7ZA
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C37 | C39 | doub | 1.38Å | 1.39Å | Aromatic |
C37 | C31 | sing | 1.38Å | 1.43Å | Aromatic |
C39 | C38 | sing | 1.38Å | 1.41Å | Aromatic |
C31 | C20 | doub | 1.38Å | 1.43Å | Aromatic |
C38 | C32 | doub | 1.38Å | 1.40Å | Aromatic |
C20 | C32 | sing | 1.38Å | 1.42Å | Aromatic |
C20 | C4 | sing | 1.51Å | 1.53Å | |
C36 | C33 | sing | 1.53Å | 1.53Å | |
C33 | O26 | sing | 1.43Å | 1.46Å | |
C4 | C27 | sing | 1.54Å | 1.56Å | |
C4 | N1 | sing | 1.47Å | 1.47Å | |
O14 | C2 | doub | 1.21Å | 1.22Å | |
C27 | C30 | sing | 1.55Å | 1.55Å | |
O26 | C11 | sing | 1.36Å | 1.38Å | |
N1 | C2 | sing | 1.35Å | 1.34Å | |
N1 | C22 | sing | 1.47Å | 1.51Å | |
C2 | C3 | sing | 1.51Å | 1.50Å | |
C10 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
C10 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
C11 | C9 | sing | 1.39Å | 1.43Å | Aromatic |
C30 | C22 | sing | 1.55Å | 1.56Å | |
N6 | C3 | sing | 1.46Å | 1.50Å | |
N6 | C17 | sing | 1.39Å | 1.38Å | |
C3 | C5 | sing | 1.51Å | 1.53Å | |
C5 | C19 | doub | 1.38Å | 1.42Å | Aromatic |
C24 | C17 | sing | 1.40Å | 1.43Å | Aromatic |
C24 | C15 | doub | 1.36Å | 1.35Å | Aromatic |
C9 | O16 | sing | 1.36Å | 1.39Å | |
C9 | C21 | doub | 1.39Å | 1.40Å | Aromatic |
O16 | C29 | sing | 1.43Å | 1.45Å | |
C17 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
C19 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
C34 | C29 | sing | 1.53Å | 1.52Å | |
C15 | C7 | sing | 1.40Å | 1.45Å | Aromatic |
C29 | C35 | sing | 1.53Å | 1.53Å | |
C18 | C12 | sing | 1.40Å | 1.38Å | Aromatic |
C7 | C12 | doub | 1.42Å | 1.42Å | Aromatic |
C7 | C8 | sing | 1.41Å | 1.39Å | Aromatic |
C12 | C28 | sing | 1.41Å | 1.42Å | Aromatic |
N23 | C8 | sing | 1.38Å | 1.38Å | |
C8 | N13 | doub | 1.32Å | 1.34Å | Aromatic |
C28 | C25 | doub | 1.36Å | 1.38Å | Aromatic |
N13 | C25 | sing | 1.33Å | 1.33Å | Aromatic |
C4 | H1 | sing | 1.09Å | 1.10Å | |
C10 | H2 | sing | 1.08Å | 1.08Å | |
C15 | H3 | sing | 1.08Å | 1.08Å | |
C21 | H4 | sing | 1.08Å | 1.08Å | |
C22 | H5 | sing | 1.09Å | 1.10Å | |
C22 | H6 | sing | 1.09Å | 1.10Å | |
C24 | H7 | sing | 1.08Å | 1.08Å | |
C28 | H8 | sing | 1.08Å | 1.08Å | |
C3 | H9 | sing | 1.09Å | 1.10Å | |
N6 | H10 | sing | 0.97Å | 1.00Å | |
C18 | H11 | sing | 1.08Å | 1.08Å | |
C19 | H12 | sing | 1.08Å | 1.08Å | |
