92J
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C19 | C18 | sing | 1.53Å | 1.55Å | |
C19 | N14 | sing | 1.47Å | 1.49Å | |
C18 | O17 | sing | 1.43Å | 1.45Å | |
C39 | C38 | sing | 1.53Å | 1.56Å | |
C39 | C34 | sing | 1.53Å | 1.56Å | |
C7 | C1 | sing | 1.51Å | 1.52Å | |
C38 | O37 | sing | 1.43Å | 1.45Å | |
O17 | C16 | sing | 1.43Å | 1.44Å | |
O20 | C34 | sing | 1.43Å | 1.44Å | |
O20 | C11 | sing | 1.36Å | 1.39Å | |
C34 | C35 | sing | 1.53Å | 1.56Å | |
N14 | C10 | sing | 1.40Å | 1.43Å | |
N14 | C15 | sing | 1.47Å | 1.50Å | |
C11 | C10 | doub | 1.40Å | 1.41Å | Aromatic |
C11 | N12 | sing | 1.32Å | 1.36Å | Aromatic |
C10 | C9 | sing | 1.39Å | 1.41Å | Aromatic |
N12 | C13 | doub | 1.32Å | 1.34Å | Aromatic |
C1 | N6 | doub | 1.32Å | 1.35Å | Aromatic |
C1 | C2 | sing | 1.39Å | 1.41Å | Aromatic |
C9 | C8 | doub | 1.40Å | 1.40Å | Aromatic |
C15 | C16 | sing | 1.53Å | 1.55Å | |
O37 | C36 | sing | 1.43Å | 1.45Å | |
C13 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
C8 | C2 | sing | 1.48Å | 1.47Å | |
N6 | C5 | sing | 1.32Å | 1.35Å | Aromatic |
C35 | C36 | sing | 1.53Å | 1.55Å | |
C2 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
C5 | C4 | doub | 1.39Å | 1.40Å | Aromatic |
C3 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
C4 | N21 | sing | 1.40Å | 1.42Å | |
N21 | C22 | sing | 1.35Å | 1.36Å | |
O29 | C22 | doub | 1.22Å | 1.23Å | |
C22 | C23 | sing | 1.48Å | 1.51Å | |
C23 | C24 | doub | 1.40Å | 1.41Å | Aromatic |
C23 | C28 | sing | 1.40Å | 1.41Å | Aromatic |
C24 | C25 | sing | 1.38Å | 1.40Å | Aromatic |
C28 | C27 | doub | 1.38Å | 1.41Å | Aromatic |
C25 | C26 | doub | 1.38Å | 1.40Å | Aromatic |
C27 | C26 | sing | 1.38Å | 1.41Å | Aromatic |
C27 | C30 | sing | 1.51Å | 1.53Å | |
F33 | C30 | sing | 1.40Å | 1.35Å | |
C30 | F32 | sing | 1.40Å | 1.34Å | |
C30 | F31 | sing | 1.40Å | 1.36Å | |
C3 | H1 | sing | 1.08Å | 1.08Å | |
C13 | H2 | sing | 1.08Å | 1.08Å | |
C15 | H3 | sing | 1.09Å | 1.10Å | |
C15 | H4 | sing | 1.09Å | 1.10Å | |
C16 | H5 | sing | 1.09Å | 1.10Å | |
C16 | H6 | sing | 1.09Å | 1.10Å | |
C18 | H7 | sing | 1.09Å | 1.10Å | |
C18 | H8 | sing | 1.09Å | 1.10Å | |
C19 | H9 | sing | 1.09Å | 1.10Å | |
C19 | H10 | sing | 1.09Å | 1.10Å | |
C24 | H11 | sing | 1.08Å | 1.08Å | |
C25 | H12 | sing | 1.08Å | 1.08Å | |
C26 | H13 | sing | 1.08Å | 1.08Å | |
C28 | H14 | sing | 1.08Å | 1.08Å | |
C36 | H15 | sing | 1.09Å | 1.10Å | |
C36 | H16 | sing | 1.09Å | 1.10Å | |
C35 | H17 | sing | 1.09Å | 1.10Å | |
