EOJ
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C9 | C3 | sing | 1.53Å | 1.51Å | |
C9 | C2 | sing | 1.53Å | 1.51Å | |
C29 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
C29 | C30 | sing | 1.38Å | 1.38Å | Aromatic |
C3 | C8 | sing | 1.53Å | 1.51Å | |
C3 | C4 | sing | 1.53Å | 1.51Å | |
C2 | C6 | sing | 1.53Å | 1.51Å | |
C2 | C1 | sing | 1.53Å | 1.51Å | |
C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
C30 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
C8 | C7 | sing | 1.53Å | 1.51Å | |
C6 | C7 | sing | 1.53Å | 1.51Å | |
C4 | C5 | sing | 1.53Å | 1.51Å | |
C1 | C5 | sing | 1.53Å | 1.50Å | |
C7 | C11 | sing | 1.53Å | 1.51Å | |
C27 | C26 | doub | 1.40Å | 1.38Å | Aromatic |
O33 | C22 | doub | 1.22Å | 1.22Å | |
C31 | C26 | sing | 1.40Å | 1.38Å | Aromatic |
C31 | CL3 | sing | 1.74Å | 1.74Å | |
C5 | C11 | sing | 1.53Å | 1.51Å | |
C5 | N10 | sing | 1.46Å | 1.44Å | |
C26 | C25 | sing | 1.48Å | 1.46Å | |
C22 | N10 | sing | 1.35Å | 1.37Å | |
C22 | C16 | sing | 1.48Å | 1.45Å | |
C15 | C16 | doub | 1.39Å | 1.37Å | Aromatic |
C15 | C14 | sing | 1.39Å | 1.37Å | Aromatic |
C25 | N24 | doub | 1.32Å | 1.32Å | Aromatic |
C25 | N21 | sing | 1.36Å | 1.37Å | Aromatic |
C16 | C17 | sing | 1.40Å | 1.38Å | Aromatic |
N24 | N23 | sing | 1.29Å | 1.37Å | Aromatic |
N21 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
N21 | C20 | sing | 1.38Å | 1.37Å | Aromatic |
C14 | C13 | doub | 1.41Å | 1.38Å | Aromatic |
C17 | C12 | doub | 1.36Å | 1.38Å | Aromatic |
N23 | C20 | doub | 1.32Å | 1.31Å | Aromatic |
C20 | C19 | sing | 1.41Å | 1.43Å | Aromatic |
C13 | C12 | sing | 1.40Å | 1.38Å | Aromatic |
C13 | N18 | sing | 1.35Å | 1.40Å | Aromatic |
C19 | N18 | doub | 1.31Å | 1.29Å | Aromatic |
C19 | C34 | sing | 1.51Å | 1.50Å | |
C4 | H1 | sing | 1.09Å | 1.10Å | |
C4 | H2 | sing | 1.09Å | 1.10Å | |
C6 | H3 | sing | 1.09Å | 1.10Å | |
C6 | H4 | sing | 1.09Å | 1.10Å | |
C7 | H5 | sing | 1.09Å | 1.10Å | |
C8 | H6 | sing | 1.09Å | 1.10Å | |
C8 | H7 | sing | 1.09Å | 1.10Å | |
C15 | H8 | sing | 1.08Å | 1.08Å | |
C17 | H9 | sing | 1.08Å | 1.08Å | |
C28 | H10 | sing | 1.08Å | 1.08Å | |
C29 | H11 | sing | 1.08Å | 1.08Å | |
C27 | H12 | sing | 1.08Å | 1.08Å | |