N23 | H13 | sing | 0.97Å | 1.00Å | |
N23 | H14 | sing | 0.97Å | 1.00Å | |
C25 | H15 | sing | 1.08Å | 1.08Å | |
C27 | H16 | sing | 1.09Å | 1.10Å | |
C27 | H17 | sing | 1.09Å | 1.10Å | |
C29 | H18 | sing | 1.09Å | 1.10Å | |
C30 | H19 | sing | 1.09Å | 1.10Å | |
C30 | H20 | sing | 1.09Å | 1.10Å | |
C31 | H21 | sing | 1.08Å | 1.08Å | |
C32 | H22 | sing | 1.08Å | 1.08Å | |
C33 | H23 | sing | 1.09Å | 1.10Å | |
C33 | H24 | sing | 1.09Å | 1.10Å | |
C34 | H25 | sing | 1.09Å | 1.10Å | |
C34 | H26 | sing | 1.09Å | 1.10Å | |
C34 | H27 | sing | 1.09Å | 1.10Å | |
C35 | H28 | sing | 1.09Å | 1.10Å | |
C35 | H29 | sing | 1.09Å | 1.10Å | |
C35 | H30 | sing | 1.09Å | 1.10Å | |
C36 | H31 | sing | 1.09Å | 1.10Å | |
C36 | H32 | sing | 1.09Å | 1.10Å | |
C36 | H33 | sing | 1.09Å | 1.10Å | |
C37 | H34 | sing | 1.08Å | 1.08Å | |
C38 | H35 | sing | 1.08Å | 1.08Å | |
C39 | H36 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C39 | C37 | C31 | 119.6° | 120.0° |
C37 | C39 | C38 | 122.6° | 120.0° |
C39 | C37 | H34 | 120.2° | 119.9° |
C37 | C39 | H36 | 118.7° | 120.0° |
C37 | C31 | C20 | 118.3° | 120.0° |
C37 | C31 | H21 | 120.9° | 120.0° |
C31 | C37 | H34 | 120.2° | 120.1° |
C39 | C38 | C32 | 118.7° | 120.0° |
C39 | C38 | H35 | 120.7° | 120.0° |
C38 | C39 | H36 | 118.7° | 120.0° |
C31 | C20 | C32 | 120.7° | 120.0° |
C31 | C20 | C4 | 119.4° | 120.0° |
C20 | C31 | H21 | 120.9° | 120.0° |
C38 | C32 | C20 | 120.1° | 120.0° |
C38 | C32 | H22 | 119.9° | 120.0° |
C32 | C38 | H35 | 120.7° | 120.0° |
C32 | C20 | C4 | 119.8° | 120.0° |
C20 | C32 | H22 | 119.9° | 120.0° |
C20 | C4 | C27 | 107.1° | 109.8° |
C20 | C4 | N1 | 108.8° | 109.9° |
C20 | C4 | H1 | 111.5° | 110.0° |
C36 | C33 | O26 | 108.4° | 109.5° |
C36 | C33 | H23 | 109.7° | 109.4° |
C36 | C33 | H24 | 109.8° | 109.5° |
C33 | C36 | H31 | 109.5° | 109.4° |
C33 | C36 | H32 | 109.5° | 109.5° |
C33 | C36 | H33 | 109.5° | 109.5° |
C33 | O26 | C11 | 117.5° | 117.0° |
O26 | C33 | H23 | 109.7° | 109.5° |
O26 | C33 | H24 | 109.7° | 109.5° |
C27 | C4 | N1 | 105.9° | 107.3° |
C4 | C27 | C30 | 106.7° | 102.9° |
C27 | C4 | H1 | 111.0° | 109.9° |
C4 | C27 | H16 | 110.2° | 110.7° |
C4 | C27 | H17 | 110.1° | 110.7° |
C4 | N1 | C2 | 121.8° | 125.6° |
C4 | N1 | C22 | 113.1° | 108.7° |
N1 | C4 | H1 | 112.3° | 109.9° |
O14 | C2 | N1 | 117.9° | 120.0° |
O14 | C2 | C3 | 121.1° | 120.0° |