C35 | H18 | sing | 1.09Å | 1.10Å | |
N21 | H19 | sing | 0.97Å | 1.00Å | |
C34 | H20 | sing | 1.09Å | 1.10Å | |
C39 | H21 | sing | 1.09Å | 1.10Å | |
C39 | H22 | sing | 1.09Å | 1.10Å | |
C38 | H23 | sing | 1.09Å | 1.10Å | |
C38 | H24 | sing | 1.09Å | 1.10Å | |
C5 | H25 | sing | 1.08Å | 1.08Å | |
C9 | H26 | sing | 1.08Å | 1.08Å | |
C7 | H27 | sing | 1.09Å | 1.10Å | |
C7 | H28 | sing | 1.09Å | 1.10Å | |
C7 | H29 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C18 | C19 | N14 | 110.0° | 109.3° |
C19 | C18 | O17 | 109.3° | 109.3° |
C19 | C18 | H7 | 109.5° | 109.5° |
C19 | C18 | H8 | 109.5° | 109.6° |
C18 | C19 | H9 | 109.3° | 109.5° |
C18 | C19 | H10 | 109.3° | 109.5° |
C19 | N14 | C10 | 119.3° | 111.0° |
C19 | N14 | C15 | 113.5° | 110.8° |
N14 | C19 | H9 | 109.3° | 109.6° |
N14 | C19 | H10 | 109.3° | 109.5° |
C18 | O17 | C16 | 114.3° | 113.7° |
O17 | C18 | H7 | 109.5° | 109.5° |
O17 | C18 | H8 | 109.5° | 109.5° |
C38 | C39 | C34 | 109.8° | 109.2° |
C39 | C38 | O37 | 110.6° | 109.4° |
C38 | C39 | H21 | 109.4° | 109.5° |
C38 | C39 | H22 | 109.4° | 109.6° |
C39 | C38 | H23 | 109.2° | 109.5° |
C39 | C38 | H24 | 109.2° | 109.5° |
C39 | C34 | O20 | 109.8° | 109.6° |
C39 | C34 | C35 | 109.6° | 109.0° |
C39 | C34 | H20 | 109.4° | 109.5° |
C34 | C39 | H21 | 109.4° | 109.5° |
C34 | C39 | H22 | 109.4° | 109.5° |
C7 | C1 | N6 | 116.8° | 119.6° |
C7 | C1 | C2 | 124.5° | 119.6° |
C1 | C7 | H27 | 109.5° | 109.4° |
C1 | C7 | H28 | 109.5° | 109.5° |
C1 | C7 | H29 | 109.4° | 109.5° |
C38 | O37 | C36 | 115.6° | 114.1° |
O37 | C38 | H23 | 109.2° | 109.4° |
O37 | C38 | H24 | 109.2° | 109.5° |
O17 | C16 | C15 | 108.4° | 109.3° |
O17 | C16 | H5 | 109.8° | 109.5° |
O17 | C16 | H6 | 109.7° | 109.6° |
C34 | O20 | C11 | 122.1° | 117.0° |
O20 | C34 | C35 | 107.7° | 109.5° |
O20 | C34 | H20 | 111.0° | 109.6° |
O20 | C11 | C10 | 118.0° | 119.6° |
O20 | C11 | N12 | 121.3° | 119.6° |
C34 | C35 | C36 | 111.1° | 109.2° |
C34 | C35 | H17 | 109.1° | 109.5° |
C34 | C35 | H18 | 109.0° | 109.6° |
C35 | C34 | H20 | 109.3° | 109.6° |
C10 | N14 | C15 | 117.7° | 111.0° |
N14 | C10 | C11 | 121.8° | 120.4° |
N14 | C10 | C9 | 120.5° | 120.5° |
N14 | C15 | C16 | 109.9° | 109.2° |
N14 | C15 | H3 | 109.4° | 109.5° |
N14 | C15 | H4 | 109.4° | 109.5° |
C10 | C11 | N12 | 120.8° | 120.8° |
C11 | C10 | C9 | 117.7° | 119.1° |
C11 | N12 | C13 | 122.8° | 121.8° |
C10 | C9 | C8 | 119.3° | 118.4° |
C10 | C9 | H26 | 120.3° | 120.8° |
N12 | C13 | C8 | 118.6° | 120.8° |