C12 | H13 | sing | 1.08Å | 1.08Å | |
C30 | H14 | sing | 1.08Å | 1.08Å | |
C9 | H15 | sing | 1.09Å | 1.10Å | |
C9 | H16 | sing | 1.09Å | 1.10Å | |
C11 | H17 | sing | 1.09Å | 1.10Å | |
C11 | H18 | sing | 1.09Å | 1.10Å | |
C1 | H19 | sing | 1.09Å | 1.10Å | |
C1 | H20 | sing | 1.09Å | 1.10Å | |
C2 | H21 | sing | 1.09Å | 1.10Å | |
C3 | H22 | sing | 1.09Å | 1.10Å | |
C34 | H23 | sing | 1.09Å | 1.10Å | |
C34 | H24 | sing | 1.09Å | 1.10Å | |
C34 | H25 | sing | 1.09Å | 1.10Å | |
N10 | H26 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C3 | C9 | C2 | 110.4° | 109.4° |
C9 | C3 | C8 | 109.6° | 109.5° |
C9 | C3 | C4 | 107.7° | 109.5° |
C3 | C9 | H15 | 109.3° | 109.5° |
C3 | C9 | H16 | 109.2° | 109.5° |
C9 | C3 | H22 | 110.1° | 109.4° |
C9 | C2 | C6 | 108.9° | 109.5° |
C9 | C2 | C1 | 109.7° | 109.5° |
C2 | C9 | H15 | 109.2° | 109.5° |
C2 | C9 | H16 | 109.3° | 109.5° |
C9 | C2 | H21 | 109.6° | 109.5° |
C28 | C29 | C30 | 119.7° | 120.3° |
C29 | C28 | C27 | 120.1° | 120.2° |
C29 | C28 | H10 | 119.9° | 119.9° |
C28 | C29 | H11 | 120.2° | 119.9° |
C29 | C30 | C31 | 119.7° | 120.1° |
C30 | C29 | H11 | 120.1° | 119.8° |
C29 | C30 | H14 | 120.2° | 119.9° |
C8 | C3 | C4 | 109.2° | 109.5° |
C3 | C8 | C7 | 109.8° | 109.5° |
C3 | C8 | H6 | 109.4° | 109.5° |
C3 | C8 | H7 | 109.4° | 109.5° |
C8 | C3 | H22 | 110.1° | 109.5° |
C3 | C4 | C5 | 111.1° | 109.4° |
C3 | C4 | H1 | 109.1° | 109.5° |
C3 | C4 | H2 | 109.1° | 109.5° |
C4 | C3 | H22 | 110.1° | 109.5° |
C6 | C2 | C1 | 109.4° | 109.5° |
C2 | C6 | C7 | 110.0° | 109.5° |
C2 | C6 | H3 | 109.3° | 109.5° |
C2 | C6 | H4 | 109.3° | 109.5° |
C6 | C2 | H21 | 109.6° | 109.4° |
C2 | C1 | C5 | 109.7° | 109.5° |
C2 | C1 | H19 | 109.4° | 109.5° |
C2 | C1 | H20 | 109.4° | 109.5° |
C1 | C2 | H21 | 109.6° | 109.5° |
C28 | C27 | C26 | 120.9° | 119.9° |
C27 | C28 | H10 | 119.9° | 119.9° |
C28 | C27 | H12 | 119.5° | 120.1° |
C30 | C31 | C26 | 121.4° | 119.8° |
C30 | C31 | CL3 | 116.1° | 120.1° |
C31 | C30 | H14 | 120.1° | 120.0° |
C8 | C7 | C6 | 109.6° | 109.5° |
C8 | C7 | C11 | 109.1° | 109.5° |
C8 | C7 | H5 | 109.7° | 109.5° |
C7 | C8 | H6 | 109.4° | 109.5° |
C7 | C8 | H7 | 109.4° | 109.4° |
C6 | C7 | C11 | 108.9° | 109.4° |