C27 | C30 | C22 | 106.5° | 101.6° |
C30 | C27 | H16 | 110.2° | 110.9° |
C30 | C27 | H17 | 110.2° | 110.5° |
C27 | C30 | H19 | 110.2° | 111.0° |
C27 | C30 | H20 | 110.2° | 111.0° |
O26 | C11 | C10 | 124.5° | 120.1° |
O26 | C11 | C9 | 115.2° | 120.0° |
C2 | N1 | C22 | 125.0° | 125.7° |
N1 | C2 | C3 | 121.0° | 119.9° |
N1 | C22 | C30 | 104.2° | 104.8° |
N1 | C22 | H5 | 110.7° | 110.3° |
N1 | C22 | H6 | 110.8° | 110.4° |
C2 | C3 | N6 | 109.2° | 109.4° |
C2 | C3 | C5 | 104.7° | 109.5° |
C2 | C3 | H9 | 110.5° | 109.5° |
C11 | C10 | C5 | 119.1° | 120.0° |
C10 | C11 | C9 | 120.3° | 119.9° |
C11 | C10 | H2 | 120.4° | 120.0° |
C10 | C5 | C3 | 118.6° | 119.9° |
C10 | C5 | C19 | 121.3° | 120.2° |
C5 | C10 | H2 | 120.4° | 120.0° |
C11 | C9 | O16 | 116.8° | 120.1° |
C11 | C9 | C21 | 119.9° | 119.8° |
C30 | C22 | H5 | 110.8° | 110.4° |
C30 | C22 | H6 | 110.8° | 110.5° |
C22 | C30 | H19 | 110.2° | 111.0° |
C22 | C30 | H20 | 110.2° | 111.0° |
C3 | N6 | C17 | 120.1° | 120.0° |
N6 | C3 | C5 | 111.3° | 109.5° |
N6 | C3 | H9 | 110.6° | 109.4° |
C3 | N6 | H10 | 106.8° | 120.0° |
N6 | C17 | C24 | 117.5° | 119.6° |
N6 | C17 | C18 | 121.6° | 119.7° |
C17 | N6 | H10 | 106.7° | 119.9° |
C3 | C5 | C19 | 120.1° | 119.9° |
C5 | C3 | H9 | 110.2° | 109.5° |
C5 | C19 | C21 | 119.4° | 120.1° |
C5 | C19 | H12 | 120.3° | 119.9° |
C17 | C24 | C15 | 120.8° | 121.0° |
C24 | C17 | C18 | 120.9° | 120.7° |
C17 | C24 | H7 | 119.6° | 119.5° |
C24 | C15 | C7 | 120.0° | 119.7° |
C24 | C15 | H3 | 120.0° | 120.1° |
C15 | C24 | H7 | 119.6° | 119.5° |
O16 | C9 | C21 | 123.2° | 120.1° |
C9 | O16 | C29 | 119.5° | 117.0° |
C9 | C21 | C19 | 119.9° | 120.0° |
C9 | C21 | H4 | 120.1° | 120.0° |
O16 | C29 | C34 | 108.2° | 109.4° |
O16 | C29 | C35 | 105.2° | 109.5° |
O16 | C29 | H18 | 111.3° | 109.5° |
C17 | C18 | C12 | 118.2° | 119.3° |
C17 | C18 | H11 | 120.9° | 120.4° |
C19 | C21 | H4 | 120.0° | 120.0° |
C21 | C19 | H12 | 120.3° | 120.0° |
C34 | C29 | C35 | 111.6° | 109.4° |
C34 | C29 | H18 | 110.3° | 109.5° |
C29 | C34 | H25 | 109.5° | 109.5° |
C29 | C34 | H26 | 109.5° | 109.5° |
C29 | C34 | H27 | 109.5° | 109.5° |
C15 | C7 | C12 | 117.6° | 119.7° |
C15 | C7 | C8 | 121.7° | 121.9° |
C7 | C15 | H3 | 120.0° | 120.2° |
C35 | C29 | H18 | 110.1° | 109.5° |
C29 | C35 | H28 | 109.5° | 109.4° |
C29 | C35 | H29 | 109.5° | 109.6° |
C29 | C35 | H30 | 109.5° | 109.5° |