N12 | C13 | H2 | 120.7° | 119.6° |
N6 | C1 | C2 | 118.7° | 120.7° |
C1 | N6 | C5 | 122.0° | 122.0° |
C1 | C2 | C8 | 123.1° | 120.5° |
C1 | C2 | C3 | 120.2° | 119.0° |
C9 | C8 | C13 | 120.7° | 119.1° |
C9 | C8 | C2 | 119.8° | 120.5° |
C8 | C9 | H26 | 120.3° | 120.8° |
C16 | C15 | H3 | 109.3° | 109.5° |
C16 | C15 | H4 | 109.3° | 109.5° |
C15 | C16 | H5 | 109.7° | 109.5° |
C15 | C16 | H6 | 109.7° | 109.5° |
O37 | C36 | C35 | 108.2° | 109.4° |
O37 | C36 | H15 | 109.8° | 109.5° |
O37 | C36 | H16 | 109.8° | 109.5° |
C13 | C8 | C2 | 119.4° | 120.5° |
C8 | C13 | H2 | 120.7° | 119.5° |
C8 | C2 | C3 | 116.7° | 120.5° |
N6 | C5 | C4 | 121.3° | 120.9° |
N6 | C5 | H25 | 119.3° | 119.6° |
C35 | C36 | H15 | 109.8° | 109.5° |
C35 | C36 | H16 | 109.8° | 109.4° |
C36 | C35 | H17 | 109.0° | 109.5° |
C36 | C35 | H18 | 109.1° | 109.5° |
C2 | C3 | C4 | 119.5° | 118.2° |
C2 | C3 | H1 | 120.3° | 120.8° |
C5 | C4 | C3 | 118.2° | 119.2° |
C5 | C4 | N21 | 116.9° | 120.4° |
C4 | C5 | H25 | 119.4° | 119.6° |
C3 | C4 | N21 | 124.5° | 120.4° |
C4 | C3 | H1 | 120.2° | 120.9° |
C4 | N21 | C22 | 126.7° | 120.1° |
C4 | N21 | H19 | 116.7° | 120.0° |
N21 | C22 | O29 | 124.4° | 119.9° |
N21 | C22 | C23 | 117.3° | 120.0° |
C22 | N21 | H19 | 116.7° | 120.0° |
O29 | C22 | C23 | 118.3° | 120.0° |
C22 | C23 | C24 | 120.6° | 120.1° |
C22 | C23 | C28 | 119.9° | 120.2° |
C24 | C23 | C28 | 119.4° | 119.7° |
C23 | C24 | C25 | 120.4° | 119.8° |
C23 | C24 | H11 | 119.8° | 120.1° |
C23 | C28 | C27 | 120.3° | 119.9° |
C23 | C28 | H14 | 119.9° | 120.1° |
C24 | C25 | C26 | 120.0° | 120.1° |
C25 | C24 | H11 | 119.8° | 120.1° |
C24 | C25 | H12 | 120.0° | 119.9° |
C28 | C27 | C26 | 119.8° | 120.1° |
C28 | C27 | C30 | 119.2° | 120.0° |
C27 | C28 | H14 | 119.9° | 120.1° |
C25 | C26 | C27 | 120.2° | 120.3° |
C26 | C25 | H12 | 120.0° | 120.0° |
C25 | C26 | H13 | 119.9° | 119.8° |
C26 | C27 | C30 | 121.0° | 119.9° |
C27 | C26 | H13 | 119.9° | 119.8° |
C27 | C30 | F33 | 111.1° | 109.5° |
C27 | C30 | F32 | 106.7° | 109.5° |
C27 | C30 | F31 | 114.0° | 109.4° |
F33 | C30 | F32 | 108.8° | 109.5° |
F33 | C30 | F31 | 107.7° | 109.4° |
F32 | C30 | F31 | 108.4° | 109.5° |
H3 | C15 | H4 | 109.5° | 109.5° |
H5 | C16 | H6 | 109.5° | 109.5° |
H7 | C18 | H8 | 109.5° | 109.5° |
H9 | C19 | H10 | 109.5° | 109.5° |
H15 | C36 | H16 | 109.5° | 109.4° |
H17 | C35 | H18 | 109.5° | 109.5° |
H21 | C39 | H22 | 109.5° | 109.5° |
H23 | C38 | H24 | 109.5° | 109.5° |