C7 | C6 | H3 | 109.3° | 109.4° |
C7 | C6 | H4 | 109.3° | 109.5° |
C6 | C7 | H5 | 109.8° | 109.5° |
C4 | C5 | C1 | 109.0° | 109.4° |
C4 | C5 | C11 | 109.1° | 109.5° |
C4 | C5 | N10 | 108.1° | 109.5° |
C5 | C4 | H1 | 109.1° | 109.4° |
C5 | C4 | H2 | 109.1° | 109.5° |
C1 | C5 | C11 | 108.6° | 109.5° |
C1 | C5 | N10 | 112.3° | 109.5° |
C5 | C1 | H19 | 109.4° | 109.4° |
C5 | C1 | H20 | 109.4° | 109.5° |
C7 | C11 | C5 | 110.5° | 109.5° |
C11 | C7 | H5 | 109.7° | 109.4° |
C7 | C11 | H17 | 109.2° | 109.4° |
C7 | C11 | H18 | 109.2° | 109.5° |
C27 | C26 | C31 | 118.2° | 119.7° |
C27 | C26 | C25 | 121.0° | 120.2° |
C26 | C27 | H12 | 119.5° | 120.0° |
O33 | C22 | N10 | 128.1° | 120.0° |
O33 | C22 | C16 | 123.2° | 120.0° |
C26 | C31 | CL3 | 122.6° | 120.1° |
C31 | C26 | C25 | 120.7° | 120.1° |
C11 | C5 | N10 | 109.6° | 109.5° |
C5 | C11 | H17 | 109.2° | 109.5° |
C5 | C11 | H18 | 109.2° | 109.5° |
C5 | N10 | C22 | 121.6° | 120.0° |
C5 | N10 | H26 | 119.2° | 120.0° |
C26 | C25 | N24 | 120.9° | 126.4° |
C26 | C25 | N21 | 130.7° | 126.4° |
N10 | C22 | C16 | 108.5° | 120.0° |
C22 | N10 | H26 | 119.2° | 119.9° |
C22 | C16 | C15 | 117.2° | 119.9° |
C22 | C16 | C17 | 120.1° | 119.9° |
C16 | C15 | C14 | 117.4° | 119.7° |
C15 | C16 | C17 | 122.7° | 120.1° |
C16 | C15 | H8 | 121.3° | 120.1° |
C15 | C14 | N21 | 120.7° | 121.1° |
C15 | C14 | C13 | 122.0° | 119.8° |
C14 | C15 | H8 | 121.3° | 120.1° |
N24 | C25 | N21 | 108.1° | 107.2° |
C25 | N24 | N23 | 109.1° | 110.0° |
C25 | N21 | C14 | 134.7° | 134.8° |
C25 | N21 | C20 | 105.9° | 106.1° |
C16 | C17 | C12 | 118.4° | 120.5° |
C16 | C17 | H9 | 120.8° | 119.7° |
N24 | N23 | C20 | 106.8° | 109.8° |
C14 | N21 | C20 | 119.5° | 119.1° |
N21 | C14 | C13 | 117.3° | 119.1° |
N21 | C20 | N23 | 110.1° | 106.9° |
N21 | C20 | C19 | 120.4° | 119.4° |
C14 | C13 | C12 | 118.7° | 119.7° |
C14 | C13 | N18 | 123.1° | 120.1° |
C17 | C12 | C13 | 120.8° | 120.2° |
C12 | C17 | H9 | 120.8° | 119.8° |
C17 | C12 | H13 | 119.6° | 119.9° |
N23 | C20 | C19 | 129.6° | 133.7° |
C20 | C19 | N18 | 121.1° | 120.8° |
C20 | C19 | C34 | 117.8° | 119.6° |
C12 | C13 | N18 | 118.2° | 120.3° |
C13 | C12 | H13 | 119.6° | 120.0° |
C13 | N18 | C19 | 118.7° | 121.5° |