C18 | C12 | C7 | 122.4° | 119.7° |
C18 | C12 | C28 | 121.3° | 122.1° |
C12 | C18 | H11 | 120.9° | 120.3° |
C12 | C7 | C8 | 120.7° | 118.5° |
C7 | C12 | C28 | 116.3° | 118.3° |
C7 | C8 | N23 | 124.2° | 120.1° |
C7 | C8 | N13 | 120.6° | 119.7° |
C12 | C28 | C25 | 118.6° | 118.8° |
C12 | C28 | H8 | 120.7° | 120.5° |
N23 | C8 | N13 | 115.1° | 120.1° |
C8 | N23 | H13 | 109.5° | 120.0° |
C8 | N23 | H14 | 109.5° | 120.0° |
C8 | N13 | C25 | 119.8° | 122.7° |
C28 | C25 | N13 | 123.8° | 122.0° |
C25 | C28 | H8 | 120.7° | 120.6° |
C28 | C25 | H15 | 118.1° | 119.1° |
N13 | C25 | H15 | 118.1° | 119.0° |
H5 | C22 | H6 | 109.5° | 110.4° |
H13 | N23 | H14 | 109.4° | 120.0° |
H16 | C27 | H17 | 109.5° | 110.8° |
H19 | C30 | H20 | 109.5° | 110.9° |
H23 | C33 | H24 | 109.5° | 109.4° |
H25 | C34 | H26 | 109.5° | 109.4° |
H25 | C34 | H27 | 109.5° | 109.5° |
H26 | C34 | H27 | 109.5° | 109.5° |
H28 | C35 | H29 | 109.4° | 109.4° |
H28 | C35 | H30 | 109.5° | 109.4° |
H29 | C35 | H30 | 109.5° | 109.5° |
H31 | C36 | H32 | 109.5° | 109.4° |
H31 | C36 | H33 | 109.5° | 109.5° |
H32 | C36 | H33 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C39 | C37 | C31 | H34 | 180.0° | 179.8° |
C37 | C39 | C38 | H36 | 180.0° | 179.7° |
C39 | C37 | C31 | C20 | 1.4° | 0.1° |
C37 | C39 | C38 | C32 | 0.5° | 0.5° |
C39 | C37 | C31 | H21 | 178.6° | 180.0° |
C37 | C39 | C38 | H35 | 179.5° | 180.0° |
C31 | C37 | C39 | C38 | 0.2° | 0.2° |
C37 | C31 | C20 | H21 | 180.0° | 179.9° |
C37 | C31 | C20 | C32 | 2.0° | 0.1° |
C37 | C31 | C20 | C4 | 179.0° | 179.7° |
C31 | C37 | C39 | H36 | 179.8° | 179.9° |
C39 | C38 | C32 | H35 | 180.0° | 179.5° |
C39 | C38 | C32 | C20 | 0.1° | 0.5° |
C39 | C38 | C32 | H22 | 179.9° | 179.4° |
C38 | C39 | C37 | H34 | 179.8° | 180.0° |
C31 | C20 | C32 | C38 | 1.3° | 0.2° |
C31 | C20 | C32 | C4 | 179.0° | 179.8° |
C31 | C20 | C4 | C27 | 89.2° | 78.3° |
C31 | C20 | C4 | N1 | 156.7° | 39.4° |
C31 | C20 | C4 | H1 | 32.4° | 160.6° |
C31 | C20 | C32 | H22 | 178.7° | 179.7° |
C20 | C31 | C37 | H34 | 178.6° | 179.7° |
C38 | C32 | C20 | H22 | 180.0° | 179.9° |
C38 | C32 | C20 | C4 | 179.7° | 180.0° |
C32 | C38 | C39 | H36 | 179.6° | 179.8° |
C32 | C20 | C4 | C27 | 91.8° | 101.5° |
C32 | C20 | C4 | N1 | 22.2° | 140.7° |
C32 | C20 | C4 | H1 | 146.6° | 19.6° |
C32 | C20 | C31 | H21 | 178.0° | 180.0° |