H27 | C7 | H28 | 109.4° | 109.5° |
H27 | C7 | H29 | 109.5° | 109.5° |
H28 | C7 | H29 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C18 | C19 | N14 | H9 | 120.1° | 119.9° |
C18 | C19 | N14 | H10 | 120.1° | 119.9° |
C19 | C18 | O17 | H7 | 120.0° | 119.9° |
C19 | C18 | O17 | H8 | 120.0° | 120.0° |
C19 | C18 | O17 | C16 | 60.7° | 58.6° |
C18 | C19 | N14 | C10 | 161.6° | 177.6° |
C18 | C19 | N14 | C15 | 52.8° | 58.6° |
C19 | C18 | H7 | H8 | 120.1° | 120.2° |
C18 | C19 | H9 | H10 | 119.8° | 120.1° |
N14 | C19 | C18 | O17 | 53.6° | 56.9° |
C19 | N14 | C10 | C15 | 144.2° | 123.6° |
C19 | N14 | C10 | C11 | 60.5° | 120.0° |
C19 | N14 | C10 | C9 | 123.3° | 60.0° |
C19 | N14 | C15 | C16 | 53.8° | 58.6° |
C19 | N14 | C15 | H3 | 66.3° | 178.6° |
C19 | N14 | C15 | H4 | 173.8° | 61.3° |
N14 | C19 | C18 | H7 | 66.4° | 63.0° |
N14 | C19 | C18 | H8 | 173.6° | 176.8° |
N14 | C19 | H9 | H10 | 119.8° | 120.1° |
C18 | O17 | C16 | C15 | 61.3° | 58.7° |
C18 | O17 | C16 | H5 | 58.5° | 178.6° |
C18 | O17 | C16 | H6 | 178.9° | 61.3° |
O17 | C18 | H7 | H8 | 120.1° | 120.0° |
O17 | C18 | C19 | H9 | 66.5° | 63.1° |
O17 | C18 | C19 | H10 | 173.6° | 176.8° |
C38 | C39 | C34 | H21 | 120.0° | 120.0° |
C38 | C39 | C34 | H22 | 120.0° | 120.0° |
C39 | C38 | O37 | H23 | 120.2° | 119.9° |
C39 | C38 | O37 | H24 | 120.2° | 120.0° |
C38 | C39 | C34 | O20 | 65.1° | 176.9° |
C38 | C39 | C34 | C35 | 53.0° | 57.0° |
C39 | C38 | O37 | C36 | 60.1° | 61.1° |
C38 | C39 | C34 | H20 | 172.8° | 62.9° |
C38 | C39 | H21 | H22 | 119.8° | 120.2° |
C39 | C38 | H23 | H24 | 119.5° | 120.1° |
C34 | C39 | C38 | O37 | 54.2° | 57.6° |
C39 | C34 | O20 | C35 | 119.3° | 119.6° |
C39 | C34 | O20 | H20 | 121.1° | 120.2° |
C39 | C34 | O20 | C11 | 163.5° | 90.4° |
C39 | C34 | C35 | H20 | 119.8° | 119.8° |
C39 | C34 | C35 | C36 | 55.3° | 57.0° |
C39 | C34 | C35 | H17 | 175.6° | 176.9° |
C39 | C34 | C35 | H18 | 65.0° | 63.0° |
C34 | C39 | H21 | H22 | 119.9° | 120.1° |
C34 | C39 | C38 | H23 | 174.4° | 62.3° |
C34 | C39 | C38 | H24 | 66.0° | 177.6° |
C7 | C1 | N6 | C2 | 179.1° | 179.7° |
C7 | C1 | C2 | C8 | 4.0° | 0.3° |
C7 | C1 | N6 | C5 | 178.3° | 179.7° |
C7 | C1 | C2 | C3 | 178.6° | 179.7° |
C1 | C7 | H27 | H28 | 120.0° | 120.0° |
C1 | C7 | H27 | H29 | 120.0° | 120.0° |
C1 | C7 | H28 | H29 | 120.0° | 120.1° |
C38 | O37 | C36 | C35 | 60.3° | 61.1° |
C38 | O37 | C36 | H15 | 179.9° | 178.8° |
C38 | O37 | C36 | H16 | 59.5° | 58.9° |
O37 | C38 | C39 | H21 | 174.2° | 177.5° |