N18 | C19 | C34 | 121.1° | 119.6° |
C19 | C34 | H23 | 109.5° | 109.5° |
C19 | C34 | H24 | 109.5° | 109.4° |
C19 | C34 | H25 | 109.5° | 109.5° |
H1 | C4 | H2 | 109.5° | 109.5° |
H3 | C6 | H4 | 109.5° | 109.4° |
H6 | C8 | H7 | 109.4° | 109.5° |
H15 | C9 | H16 | 109.5° | 109.5° |
H17 | C11 | H18 | 109.5° | 109.5° |
H19 | C1 | H20 | 109.4° | 109.5° |
H23 | C34 | H24 | 109.4° | 109.5° |
H23 | C34 | H25 | 109.5° | 109.5° |
H24 | C34 | H25 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C3 | C9 | C2 | H15 | 120.1° | 120.0° |
C3 | C9 | C2 | H16 | 120.1° | 120.0° |
C9 | C3 | C8 | C4 | 117.8° | 120.1° |
C9 | C3 | C8 | H22 | 121.2° | 120.0° |
C9 | C3 | C4 | H22 | 120.0° | 119.9° |
C3 | C9 | C2 | C6 | 59.6° | 60.0° |
C3 | C9 | C2 | C1 | 60.1° | 60.0° |
C9 | C3 | C8 | C7 | 58.3° | 60.0° |
C9 | C3 | C4 | C5 | 60.2° | 60.0° |
C9 | C3 | C4 | H1 | 179.6° | 59.9° |
C9 | C3 | C4 | H2 | 60.1° | 180.0° |
C9 | C3 | C8 | H6 | 61.8° | 180.0° |
C9 | C3 | C8 | H7 | 178.4° | 60.0° |
C3 | C9 | H15 | H16 | 119.6° | 120.0° |
C3 | C9 | C2 | H21 | 179.5° | 180.0° |
C2 | C9 | C3 | C8 | 59.0° | 60.0° |
C2 | C9 | C3 | C4 | 59.7° | 60.0° |
C9 | C2 | C6 | C1 | 119.9° | 120.0° |
C9 | C2 | C6 | H21 | 119.9° | 120.0° |
C9 | C2 | C1 | H21 | 120.4° | 120.0° |
C9 | C2 | C6 | C7 | 60.1° | 60.0° |
C9 | C2 | C1 | C5 | 59.1° | 60.0° |
C9 | C2 | C6 | H3 | 179.8° | 60.0° |
C9 | C2 | C6 | H4 | 60.0° | 180.0° |
C2 | C9 | H15 | H16 | 119.6° | 120.1° |
C9 | C2 | C1 | H19 | 61.0° | 180.0° |
C9 | C2 | C1 | H20 | 179.2° | 60.0° |
C2 | C9 | C3 | H22 | 179.8° | 180.0° |
C28 | C29 | C30 | H11 | 180.0° | 179.7° |
C29 | C28 | C27 | H10 | 180.0° | 180.0° |
C28 | C29 | C30 | C31 | 0.4° | 0.3° |
C29 | C28 | C27 | C26 | 0.8° | 0.0° |
C29 | C28 | C27 | H12 | 179.2° | 180.0° |
C28 | C29 | C30 | H14 | 179.6° | 180.0° |
C30 | C29 | C28 | C27 | 0.1° | 0.3° |
C29 | C30 | C31 | H14 | 180.0° | 179.7° |
C29 | C30 | C31 | C26 | 0.1° | 0.0° |
C29 | C30 | C31 | CL3 | 179.8° | 180.0° |
C30 | C29 | C28 | H10 | 179.9° | 179.8° |
C8 | C3 | C4 | H22 | 121.0° | 120.0° |
C3 | C8 | C7 | H6 | 120.1° | 120.0° |
C3 | C8 | C7 | H7 | 120.1° | 120.0° |
C3 | C8 | C7 | C6 | 59.1° | 59.9° |
C8 | C3 | C4 | C5 | 58.8° | 60.0° |
