2° | 0.0° |
C10 | N2 | C11 | H11 | 180.0° | 180.0° |
C10 | N2 | C11 | C12 | 93.3° | 180.0° |
C10 | N2 | C11 | H12 | 145.8° | 60.0° |
C10 | N2 | C11 | H13 | 27.6° | 60.1° |
C11 | N2 | C10 | O2 | 5.4° | 0.1° |
N2 | C11 | C12 | H12 | 120.9° | 120.0° |
N2 | C11 | C12 | H13 | 120.9° | 120.0° |
N2 | C11 | C12 | S | 8.8° | 90.0° |
N2 | C11 | C12 | N3 | 173.0° | 90.0° |
N2 | C11 | H12 | H13 | 117.2° | 120.0° |
O2 | C10 | N2 | H11 | 174.6° | 180.0° |
C11 | C12 | S | N3 | 178.4° | 180.0° |
C11 | C12 | S | C14 | 177.0° | 180.0° |
C11 | C12 | N3 | C13 | 176.4° | 180.0° |
C12 | C11 | N2 | H11 | 86.7° | 0.0° |
C12 | C11 | H12 | H13 | 117.1° | 120.0° |
S | C12 | N3 | C13 | 2.0° | 0.0° |
C12 | S | C14 | C13 | 0.3° | 0.0° |
C12 | S | C14 | C15 | 178.3° | 180.0° |
S | C12 | C11 | H12 | 129.7° | 150.0° |
S | C12 | C11 | H13 | 112.2° | 30.0° |
N3 | C12 | S | C14 | 1.4° | 0.0° |
C12 | N3 | C13 | C14 | 1.7° | 0.1° |
N3 | C12 | C11 | H12 | 52.1° | 30.0° |
N3 | C12 | C11 | H13 | 66.1° | 150.0° |
C12 | N3 | C13 | H14 | 178.3° | 179.9° |
S | C14 | C13 | N3 | 0.7° | 0.1° |
S | C14 | C13 | C15 | 178.4° | 180.0° |
S | C14 | C15 | O1 | 9.9° | 179.9° |
S | C14 | C15 | N4 | 165.6° | 0.0° |
S | C14 | C13 | H14 | 179.3° | 179.9° |
N3 | C13 | C14 | H14 | 180.0° | 179.9° |
N3 | C13 | C14 | C15 | 179.1° | 180.0° |
C22 | C21 | C20 | H29 | 120.2° | 120.0° |
C22 | C21 | C20 | H30 | 120.2° | 120.1° |
C21 | C22 | C23 | H27 | 120.2° | 120.0° |
C21 | C22 | C23 | H28 | 120.2° | 120.0° |
C22 | C21 | C20 | C19 | 56.9° | 60.1° |
C21 | C22 | C23 | C24 | 56.2° | 60.0° |
C21 | C22 | C23 | H25 | 64.1° | 180.0° |
C21 | C22 | C23 | H26 | 176.5° | 60.0° |
C21 | C22 | H27 | H28 | 119.5° | 120.0° |
C22 | C21 | H29 | H30 | 119.4° | 120.0° |
C22 | C21 | C20 | H31 | 63.4° | 180.0° |
C22 | C21 | C20 | H32 | 177.3° | 59.9° |
C20 | C21 | C22 | C23 | 56.9° | 60.0° |
C21 | C20 | C19 | H31 | 120.3° | 120.0° |
C21 | C20 | C19 | H32 | 120.3° | 120.0° |
C21 | C20 | C19 | C24 | 54.6° | 60.0° |
C21 | C20 | C19 | C18 | 178.5° | 180.0° |
C21 | C20 | C19 | H22 | 62.2° | 59.9° |
C20 | C21 | C22 | H27 | 177.1° | 60.0° |
C20 | C21 | C22 | H28 | 63.2° | 180.0° |
C20 | C21 | H29 | H30 | 119.4° | 120.0° |
C21 | C20 | H31 | H32 | 119.1° | 120.0° |
C13 | C14 | C15 | O1 | 171.9° | 0.0° |
C13 | C14 | C15 | N4 | 12.7° | 180.0° |
C14 | C15 | O1 | N4 | 175.1° | 180.0° |
C14 | C15 | N4 | C16 | 173.5° | 180.0° |
C14 | C15 | N4 | H3 | 6.5° | 0.0° |
C15 | C14 | C13 | H14 | 0.9° | 0.1° |