O37 | C38 | C39 | H22 | 65.8° | 62.4° |
O37 | C38 | H23 | H24 | 119.5° | 120.0° |
O17 | C16 | C15 | N14 | 55.2° | 56.9° |
O17 | C16 | C15 | H5 | 119.9° | 119.9° |
O17 | C16 | C15 | H6 | 119.8° | 120.0° |
O17 | C16 | C15 | H3 | 64.9° | 176.8° |
O17 | C16 | C15 | H4 | 175.3° | 63.1° |
O17 | C16 | H5 | H6 | 120.5° | 120.1° |
C16 | O17 | C18 | H7 | 59.2° | 61.3° |
C16 | O17 | C18 | H8 | 179.3° | 178.6° |
O20 | C34 | C35 | H20 | 120.7° | 120.2° |
C34 | O20 | C11 | C10 | 166.8° | 180.0° |
C34 | O20 | C11 | N12 | 13.1° | 0.3° |
O20 | C34 | C35 | C36 | 64.1° | 176.9° |
O20 | C34 | C35 | H17 | 56.1° | 63.2° |
O20 | C34 | C35 | H18 | 175.6° | 56.9° |
O20 | C34 | C39 | H21 | 54.9° | 63.2° |
O20 | C34 | C39 | H22 | 174.9° | 56.9° |
C11 | O20 | C34 | C35 | 77.2° | 150.0° |
O20 | C11 | C10 | N14 | 4.6° | 0.3° |
O20 | C11 | C10 | N12 | 179.9° | 179.7° |
O20 | C11 | C10 | C9 | 179.1° | 179.8° |
O20 | C11 | N12 | C13 | 179.6° | 179.8° |
C11 | O20 | C34 | H20 | 42.4° | 29.8° |
C34 | C35 | C36 | O37 | 56.7° | 57.6° |
C34 | C35 | C36 | H17 | 120.2° | 119.9° |
C34 | C35 | C36 | H18 | 120.2° | 120.0° |
C34 | C35 | C36 | H15 | 176.4° | 177.7° |
C34 | C35 | C36 | H16 | 63.1° | 62.4° |
C34 | C35 | H17 | H18 | 119.2° | 120.2° |
C35 | C34 | C39 | H21 | 173.0° | 176.9° |
C35 | C34 | C39 | H22 | 67.0° | 63.0° |
N14 | C10 | C11 | C9 | 176.3° | 179.9° |
N14 | C10 | C11 | N12 | 175.3° | 180.0° |
N14 | C10 | C9 | C8 | 175.0° | 180.0° |
C10 | N14 | C15 | C16 | 160.0° | 177.6° |
C10 | N14 | C15 | H3 | 79.9° | 57.7° |
C10 | N14 | C15 | H4 | 40.0° | 62.4° |
C10 | N14 | C19 | H9 | 78.4° | 62.5° |
C10 | N14 | C19 | H10 | 41.5° | 57.7° |
N14 | C10 | C9 | H26 | 5.0° | 0.1° |
C15 | N14 | C10 | C11 | 155.3° | 116.4° |
C15 | N14 | C10 | C9 | 20.9° | 63.6° |
N14 | C15 | C16 | H3 | 120.1° | 119.9° |
N14 | C15 | C16 | H4 | 120.1° | 120.0° |
N14 | C15 | H3 | H4 | 119.8° | 120.1° |
N14 | C15 | C16 | H5 | 64.6° | 176.8° |
N14 | C15 | C16 | H6 | 175.0° | 63.2° |
C15 | N14 | C19 | H9 | 67.3° | 61.3° |
C15 | N14 | C19 | H10 | 172.8° | 178.6° |
C10 | C11 | N12 | C13 | 0.3° | 0.1° |
C11 | C10 | C9 | C8 | 1.4° | 0.1° |
C11 | C10 | C9 | H26 | 178.6° | 180.0° |
N12 | C11 | C10 | C9 | 1.1° | 0.1° |
C11 | N12 | C13 | C8 | 1.3° | 0.0° |
C11 | N12 | C13 | H2 | 178.7° | 179.9° |
C10 | C9 | C8 | H26 | 180.0° | 179.9° |
C10 | C9 | C8 | C13 | 0.4° | 0.1° |
C10 | C9 | C8 | C2 | 178.7° | 179.9° |
N12 | C13 | C8 | C9 | 0.9° | 0.1° |
N12 | C13 | C8 | H2 | 180.0° | 180.0° |