C3 | C8 | C7 | C11 | 60.1° | 60.0° |
C8 | C3 | C4 | H1 | 61.4° | 180.0° |
C8 | C3 | C4 | H2 | 179.1° | 60.0° |
C3 | C8 | C7 | H5 | 179.7° | 180.0° |
C3 | C8 | H6 | H7 | 119.8° | 120.0° |
C8 | C3 | C9 | H15 | 179.1° | 60.0° |
C8 | C3 | C9 | H16 | 61.2° | 180.0° |
C4 | C3 | C8 | C7 | 59.5° | 60.1° |
C3 | C4 | C5 | H1 | 120.2° | 120.0° |
C3 | C4 | C5 | H2 | 120.3° | 120.0° |
C3 | C4 | C5 | C1 | 60.4° | 60.0° |
C3 | C4 | C5 | C11 | 58.1° | 60.0° |
C3 | C4 | C5 | N10 | 177.3° | 180.0° |
C3 | C4 | H1 | H2 | 119.3° | 120.1° |
C4 | C3 | C8 | H6 | 179.5° | 60.0° |
C4 | C3 | C8 | H7 | 60.6° | 180.0° |
C4 | C3 | C9 | H15 | 60.4° | 179.9° |
C4 | C3 | C9 | H16 | 179.9° | 59.9° |
C6 | C2 | C1 | H21 | 120.2° | 120.0° |
C2 | C6 | C7 | C8 | 60.2° | 60.0° |
C2 | C6 | C7 | H3 | 120.1° | 120.0° |
C2 | C6 | C7 | H4 | 120.1° | 120.0° |
C6 | C2 | C1 | C5 | 60.3° | 60.0° |
C2 | C6 | C7 | C11 | 59.1° | 60.0° |
C2 | C6 | H3 | H4 | 119.8° | 120.0° |
C2 | C6 | C7 | H5 | 179.2° | 180.0° |
C6 | C2 | C9 | H15 | 179.7° | 60.0° |
C6 | C2 | C9 | H16 | 60.6° | 180.0° |
C6 | C2 | C1 | H19 | 179.7° | 60.0° |
C6 | C2 | C1 | H20 | 59.8° | 180.0° |
C1 | C2 | C6 | C7 | 59.8° | 60.0° |
C2 | C1 | C5 | C4 | 58.7° | 60.0° |
C2 | C1 | C5 | H19 | 120.1° | 120.0° |
C2 | C1 | C5 | H20 | 120.0° | 120.0° |
C2 | C1 | C5 | C11 | 60.1° | 60.0° |
C2 | C1 | C5 | N10 | 178.5° | 180.0° |
C1 | C2 | C6 | H3 | 60.3° | 180.0° |
C1 | C2 | C6 | H4 | 179.8° | 60.0° |
C1 | C2 | C9 | H15 | 60.0° | 180.0° |
C1 | C2 | C9 | H16 | 179.7° | 59.9° |
C2 | C1 | H19 | H20 | 119.9° | 120.0° |
C28 | C27 | C26 | H12 | 180.0° | 180.0° |
C28 | C27 | C26 | C31 | 1.1° | 0.2° |
C28 | C27 | C26 | C25 | 177.8° | 180.0° |
C27 | C28 | C29 | H11 | 180.0° | 180.0° |
C30 | C31 | C26 | C27 | 0.6° | 0.2° |
C30 | C31 | C26 | CL3 | 179.9° | 179.9° |
C30 | C31 | C26 | C25 | 177.4° | 180.0° |
C31 | C30 | C29 | H11 | 179.6° | 180.0° |
C8 | C7 | C6 | C11 | 119.3° | 120.0° |
C8 | C7 | C6 | H5 | 120.5° | 120.1° |
C8 | C7 | C11 | H5 | 120.2° | 120.1° |
C8 | C7 | C11 | C5 | 59.9° | 60.0° |
C8 | C7 | C6 | H3 | 179.7° | 60.0° |
C8 | C7 | C6 | H4 | 59.8° | 180.0° |
C7 | C8 | H6 | H7 | 119.8° | 120.0° |
C8 | C7 | C11 | H17 | 179.9° | 60.0° |
