KZK
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3 | S | doub | 1.42Å | 1.42Å | |
C7 | C6 | sing | 1.51Å | 1.51Å | |
C7 | C8 | sing | 1.51Å | 1.50Å | |
C4 | O1 | sing | 1.43Å | 1.42Å | |
C9 | C8 | doub | 1.34Å | 1.36Å | Aromatic |
C9 | N1 | sing | 1.37Å | 1.36Å | Aromatic |
N | C5 | sing | 1.40Å | 1.41Å | |
N | C6 | sing | 1.35Å | 1.34Å | |
O1 | C3 | sing | 1.36Å | 1.36Å | |
C3 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
C3 | C2 | sing | 1.39Å | 1.38Å | Aromatic |
C5 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
C2 | C1 | doub | 1.38Å | 1.38Å | Aromatic |
C16 | C | doub | 1.38Å | 1.39Å | Aromatic |
C1 | C | sing | 1.38Å | 1.38Å | Aromatic |
C | S | sing | 1.76Å | 1.76Å | |
S | O | doub | 1.42Å | 1.42Å | |
S | N2 | sing | 1.66Å | 1.62Å | |
C6 | O2 | doub | 1.21Å | 1.22Å | |
C8 | C11 | sing | 1.47Å | 1.43Å | Aromatic |
N1 | C10 | sing | 1.38Å | 1.37Å | Aromatic |
C17 | N2 | sing | 1.43Å | 1.48Å | |
C17 | C18 | sing | 1.54Å | 1.51Å | |
N2 | C22 | sing | 1.50Å | 1.47Å | |
C18 | C19 | sing | 1.55Å | 1.50Å | |
C11 | C10 | doub | 1.41Å | 1.41Å | Aromatic |
C11 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
C10 | C15 | sing | 1.39Å | 1.38Å | Aromatic |
C22 | C21 | sing | 1.46Å | 1.51Å | |
C12 | C13 | doub | 1.37Å | 1.38Å | Aromatic |
C19 | C20 | sing | 1.50Å | 1.51Å | |
C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
C20 | C21 | sing | 1.53Å | 1.49Å | |
C13 | C14 | sing | 1.39Å | 1.38Å | Aromatic |
C4 | H1 | sing | 1.09Å | 1.10Å | |
C4 | H2 | sing | 1.09Å | 1.10Å | |
C4 | H3 | sing | 1.09Å | 1.10Å | |
N1 | H4 | sing | 0.97Å | 1.00Å | |
C7 | H5 | sing | 1.09Å | 1.10Å | |
C7 | H6 | sing | 1.09Å | 1.10Å | |
C9 | H7 | sing | 1.08Å | 1.08Å | |
C12 | H8 | sing | 1.08Å | 1.08Å | |
C13 | H9 | sing | 1.08Å | 1.08Å | |
C14 | H10 | sing | 1.08Å | 1.08Å | |
C15 | H11 | sing | 1.08Å | 1.08Å | |
C22 | H12 | sing | 1.09Å | 1.10Å | |
C22 | H13 | sing | 1.09Å | 1.10Å | |
C21 | H14 | sing | 1.09Å | 1.10Å | |
C21 | H15 | sing | 1.09Å | 1.10Å | |
C20 | H16 | sing | 1.09Å | 1.10Å | |
C20 | H17 | sing | 1.09Å | 1.10Å | |
C19 | H18 | sing | 1.09Å | 1.10Å | |
C19 | H19 | sing | 1.09Å | 1.10Å | |
C18 | H20 | sing | 1.09Å | 1.10Å | |
C18 | H21 | sing | 1.09Å | 1.10Å | |
C17 | H22 | sing | 1.09Å | 1.10Å | |
C17 | H23 | sing | 1.09Å | 1.10Å | |
C16 | H24 | sing | 1.08Å | 1.08Å | |
C2 | H25 | sing | 1.08Å | 1.08Å | |
C1 | H26 | sing | 1.08Å | 1.08Å | |
N | H27 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O3 | S | C | 108.0° | 106.4° |