N12 | C13 | C8 | C2 | 179.9° | 180.0° |
N6 | C1 | C2 | C8 | 175.1° | 180.0° |
N6 | C1 | C2 | C3 | 2.4° | 0.0° |
C1 | N6 | C5 | C4 | 0.3° | 0.0° |
C1 | N6 | C5 | H25 | 179.7° | 180.0° |
N6 | C1 | C7 | H27 | 0.0° | 85.5° |
N6 | C1 | C7 | H28 | 120.0° | 154.6° |
N6 | C1 | C7 | H29 | 120.0° | 34.5° |
C1 | C2 | C8 | C9 | 70.5° | 123.9° |
C1 | C2 | C8 | C13 | 110.4° | 56.1° |
C1 | C2 | C8 | C3 | 177.5° | 180.0° |
C2 | C1 | N6 | C5 | 2.6° | 0.0° |
C1 | C2 | C3 | C4 | 0.1° | 0.1° |
C1 | C2 | C3 | H1 | 179.9° | 180.0° |
C2 | C1 | C7 | H27 | 179.1° | 94.3° |
C2 | C1 | C7 | H28 | 60.9° | 25.7° |
C2 | C1 | C7 | H29 | 59.1° | 145.8° |
C9 | C8 | C13 | C2 | 179.2° | 180.0° |
C9 | C8 | C2 | C3 | 112.0° | 56.1° |
C9 | C8 | C13 | H2 | 179.1° | 179.9° |
C16 | C15 | H3 | H4 | 119.8° | 120.1° |
C15 | C16 | H5 | H6 | 120.4° | 120.1° |
O37 | C36 | C35 | H15 | 119.8° | 120.1° |
O37 | C36 | C35 | H16 | 119.8° | 120.0° |
O37 | C36 | H15 | H16 | 120.6° | 120.0° |
O37 | C36 | C35 | H17 | 176.9° | 177.5° |
O37 | C36 | C35 | H18 | 63.6° | 62.5° |
C36 | O37 | C38 | H23 | 179.8° | 58.9° |
C36 | O37 | C38 | H24 | 60.1° | 178.9° |
C13 | C8 | C2 | C3 | 67.2° | 124.0° |
C13 | C8 | C9 | H26 | 179.6° | 180.0° |
C8 | C2 | C3 | C4 | 177.7° | 180.0° |
C8 | C2 | C3 | H1 | 2.3° | 0.0° |
C2 | C8 | C13 | H2 | 0.1° | 0.1° |
C2 | C8 | C9 | H26 | 1.3° | 0.1° |
N6 | C5 | C4 | H25 | 180.0° | 180.0° |
N6 | C5 | C4 | C3 | 2.2° | 0.0° |
N6 | C5 | C4 | N21 | 170.9° | 180.0° |
C35 | C36 | H15 | H16 | 120.6° | 120.0° |
C36 | C35 | H17 | H18 | 119.3° | 120.0° |
C36 | C35 | C34 | H20 | 175.2° | 62.9° |
C2 | C3 | C4 | C5 | 2.3° | 0.0° |
C2 | C3 | C4 | H1 | 180.0° | 180.0° |
C2 | C3 | C4 | N21 | 170.2° | 180.0° |
C5 | C4 | C3 | N21 | 172.5° | 179.9° |
C5 | C4 | N21 | C22 | 138.9° | 145.1° |
C5 | C4 | C3 | H1 | 177.7° | 180.0° |
C5 | C4 | N21 | H19 | 41.1° | 34.9° |
C3 | C4 | N21 | C22 | 33.6° | 34.8° |
C3 | C4 | N21 | H19 | 146.4° | 145.1° |
C3 | C4 | C5 | H25 | 177.8° | 180.0° |
C4 | N21 | C22 | H19 | 180.0° | 179.9° |
C4 | N21 | C22 | O29 | 4.8° | 4.8° |
C4 | N21 | C22 | C23 | 173.8° | 175.1° |
N21 | C4 | C3 | H1 | 9.8° | 0.1° |
N21 | C4 | C5 | H25 | 9.1° | 0.0° |
N21 | C22 | O29 | C23 | 178.5° | 179.9° |
N21 | C22 | C23 | C24 | 13.5° | 0.0° |
N21 | C22 | C23 | C28 | 163.7° | 179.7° |
O29 | C22 | C23 | C24 | 167.9° | 180.0° |
O29 | C22 | C23 | C28 | 14.9° | 0.2° |
O29 | C22 | N21 | H19 | 175.2° | 175.2° |
C22 | C23 | C24 | C28 | 177.2° | 179.8° |