C8 | C7 | C11 | H18 | 60.2° | 180.0° |
C7 | C8 | C3 | H22 | 179.5° | 179.9° |
C6 | C7 | C11 | H5 | 120.2° | 120.0° |
C6 | C7 | C11 | C5 | 59.7° | 60.0° |
C7 | C6 | H3 | H4 | 119.8° | 120.0° |
C6 | C7 | C8 | H6 | 61.0° | 180.0° |
C6 | C7 | C8 | H7 | 179.2° | 60.0° |
C6 | C7 | C11 | H17 | 60.4° | 180.0° |
C6 | C7 | C11 | H18 | 179.9° | 60.0° |
C7 | C6 | C2 | H21 | 180.0° | 180.0° |
C4 | C5 | C1 | C11 | 118.8° | 120.0° |
C4 | C5 | C1 | N10 | 119.8° | 120.0° |
C4 | C5 | C11 | C7 | 58.5° | 60.0° |
C4 | C5 | C11 | N10 | 118.2° | 120.0° |
C4 | C5 | N10 | C22 | 75.0° | 180.0° |
C5 | C4 | H1 | H2 | 119.3° | 120.0° |
C4 | C5 | C11 | H17 | 178.7° | 60.0° |
C4 | C5 | C11 | H18 | 61.6° | 180.0° |
C4 | C5 | C1 | H19 | 61.4° | 180.0° |
C4 | C5 | C1 | H20 | 178.7° | 60.0° |
C5 | C4 | C3 | H22 | 179.8° | 180.0° |
C4 | C5 | N10 | H26 | 105.0° | 0.0° |
C1 | C5 | C11 | C7 | 60.2° | 60.0° |
C1 | C5 | C11 | N10 | 123.1° | 120.0° |
C1 | C5 | N10 | C22 | 45.3° | 60.0° |
C1 | C5 | C4 | H1 | 179.4° | 60.0° |
C1 | C5 | C4 | H2 | 59.9° | 180.0° |
C1 | C5 | C11 | H17 | 59.9° | 179.9° |
C1 | C5 | C11 | H18 | 179.6° | 60.0° |
C5 | C1 | H19 | H20 | 119.9° | 120.0° |
C5 | C1 | C2 | H21 | 179.5° | 180.0° |
C1 | C5 | N10 | H26 | 134.7° | 120.0° |
C7 | C11 | C5 | H17 | 120.2° | 119.9° |
C7 | C11 | C5 | H18 | 120.1° | 120.0° |
C7 | C11 | C5 | N10 | 176.7° | 180.0° |
C11 | C7 | C6 | H3 | 60.9° | 180.0° |
C11 | C7 | C6 | H4 | 179.2° | 60.0° |
C11 | C7 | C8 | H6 | 179.8° | 60.0° |
C11 | C7 | C8 | H7 | 59.9° | 180.0° |
C7 | C11 | H17 | H18 | 119.5° | 120.0° |
C27 | C26 | C31 | C25 | 176.8° | 179.7° |
C27 | C26 | C31 | CL3 | 179.5° | 179.7° |
C27 | C26 | C25 | N24 | 64.6° | 89.9° |
C27 | C26 | C25 | N21 | 123.1° | 90.0° |
C26 | C27 | C28 | H10 | 179.2° | 180.0° |
O33 | C22 | N10 | C5 | 2.6° | 0.1° |
O33 | C22 | N10 | C16 | 175.3° | 180.0° |
O33 | C22 | C16 | C15 | 40.7° | 0.0° |
O33 | C22 | C16 | C17 | 140.8° | 179.8° |
O33 | C22 | N10 | H26 | 177.4° | 180.0° |
C31 | C26 | C25 | N24 | 112.1° | 89.8° |
C31 | C26 | C25 | N21 | 60.2° | 90.2° |
C31 | C26 | C27 | H12 | 178.9° | 179.8° |
C26 | C31 | C30 | H14 | 179.9° | 179.7° |
CL3 | C31 | C26 | C25 | 2.7° | 0.0° |
CL3 | C31 | C30 | H14 | 0.2° | 0.4° |