C20 | C32 | C38 | H35 | 179.9° | 180.0° |
C20 | C4 | C27 | N1 | 115.9° | 119.4° |
C20 | C4 | C27 | H1 | 121.9° | 121.2° |
C20 | C4 | N1 | H1 | 123.8° | 121.2° |
C20 | C4 | C27 | C30 | 125.4° | 141.4° |
C20 | C4 | N1 | C2 | 69.5° | 61.7° |
C20 | C4 | N1 | C22 | 112.1° | 118.1° |
C20 | C4 | C27 | H16 | 115.0° | 100.1° |
C20 | C4 | C27 | H17 | 5.8° | 23.3° |
C4 | C20 | C31 | H21 | 0.9° | 0.2° |
C4 | C20 | C32 | H22 | 0.3° | 0.1° |
C36 | C33 | O26 | H23 | 119.8° | 120.0° |
C36 | C33 | O26 | H24 | 119.8° | 120.1° |
C36 | C33 | O26 | C11 | 164.7° | 180.0° |
C36 | C33 | H23 | H24 | 120.5° | 120.0° |
C33 | C36 | H31 | H32 | 120.0° | 119.9° |
C33 | C36 | H31 | H33 | 120.0° | 120.0° |
C33 | C36 | H32 | H33 | 120.0° | 120.1° |
C33 | O26 | C11 | C10 | 4.9° | 0.0° |
C33 | O26 | C11 | C9 | 174.1° | 180.0° |
O26 | C33 | H23 | H24 | 120.5° | 120.0° |
O26 | C33 | C36 | H31 | 180.0° | 60.0° |
O26 | C33 | C36 | H32 | 60.0° | 59.9° |
O26 | C33 | C36 | H33 | 60.0° | 180.0° |
C27 | C4 | N1 | H1 | 121.4° | 119.4° |
C4 | C27 | C30 | H16 | 119.6° | 118.4° |
C4 | C27 | C30 | H17 | 119.5° | 118.3° |
C27 | C4 | N1 | C2 | 175.7° | 179.0° |
C27 | C4 | N1 | C22 | 2.6° | 1.2° |
C4 | C27 | C30 | C22 | 17.6° | 35.5° |
C4 | C27 | H16 | H17 | 121.3° | 123.3° |
C4 | C27 | C30 | H19 | 101.9° | 153.6° |
C4 | C27 | C30 | H20 | 137.2° | 82.6° |
C4 | N1 | C2 | O14 | 0.9° | 0.3° |
N1 | C4 | C27 | C30 | 9.5° | 22.1° |
C4 | N1 | C2 | C22 | 178.2° | 179.7° |
C4 | N1 | C2 | C3 | 179.7° | 179.7° |
C4 | N1 | C22 | C30 | 13.5° | 24.3° |
C4 | N1 | C22 | H5 | 105.7° | 94.5° |
C4 | N1 | C22 | H6 | 132.6° | 143.3° |
N1 | C4 | C27 | H16 | 129.0° | 140.6° |
N1 | C4 | C27 | H17 | 110.1° | 96.1° |
O14 | C2 | N1 | C3 | 179.4° | 180.0° |
O14 | C2 | N1 | C22 | 177.3° | 180.0° |
O14 | C2 | C3 | N6 | 16.0° | 0.0° |
O14 | C2 | C3 | C5 | 103.4° | 120.0° |
O14 | C2 | C3 | H9 | 137.9° | 120.0° |
C27 | C30 | C22 | N1 | 18.7° | 37.1° |
C27 | C30 | C22 | H19 | 119.5° | 118.1° |
C27 | C30 | C22 | H20 | 119.5° | 118.1° |
C30 | C27 | C4 | H1 | 112.7° | 97.4° |
C27 | C30 | C22 | H5 | 100.5° | 81.7° |
C27 | C30 | C22 | H6 | 137.8° | 156.0° |
C30 | C27 | H16 | H17 | 121.3° | 123.1° |
C27 | C30 | H19 | H20 | 121.3° | 123.9° |
O26 | C11 | C10 | C9 | 179.0° | 180.0° |
O26 | C11 | C10 | C5 | 179.7° | 179.9° |
O26 | C11 | C9 | O16 | 0.8° | 0.0° |
O26 | C11 | C9 | C21 | 178.8° | 179.9° |