C22 | C23 | C24 | C25 | 176.4° | 180.0° |
C22 | C23 | C28 | C27 | 178.2° | 179.7° |
C22 | C23 | C24 | H11 | 3.6° | 0.0° |
C22 | C23 | C28 | H14 | 1.8° | 0.0° |
C23 | C22 | N21 | H19 | 6.2° | 4.9° |
C23 | C24 | C25 | H11 | 180.0° | 180.0° |
C24 | C23 | C28 | C27 | 1.0° | 0.5° |
C23 | C24 | C25 | C26 | 0.9° | 0.0° |
C23 | C24 | C25 | H12 | 179.0° | 180.0° |
C24 | C23 | C28 | H14 | 179.0° | 179.8° |
C28 | C23 | C24 | C25 | 0.9° | 0.3° |
C23 | C28 | C27 | H14 | 180.0° | 179.7° |
C23 | C28 | C27 | C26 | 2.8° | 0.5° |
C23 | C28 | C27 | C30 | 176.3° | 179.7° |
C28 | C23 | C24 | H11 | 179.1° | 179.8° |
C24 | C25 | C26 | H12 | 180.0° | 180.0° |
C24 | C25 | C26 | C27 | 0.8° | 0.0° |
C24 | C25 | C26 | H13 | 179.2° | 180.0° |
C28 | C27 | C26 | C25 | 2.7° | 0.3° |
C28 | C27 | C26 | C30 | 179.0° | 179.8° |
C28 | C27 | C30 | F33 | 31.5° | 60.2° |
C28 | C27 | C30 | F32 | 86.9° | 179.7° |
C28 | C27 | C30 | F31 | 153.5° | 59.7° |
C28 | C27 | C26 | H13 | 177.3° | 179.8° |
C25 | C26 | C27 | H13 | 180.0° | 180.0° |
C25 | C26 | C27 | C30 | 176.3° | 180.0° |
C26 | C25 | C24 | H11 | 179.0° | 180.0° |
C26 | C27 | C30 | F33 | 147.5° | 120.0° |
C26 | C27 | C30 | F32 | 94.1° | 0.0° |
C26 | C27 | C30 | F31 | 25.5° | 120.0° |
C27 | C26 | C25 | H12 | 179.2° | 180.0° |
C26 | C27 | C28 | H14 | 177.2° | 179.8° |
C27 | C30 | F33 | F32 | 117.2° | 120.1° |
C27 | C30 | F33 | F31 | 125.5° | 120.0° |
C27 | C30 | F32 | F31 | 123.2° | 120.0° |
C30 | C27 | C26 | H13 | 3.7° | 0.0° |
C30 | C27 | C28 | H14 | 3.7° | 0.0° |
F33 | C30 | F32 | F31 | 116.9° | 120.0° |
H3 | C15 | C16 | H5 | 175.3° | 63.3° |
H3 | C15 | C16 | H6 | 54.9° | 56.8° |
H4 | C15 | C16 | H5 | 55.4° | 56.8° |
H4 | C15 | C16 | H6 | 64.9° | 176.9° |
H7 | C18 | C19 | H9 | 173.6° | 177.0° |
H7 | C18 | C19 | H10 | 53.7° | 56.9° |
H8 | C18 | C19 | H9 | 53.5° | 56.8° |
H8 | C18 | C19 | H10 | 66.4° | 63.3° |
H11 | C24 | C25 | H12 | 1.0° | 0.1° |
H12 | C25 | C26 | H13 | 0.8° | 0.1° |
H15 | C36 | C35 | H17 | 63.3° | 62.4° |
H15 | C36 | C35 | H18 | 56.2° | 57.6° |
H16 | C36 | C35 | H17 | 57.1° | 57.5° |
H16 | C36 | C35 | H18 | 176.6° | 177.6° |
H17 | C35 | C34 | H20 | 64.6° | 57.0° |
H18 | C35 | C34 | H20 | 54.9° | 177.2° |
H20 | C34 | C39 | H21 | 67.1° | 57.1° |
H20 | C34 | C39 | H22 | 52.8° | 177.1° |
H21 | C39 | C38 | H23 | 65.6° | 57.6° |
H21 | C39 | C38 | H24 | 54.1° | 62.5° |
H22 | C39 | C38 | H23 | 54.3° | 177.7° |
H22 | C39 | C38 | H24 | 174.0° | 57.6° |
H27 | C7 | H28 | H29 | 120.0° | 120.0° |