C11 | C5 | N10 | C22 | 166.2° | 60.0° |
C11 | C5 | C4 | H1 | 62.1° | 180.0° |
C11 | C5 | C4 | H2 | 178.4° | 60.0° |
C5 | C11 | C7 | H5 | 179.9° | 180.0° |
C5 | C11 | H17 | H18 | 119.5° | 120.0° |
C11 | C5 | C1 | H19 | 179.8° | 60.0° |
C11 | C5 | C1 | H20 | 60.0° | 180.0° |
C11 | C5 | N10 | H26 | 13.8° | 120.0° |
C5 | N10 | C22 | H26 | 180.0° | 180.0° |
C5 | N10 | C22 | C16 | 178.0° | 180.0° |
N10 | C5 | C4 | H1 | 57.1° | 60.0° |
N10 | C5 | C4 | H2 | 62.5° | 60.0° |
N10 | C5 | C11 | H17 | 63.1° | 60.1° |
N10 | C5 | C11 | H18 | 56.6° | 60.0° |
N10 | C5 | C1 | H19 | 58.4° | 60.0° |
N10 | C5 | C1 | H20 | 61.5° | 60.0° |
C26 | C25 | N24 | N21 | 173.9° | 180.0° |
C26 | C25 | N24 | N23 | 173.7° | 179.9° |
C26 | C25 | N21 | C14 | 8.2° | 0.0° |
C26 | C25 | N21 | C20 | 172.1° | 180.0° |
C25 | C26 | C27 | H12 | 2.2° | 0.0° |
N10 | C22 | C16 | C15 | 134.9° | 180.0° |
N10 | C22 | C16 | C17 | 43.6° | 0.3° |
C22 | C16 | C15 | C17 | 178.5° | 179.8° |
C22 | C16 | C15 | C14 | 178.8° | 180.0° |
C22 | C16 | C17 | C12 | 178.8° | 179.7° |
C22 | C16 | C15 | H8 | 1.2° | 0.3° |
C22 | C16 | C17 | H9 | 1.2° | 0.3° |
C16 | C22 | N10 | H26 | 2.0° | 0.0° |
C16 | C15 | C14 | H8 | 180.0° | 179.7° |
C16 | C15 | C14 | N21 | 179.6° | 180.0° |
C16 | C15 | C14 | C13 | 0.3° | 0.0° |
C15 | C16 | C17 | C12 | 0.4° | 0.5° |
C15 | C16 | C17 | H9 | 179.7° | 180.0° |
C15 | C14 | N21 | C25 | 0.8° | 0.0° |
C14 | C15 | C16 | C17 | 0.4° | 0.2° |
C15 | C14 | N21 | C13 | 179.9° | 180.0° |
C15 | C14 | N21 | C20 | 178.8° | 180.0° |
C15 | C14 | C13 | C12 | 0.3° | 0.0° |
C15 | C14 | C13 | N18 | 179.7° | 179.7° |
N24 | C25 | N21 | C14 | 178.7° | 180.0° |
N24 | C25 | N21 | C20 | 0.9° | 0.0° |
C25 | N24 | N23 | C20 | 0.8° | 0.1° |
N21 | C25 | N24 | N23 | 0.1° | 0.1° |
C25 | N21 | C14 | C20 | 179.6° | 180.0° |
C25 | N21 | C14 | C13 | 179.1° | 180.0° |
C25 | N21 | C20 | N23 | 1.5° | 0.0° |
C25 | N21 | C20 | C19 | 178.8° | 179.7° |
C16 | C17 | C12 | H9 | 180.0° | 179.5° |
C16 | C17 | C12 | C13 | 0.3° | 0.5° |
C17 | C16 | C15 | H8 | 179.6° | 179.9° |
C16 | C17 | C12 | H13 | 179.8° | 179.5° |
N24 | N23 | C20 | N21 | 1.4° | 0.1° |
N24 | N23 | C20 | C19 | 178.9° | 179.6° |