O3 | S | O | 120.0° | 123.2° |
O3 | S | N2 | 106.5° | 106.4° |
C6 | C7 | C8 | 112.2° | 109.5° |
C7 | C6 | N | 114.7° | 120.0° |
C7 | C6 | O2 | 121.0° | 120.0° |
C6 | C7 | H5 | 108.8° | 109.5° |
C6 | C7 | H6 | 108.8° | 109.5° |
C7 | C8 | C9 | 127.3° | 126.5° |
C7 | C8 | C11 | 126.4° | 126.5° |
C8 | C7 | H5 | 108.8° | 109.5° |
C8 | C7 | H6 | 108.8° | 109.5° |
C4 | O1 | C3 | 117.2° | 117.0° |
O1 | C4 | H1 | 109.5° | 109.4° |
O1 | C4 | H2 | 109.5° | 109.4° |
O1 | C4 | H3 | 109.4° | 109.5° |
C8 | C9 | N1 | 110.3° | 110.0° |
C9 | C8 | C11 | 106.3° | 107.0° |
C8 | C9 | H7 | 124.9° | 125.0° |
C9 | N1 | C10 | 109.1° | 109.8° |
C9 | N1 | H4 | 125.5° | 125.1° |
N1 | C9 | H7 | 124.8° | 125.0° |
C5 | N | C6 | 127.8° | 119.9° |
N | C5 | C3 | 117.6° | 120.1° |
N | C5 | C16 | 123.1° | 120.1° |
C5 | N | H27 | 116.1° | 120.1° |
N | C6 | O2 | 124.2° | 120.0° |
C6 | N | H27 | 116.1° | 120.0° |
O1 | C3 | C5 | 115.2° | 120.1° |
O1 | C3 | C2 | 123.8° | 120.1° |
C5 | C3 | C2 | 121.0° | 119.8° |
C3 | C5 | C16 | 119.3° | 119.8° |
C3 | C2 | C1 | 119.7° | 120.0° |
C3 | C2 | H25 | 120.2° | 120.0° |
C5 | C16 | C | 119.1° | 120.0° |
C5 | C16 | H24 | 120.4° | 120.0° |
C2 | C1 | C | 119.5° | 120.2° |
C1 | C2 | H25 | 120.1° | 120.0° |
C2 | C1 | H26 | 120.2° | 119.9° |
C16 | C | C1 | 121.4° | 120.1° |
C16 | C | S | 119.1° | 119.9° |
C | C16 | H24 | 120.5° | 120.0° |
C1 | C | S | 119.4° | 119.9° |
C | C1 | H26 | 120.2° | 119.9° |
C | S | O | 108.3° | 106.4° |
C | S | N2 | 106.6° | 107.2° |
O | S | N2 | 106.7° | 106.4° |
S | N2 | C17 | 116.0° | 120.5° |
S | N2 | C22 | 118.3° | 120.5° |
C8 | C11 | C10 | 107.0° | 106.0° |
C8 | C11 | C12 | 134.3° | 134.0° |
N1 | C10 | C11 | 107.3° | 107.2° |
N1 | C10 | C15 | 130.9° | 133.5° |
C10 | N1 | H4 | 125.5° | 125.1° |
N2 | C17 | C18 | 114.3° | 116.4° |
C17 | N2 | C22 | 125.5° | 118.9° |
N2 | C17 | H22 | 108.2° | 108.2° |
N2 | C17 | H23 | 108.3° | 108.2° |
C17 | C18 | C19 | 111.3° | 110.1° |
C17 | C18 | H20 | 109.0° | 109.5° |
C17 | C18 | H21 | 109.0° | 109.2° |
C18 | C17 | H22 | 108.3° | 108.1° |
C18 | C17 | H23 | 108.2° | 107.8° |
N2 | C22 | C21 | 114.9° | 107.5° |
N2 | C22 | H12 | 108.1° | 109.8° |
N2 | C22 | H13 | 108.1° | 109.9° |
C18 | C19 | C20 | 114.9° | 110.8° |
C18 | C19 | H18 | 108.1° | 109.2° |
C18 | C19 | H19 | 108.1° | 109.2° |
C19 | C18 | H20 | 109.0° | 109.4° |
C19 | C18 | H21 | 109.0° | 109.4° |
C10 | C11 | C12 | 118.6° | 119.9° |
C11 | C10 | C15 | 121.8° | 119.4° |
C11 | C12 | C13 | 119.8° | 119.7° |
C11 | C12 | H8 | 120.1° | 120.1° |