O26 | C11 | C10 | H2 | 0.3° | 0.0° |
C11 | O26 | C33 | H23 | 44.9° | 60.0° |
C11 | O26 | C33 | H24 | 75.5° | 59.9° |
C2 | N1 | C22 | C30 | 164.8° | 155.9° |
N1 | C2 | C3 | N6 | 163.4° | 180.0° |
N1 | C2 | C3 | C5 | 77.2° | 60.0° |
C2 | N1 | C4 | H1 | 54.3° | 59.5° |
C2 | N1 | C22 | H5 | 76.0° | 85.3° |
C2 | N1 | C22 | H6 | 45.7° | 36.9° |
N1 | C2 | C3 | H9 | 41.5° | 60.0° |
C22 | N1 | C2 | C3 | 2.1° | 0.0° |
N1 | C22 | C30 | H5 | 119.1° | 118.8° |
N1 | C22 | C30 | H6 | 119.2° | 118.9° |
C22 | N1 | C4 | H1 | 124.0° | 120.7° |
N1 | C22 | H5 | H6 | 122.4° | 122.2° |
N1 | C22 | C30 | H19 | 100.9° | 155.2° |
N1 | C22 | C30 | H20 | 138.2° | 81.0° |
C2 | C3 | C5 | C10 | 59.6° | 100.3° |
C2 | C3 | N6 | C5 | 115.2° | 120.0° |
C2 | C3 | N6 | H9 | 121.9° | 120.0° |
C2 | C3 | N6 | C17 | 167.1° | 85.0° |
C2 | C3 | C5 | H9 | 118.9° | 120.0° |
C2 | C3 | C5 | C19 | 119.2° | 80.0° |
C2 | C3 | N6 | H10 | 71.4° | 95.0° |
C11 | C10 | C5 | H2 | 180.0° | 179.9° |
C11 | C10 | C5 | C3 | 177.7° | 179.7° |
C11 | C10 | C5 | C19 | 1.1° | 0.0° |
C10 | C11 | C9 | O16 | 178.3° | 180.0° |
C10 | C11 | C9 | C21 | 0.3° | 0.0° |
C5 | C10 | C11 | C9 | 0.7° | 0.0° |
C10 | C5 | C3 | N6 | 58.3° | 139.7° |
C10 | C5 | C3 | C19 | 178.8° | 179.8° |
C10 | C5 | C19 | C21 | 0.4° | 0.0° |
C10 | C5 | C3 | H9 | 178.5° | 19.8° |
C10 | C5 | C19 | H12 | 179.6° | 179.9° |
C11 | C9 | O16 | C21 | 178.0° | 180.0° |
C11 | C9 | O16 | C29 | 175.6° | 174.5° |
C11 | C9 | C21 | C19 | 0.9° | 0.0° |
C9 | C11 | C10 | H2 | 179.3° | 180.0° |
C11 | C9 | C21 | H4 | 179.1° | 180.0° |
C30 | C22 | H5 | H6 | 122.4° | 122.4° |
C22 | C30 | C27 | H16 | 137.2° | 153.9° |
C22 | C30 | C27 | H17 | 101.9° | 82.8° |
C22 | C30 | H19 | H20 | 121.4° | 123.9° |
C3 | N6 | C17 | H10 | 121.5° | 180.0° |
N6 | C3 | C5 | H9 | 123.1° | 120.0° |
N6 | C3 | C5 | C19 | 122.9° | 40.0° |
C3 | N6 | C17 | C24 | 169.1° | 0.5° |
C3 | N6 | C17 | C18 | 11.3° | 180.0° |
C17 | N6 | C3 | C5 | 77.7° | 155.0° |
N6 | C17 | C24 | C18 | 179.7° | 179.5° |
N6 | C17 | C24 | C15 | 178.6° | 179.7° |
N6 | C17 | C18 | C12 | 178.5° | 180.0° |
N6 | C17 | C24 | H7 | 1.4° | 0.3° |
C17 | N6 | C3 | H9 | 45.2° | 35.0° |
N6 | C17 | C18 | H11 | 1.5° | 0.6° |
C3 | C5 | C19 | C21 | 178.3° | 179.7° |
C3 | C5 | C10 | H2 | 2.3° | 0.2° |
C5 | C3 | N6 | H10 | 43.8° | 25.0° |
C3 | C5 | C19 | H12 | 1.7° | 0.3° |