O1 | C15 | N4 | C16 | 11.2° | 0.0° |
O1 | C15 | N4 | H3 | 168.8° | 179.9° |
C22 | C23 | C24 | H25 | 120.3° | 120.0° |
C22 | C23 | C24 | H26 | 120.3° | 120.0° |
C22 | C23 | C24 | C19 | 56.0° | 60.0° |
C22 | C23 | C24 | H23 | 176.5° | 60.0° |
C22 | C23 | C24 | H24 | 64.5° | 180.0° |
C22 | C23 | H25 | H26 | 119.0° | 119.9° |
C23 | C22 | H27 | H28 | 119.5° | 120.0° |
C23 | C22 | C21 | H29 | 177.1° | 180.0° |
C23 | C22 | C21 | H30 | 63.3° | 60.1° |
C20 | C19 | C24 | C23 | 54.2° | 60.0° |
C20 | C19 | C24 | C18 | 126.2° | 120.0° |
C20 | C19 | C24 | H22 | 116.8° | 119.9° |
C20 | C19 | C18 | H22 | 119.4° | 120.1° |
C20 | C19 | C18 | C17 | 52.0° | 65.1° |
C20 | C19 | C18 | H20 | 173.1° | 54.9° |
C20 | C19 | C18 | H21 | 69.2° | 175.0° |
C20 | C19 | C24 | H23 | 174.6° | 60.0° |
C20 | C19 | C24 | H24 | 66.3° | 180.0° |
C19 | C20 | C21 | H29 | 177.1° | 180.0° |
C19 | C20 | C21 | H30 | 63.2° | 60.0° |
C19 | C20 | H31 | H32 | 119.1° | 120.0° |
C15 | N4 | C16 | H3 | 180.0° | 179.9° |
C15 | N4 | C16 | C17 | 89.7° | 155.0° |
C15 | N4 | C16 | C25 | 145.6° | 85.1° |
C15 | N4 | C16 | H15 | 27.7° | 35.0° |
C23 | C24 | C19 | H23 | 120.5° | 120.0° |
C23 | C24 | C19 | H24 | 120.5° | 120.0° |
C23 | C24 | C19 | C18 | 179.6° | 180.0° |
C23 | C24 | C19 | H22 | 62.6° | 59.9° |
C23 | C24 | H23 | H24 | 118.5° | 120.0° |
C24 | C23 | H25 | H26 | 119.0° | 120.1° |
C24 | C23 | C22 | H27 | 176.4° | 60.0° |
C24 | C23 | C22 | H28 | 64.0° | 180.0° |
N4 | C16 | C17 | C18 | 171.6° | 65.1° |
N4 | C16 | C17 | C25 | 122.0° | 119.9° |
N4 | C16 | C17 | H15 | 117.9° | 120.0° |
N4 | C16 | C25 | H15 | 118.4° | 120.0° |
N4 | C16 | C25 | N5 | 76.9° | 180.0° |
N4 | C16 | C25 | O | 97.5° | 0.1° |
N4 | C16 | C17 | H18 | 67.3° | 54.9° |
N4 | C16 | C17 | H19 | 50.4° | 174.9° |
C24 | C19 | C18 | H22 | 117.2° | 120.0° |
C24 | C19 | C18 | C17 | 175.3° | 175.0° |
C24 | C19 | C18 | H20 | 63.5° | 65.0° |
C24 | C19 | C18 | H21 | 54.1° | 55.0° |
C19 | C24 | H23 | H24 | 118.5° | 119.9° |
C19 | C24 | C23 | H25 | 64.4° | 180.0° |
C19 | C24 | C23 | H26 | 176.3° | 60.0° |
C24 | C19 | C20 | H31 | 65.7° | 180.0° |
C24 | C19 | C20 | H32 | 174.9° | 60.0° |
C19 | C18 | C17 | H20 | 121.2° | 120.0° |
C19 | C18 | C17 | H21 | 121.2° | 120.0° |
C19 | C18 | C17 | C16 | 65.5° | 180.0° |
C19 | C18 | C17 | H18 | 173.4° | 60.0° |
C19 | C18 | C17 | H19 | 55.7° | 60.0° |
C19 | C18 | H20 | H21 | 116.3° | 120.1° |
C18 | C19 | C24 | H23 | 59.1° | 59.9° |
C18 | C19 | C24 | H24 | 59.9° | 60.0° |
C18 | C19 | C20 | H31 | 58.2° | 60.1° |