C14 | N21 | C20 | N23 | 178.2° | 179.9° |
C14 | N21 | C20 | C19 | 1.5° | 0.3° |
N21 | C14 | C13 | C12 | 179.7° | 180.0° |
N21 | C14 | C13 | N18 | 0.4° | 0.3° |
N21 | C14 | C15 | H8 | 0.4° | 0.3° |
C20 | N21 | C14 | C13 | 1.3° | 0.0° |
N21 | C20 | N23 | C19 | 179.7° | 179.7° |
N21 | C20 | C19 | N18 | 0.7° | 0.3° |
N21 | C20 | C19 | C34 | 179.0° | 179.7° |
C14 | C13 | C12 | C17 | 0.2° | 0.2° |
C14 | C13 | C12 | N18 | 180.0° | 179.7° |
C14 | C13 | N18 | C19 | 0.4° | 0.3° |
C13 | C14 | C15 | H8 | 179.7° | 179.7° |
C14 | C13 | C12 | H13 | 179.8° | 179.7° |
C17 | C12 | C13 | H13 | 180.0° | 180.0° |
C17 | C12 | C13 | N18 | 179.7° | 180.0° |
N23 | C20 | C19 | N18 | 178.9° | 180.0° |
N23 | C20 | C19 | C34 | 1.4° | 0.1° |
C20 | C19 | N18 | C13 | 0.2° | 0.0° |
C20 | C19 | N18 | C34 | 179.7° | 180.0° |
C20 | C19 | C34 | H23 | 179.7° | 90.0° |
C20 | C19 | C34 | H24 | 60.3° | 150.0° |
C20 | C19 | C34 | H25 | 59.7° | 30.0° |
C12 | C13 | N18 | C19 | 179.6° | 180.0° |
C13 | C12 | C17 | H9 | 179.7° | 180.0° |
C13 | N18 | C19 | C34 | 179.9° | 180.0° |
N18 | C13 | C12 | H13 | 0.2° | 0.0° |
N18 | C19 | C34 | H23 | 0.0° | 90.0° |
N18 | C19 | C34 | H24 | 120.0° | 30.0° |
N18 | C19 | C34 | H25 | 120.0° | 150.0° |
C19 | C34 | H23 | H24 | 120.0° | 120.0° |
C19 | C34 | H23 | H25 | 120.0° | 120.0° |
C19 | C34 | H24 | H25 | 120.0° | 120.0° |
H1 | C4 | C3 | H22 | 59.5° | 60.0° |
H2 | C4 | C3 | H22 | 60.0° | 60.0° |
H3 | C6 | C7 | H5 | 59.2° | 60.0° |
H3 | C6 | C2 | H21 | 59.9° | 60.0° |
H4 | C6 | C7 | H5 | 60.7° | 59.9° |
H4 | C6 | C2 | H21 | 60.0° | 60.0° |
H5 | C7 | C8 | H6 | 59.6° | 60.0° |
H5 | C7 | C8 | H7 | 60.2° | 60.0° |
H5 | C7 | C11 | H17 | 59.8° | 60.1° |
H5 | C7 | C11 | H18 | 59.9° | 60.0° |
H6 | C8 | C3 | H22 | 59.5° | 60.0° |
H7 | C8 | C3 | H22 | 60.4° | 60.0° |
H9 | C17 | C12 | H13 | 0.2° | 0.0° |
H10 | C28 | C29 | H11 | 0.0° | 0.0° |
H10 | C28 | C27 | H12 | 0.8° | 0.0° |
H11 | C29 | C30 | H14 | 0.5° | 0.3° |
H15 | C9 | C2 | H21 | 60.4° | 60.0° |
H15 | C9 | C3 | H22 | 59.7° | 60.0° |
H16 | C9 | C2 | H21 | 59.4° | 60.1° |
H16 | C9 | C3 | H22 | 60.0° | 60.0° |
H19 | C1 | C2 | H21 | 59.4° | 60.0° |
H20 | C1 | C2 | H21 | 60.5° | 60.0° |
H23 | C34 | H24 | H25 | 120.0° | 120.0° |