C5 | C19 | C21 | C9 | 0.6° | 0.0° |
C5 | C19 | C21 | H12 | 180.0° | 180.0° |
C19 | C5 | C10 | H2 | 179.0° | 180.0° |
C5 | C19 | C21 | H4 | 179.4° | 180.0° |
C19 | C5 | C3 | H9 | 0.2° | 160.0° |
C17 | C24 | C15 | H7 | 180.0° | 180.0° |
C17 | C24 | C15 | C7 | 0.9° | 0.0° |
C24 | C17 | C18 | C12 | 1.1° | 0.5° |
C17 | C24 | C15 | H3 | 179.1° | 180.0° |
C24 | C17 | N6 | H10 | 47.5° | 179.5° |
C24 | C17 | C18 | H11 | 178.9° | 180.0° |
C15 | C24 | C17 | C18 | 1.1° | 0.3° |
C24 | C15 | C7 | H3 | 180.0° | 180.0° |
C24 | C15 | C7 | C12 | 0.8° | 0.0° |
C24 | C15 | C7 | C8 | 179.0° | 179.7° |
O16 | C9 | C21 | C19 | 178.9° | 180.0° |
C9 | O16 | C29 | C34 | 159.7° | 84.9° |
C9 | O16 | C29 | C35 | 81.0° | 155.1° |
O16 | C9 | C21 | H4 | 1.1° | 0.0° |
C9 | O16 | C29 | H18 | 38.3° | 35.1° |
C21 | C9 | O16 | C29 | 6.4° | 5.5° |
C9 | C21 | C19 | H4 | 180.0° | 180.0° |
C9 | C21 | C19 | H12 | 179.4° | 179.9° |
O16 | C29 | C34 | C35 | 115.3° | 120.0° |
O16 | C29 | C34 | H18 | 122.0° | 120.0° |
O16 | C29 | C35 | H18 | 120.0° | 120.1° |
O16 | C29 | C34 | H25 | 180.0° | 60.0° |
O16 | C29 | C34 | H26 | 60.0° | 180.0° |
O16 | C29 | C34 | H27 | 60.0° | 60.0° |
O16 | C29 | C35 | H28 | 180.0° | 60.0° |
O16 | C29 | C35 | H29 | 60.0° | 180.0° |
O16 | C29 | C35 | H30 | 60.0° | 59.9° |
C17 | C18 | C12 | H11 | 180.0° | 179.4° |
C17 | C18 | C12 | C7 | 1.1° | 0.5° |
C17 | C18 | C12 | C28 | 179.2° | 179.5° |
C18 | C17 | C24 | H7 | 178.9° | 179.7° |
C18 | C17 | N6 | H10 | 132.8° | 0.0° |
C34 | C29 | C35 | H18 | 122.8° | 120.0° |
C29 | C34 | H25 | H26 | 120.0° | 120.0° |
C29 | C34 | H25 | H27 | 120.0° | 120.0° |
C29 | C34 | H26 | H27 | 120.0° | 120.0° |
C34 | C29 | C35 | H28 | 62.8° | 180.0° |
C34 | C29 | C35 | H29 | 57.2° | 60.1° |
C34 | C29 | C35 | H30 | 177.1° | 60.1° |
C15 | C7 | C12 | C18 | 0.9° | 0.3° |
C15 | C7 | C12 | C8 | 179.8° | 179.8° |
C15 | C7 | C12 | C28 | 179.1° | 179.8° |
C15 | C7 | C8 | N23 | 0.8° | 0.3° |
C15 | C7 | C8 | N13 | 177.8° | 179.7° |
C7 | C15 | C24 | H7 | 179.0° | 180.0° |
C35 | C29 | C34 | H25 | 64.7° | 60.0° |
C35 | C29 | C34 | H26 | 175.3° | 60.0° |
C35 | C29 | C34 | H27 | 55.3° | 180.0° |
C29 | C35 | H28 | H29 | 120.0° | 120.0° |
C29 | C35 | H28 | H30 | 120.0° | 120.0° |
C29 | C35 | H29 | H30 | 120.0° | 120.1° |
C18 | C12 | C7 | C28 | 178.2° | 180.0° |
C18 | C12 | C7 | C8 | 178.9° | 180.0° |