C18 | C19 | C20 | H32 | 61.2° | 60.0° |
C18 | C17 | C16 | H18 | 121.1° | 120.0° |
C18 | C17 | C16 | H19 | 121.1° | 120.0° |
C18 | C17 | C16 | C25 | 66.4° | 175.0° |
C18 | C17 | C16 | H15 | 53.6° | 55.0° |
C18 | C17 | H18 | H19 | 116.3° | 120.0° |
C17 | C18 | H20 | H21 | 116.3° | 119.9° |
C17 | C18 | C19 | H22 | 67.5° | 55.0° |
C17 | C16 | C25 | H15 | 120.0° | 120.1° |
C17 | C16 | C25 | N5 | 161.5° | 60.1° |
C17 | C16 | C25 | O | 24.0° | 120.0° |
C17 | C16 | N4 | H3 | 90.3° | 24.9° |
C16 | C17 | H18 | H19 | 116.4° | 120.0° |
C16 | C17 | C18 | H20 | 55.7° | 60.0° |
C16 | C17 | C18 | H21 | 173.3° | 60.0° |
C16 | C25 | N5 | O | 174.3° | 179.9° |
C25 | C16 | N4 | H3 | 34.4° | 95.0° |
C16 | C25 | N5 | H16 | 174.4° | 0.1° |
C16 | C25 | N5 | H17 | 5.7° | 180.0° |
C25 | C16 | C17 | H18 | 54.7° | 65.0° |
C25 | C16 | C17 | H19 | 172.5° | 55.1° |
N5 | C25 | C16 | H15 | 41.5° | 60.0° |
C25 | N5 | H16 | H17 | 180.0° | 179.9° |
O | C25 | C16 | H15 | 144.0° | 119.9° |
O | C25 | N5 | H16 | 0.0° | 180.0° |
O | C25 | N5 | H17 | 180.0° | 0.1° |
H1 | C2 | C3 | H7 | 0.5° | 0.3° |
H2 | C4 | C5 | H4 | 0.6° | 0.0° |
H2 | C4 | C3 | H7 | 0.3° | 0.0° |
H3 | N4 | C16 | H15 | 152.3° | 145.0° |
H8 | C | H9 | H10 | 120.0° | 120.0° |
H11 | N2 | C11 | H12 | 34.2° | 120.0° |
H11 | N2 | C11 | H13 | 152.4° | 120.0° |
H15 | C16 | C17 | H18 | 174.8° | 175.0° |
H15 | C16 | C17 | H19 | 67.5° | 65.0° |
H18 | C17 | C18 | H20 | 65.5° | NaN° |
H18 | C17 | C18 | H21 | 52.2° | 60.0° |
H19 | C17 | C18 | H20 | 176.8° | 60.0° |
H19 | C17 | C18 | H21 | 65.5° | 180.0° |
H20 | C18 | C19 | H22 | 53.7° | 175.0° |
H21 | C18 | C19 | H22 | 171.4° | 64.9° |
H22 | C19 | C24 | H23 | 57.9° | 180.0° |
H22 | C19 | C24 | H24 | 176.9° | 60.1° |
H22 | C19 | C20 | H31 | 177.4° | 60.1° |
H22 | C19 | C20 | H32 | 58.1° | 179.9° |
H23 | C24 | C23 | H25 | 56.1° | 60.0° |
H23 | C24 | C23 | H26 | 63.2° | 180.0° |
H24 | C24 | C23 | H25 | 175.1° | 60.0° |
H24 | C24 | C23 | H26 | 55.8° | 60.0° |
H25 | C23 | C22 | H27 | 56.1° | 60.0° |
H25 | C23 | C22 | H28 | 175.7° | 60.0° |
H26 | C23 | C22 | H27 | 63.3° | 180.0° |
H26 | C23 | C22 | H28 | 56.4° | 60.0° |
H27 | C22 | C21 | H29 | 62.7° | 60.0° |
H27 | C22 | C21 | H30 | 56.9° | 179.9° |
H28 | C22 | C21 | H29 | 56.9° | 60.0° |
H28 | C22 | C21 | H30 | 176.5° | 59.9° |
H29 | C21 | C20 | H31 | 56.8° | 60.0° |
H29 | C21 | C20 | H32 | 62.6° | 60.0° |
H30 | C21 | C20 | H31 | 176.5° | 59.9° |
H30 | C21 | C20 | H32 | 57.1° | 180.0° |