C18 | C12 | C28 | C25 | 179.5° | 180.0° |
C18 | C12 | C28 | H8 | 0.4° | 0.0° |
C12 | C7 | C8 | N23 | 179.4° | 180.0° |
C12 | C7 | C8 | N13 | 2.4° | 0.0° |
C7 | C12 | C28 | C25 | 2.2° | 0.0° |
C12 | C7 | C15 | H3 | 179.2° | 180.0° |
C7 | C12 | C28 | H8 | 177.8° | 180.0° |
C7 | C12 | C18 | H11 | 178.9° | 179.9° |
C8 | C7 | C12 | C28 | 0.7° | 0.0° |
C7 | C8 | N23 | N13 | 177.2° | 180.0° |
C7 | C8 | N13 | C25 | 3.9° | 0.0° |
C8 | C7 | C15 | H3 | 1.0° | 0.2° |
C7 | C8 | N23 | H13 | 177.2° | 0.1° |
C7 | C8 | N23 | H14 | 62.9° | 179.9° |
C12 | C28 | C25 | H8 | 180.0° | 179.9° |
C12 | C28 | C25 | N13 | 0.8° | 0.0° |
C28 | C12 | C18 | H11 | 0.8° | 0.1° |
C12 | C28 | C25 | H15 | 179.2° | 180.0° |
N23 | C8 | N13 | C25 | 178.8° | 179.9° |
C8 | N23 | H13 | H14 | 120.0° | 179.9° |
C8 | N13 | C25 | C28 | 2.3° | 0.0° |
N13 | C8 | N23 | H13 | 0.0° | 180.0° |
N13 | C8 | N23 | H14 | 120.0° | 0.1° |
C8 | N13 | C25 | H15 | 177.7° | 180.0° |
C28 | C25 | N13 | H15 | 180.0° | 180.0° |
N13 | C25 | C28 | H8 | 179.2° | 180.0° |
H1 | C4 | C27 | H16 | 6.9° | 21.1° |
H1 | C4 | C27 | H17 | 127.7° | 144.5° |
H3 | C15 | C24 | H7 | 0.9° | 0.0° |
H4 | C21 | C19 | H12 | 0.6° | 0.1° |
H5 | C22 | C30 | H19 | 140.0° | 36.4° |
H5 | C22 | C30 | H20 | 19.1° | 160.2° |
H6 | C22 | C30 | H19 | 18.3° | 86.0° |
H6 | C22 | C30 | H20 | 102.6° | 37.9° |
H8 | C28 | C25 | H15 | 0.8° | 0.0° |
H9 | C3 | N6 | H10 | 166.7° | 145.0° |
H16 | C27 | C30 | H19 | 17.6° | 88.0° |
H16 | C27 | C30 | H20 | 103.3° | 35.9° |
H17 | C27 | C30 | H19 | 138.5° | 35.3° |
H17 | C27 | C30 | H20 | 17.6° | 159.2° |
H18 | C29 | C34 | H25 | 58.0° | 180.0° |
H18 | C29 | C34 | H26 | 62.0° | 60.0° |
H18 | C29 | C34 | H27 | 178.0° | 60.0° |
H18 | C29 | C35 | H28 | 60.0° | 60.1° |
H18 | C29 | C35 | H29 | 180.0° | 59.9° |
H18 | C29 | C35 | H30 | 60.0° | 179.9° |
H21 | C31 | C37 | H34 | 1.4° | 0.2° |
H22 | C32 | C38 | H35 | 0.1° | 0.1° |
H23 | C33 | C36 | H31 | 60.2° | 180.0° |
H23 | C33 | C36 | H32 | 59.8° | 60.1° |
H23 | C33 | C36 | H33 | 179.8° | 60.0° |
H24 | C33 | C36 | H31 | 60.2° | 60.0° |
H24 | C33 | C36 | H32 | 179.8° | 180.0° |
H24 | C33 | C36 | H33 | 59.8° | 59.9° |
H25 | C34 | H26 | H27 | 120.0° | 120.0° |
H28 | C35 | H29 | H30 | 120.0° | 119.9° |
H31 | C36 | H32 | H33 | 120.0° | 120.0° |
H34 | C37 | C39 | H36 | 0.2° | 0.3° |
H35 | C38 | C39 | H36 | 0.4° | 0.3° |