C10 | C15 | C14 | 118.2° | 119.7° |
C10 | C15 | H11 | 120.9° | 120.1° |
C22 | C21 | C20 | 112.9° | 114.3° |
C21 | C22 | H12 | 108.1° | 109.8° |
C21 | C22 | H13 | 108.1° | 109.9° |
C22 | C21 | H14 | 108.6° | 108.5° |
C22 | C21 | H15 | 108.6° | 108.6° |
C12 | C13 | C14 | 120.6° | 120.5° |
C13 | C12 | H8 | 120.1° | 120.2° |
C12 | C13 | H9 | 119.7° | 119.7° |
C19 | C20 | C21 | 114.4° | 105.4° |
C19 | C20 | H16 | 108.2° | 110.3° |
C19 | C20 | H17 | 108.2° | 110.4° |
C20 | C19 | H18 | 108.1° | 109.2° |
C20 | C19 | H19 | 108.1° | 109.2° |
C15 | C14 | C13 | 120.9° | 120.7° |
C15 | C14 | H10 | 119.5° | 119.7° |
C14 | C15 | H11 | 120.9° | 120.1° |
C20 | C21 | H14 | 108.6° | 108.5° |
C20 | C21 | H15 | 108.6° | 108.4° |
C21 | C20 | H16 | 108.2° | 110.3° |
C21 | C20 | H17 | 108.2° | 110.2° |
C14 | C13 | H9 | 119.7° | 119.8° |
C13 | C14 | H10 | 119.6° | 119.6° |
H1 | C4 | H2 | 109.4° | 109.5° |
H1 | C4 | H3 | 109.5° | 109.5° |
H2 | C4 | H3 | 109.5° | 109.5° |
H5 | C7 | H6 | 109.5° | 109.4° |
H12 | C22 | H13 | 109.5° | 109.9° |
H14 | C21 | H15 | 109.5° | 108.4° |
H16 | C20 | H17 | 109.5° | 110.2° |
H18 | C19 | H19 | 109.5° | 109.2° |
H20 | C18 | H21 | 109.5° | 109.3° |
H22 | C17 | H23 | 109.5° | 107.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3 | S | C | C16 | 64.0° | 156.4° |
O3 | S | C | C1 | 114.2° | 23.5° |
O3 | S | C | O | 131.4° | 132.9° |
O3 | S | C | N2 | 114.2° | 113.6° |
O3 | S | O | N2 | 121.1° | 123.0° |
O3 | S | N2 | C17 | 20.7° | 156.2° |
O3 | S | N2 | C22 | 164.6° | 23.5° |
C6 | C7 | C8 | H5 | 120.4° | 120.0° |
C6 | C7 | C8 | H6 | 120.4° | 120.0° |
C6 | C7 | C8 | C9 | 109.8° | 94.5° |
C7 | C6 | N | C5 | 162.1° | 174.5° |
C7 | C6 | N | O2 | 179.9° | 180.0° |
C6 | C7 | C8 | C11 | 69.2° | 85.0° |
C6 | C7 | H5 | H6 | 118.8° | 120.0° |
C7 | C6 | N | H27 | 17.9° | 5.5° |
C7 | C8 | C9 | C11 | 179.2° | 179.6° |
C7 | C8 | C9 | N1 | 178.8° | 179.8° |
C8 | C7 | C6 | N | 163.1° | 180.0° |
C8 | C7 | C6 | O2 | 16.9° | 0.0° |
C7 | C8 | C11 | C10 | 178.8° | 180.0° |
C7 | C8 | C11 | C12 | 3.3° | 0.4° |
C8 | C7 | H5 | H6 | 118.8° | 120.0° |
C7 | C8 | C9 | H7 | 1.2° | 0.1° |
C4 | O1 | C3 | C5 | 173.6° | 180.0° |
C4 | O1 | C3 | C2 | 6.5° | 0.0° |
O1 | C4 | H1 | H2 | 120.0° | 119.9° |
O1 | C4 | H1 | H3 | 120.0° | 120.0° |
O1 | C4 | H2 | H3 | 120.0° | 120.0° |
C8 | C9 | N1 | H7 | 180.0° | 179.9° |
C8 | C9 | N1 | C10 | 0.2° | 0.1° |
C9 | C8 | C11 | C10 | 0.3° | 0.4° |
C9 | C8 | C11 | C12 | 177.5° | 180.0° |
C8 | C9 | N1 | H4 | 179.7° | 179.8° |
C9 | C8 | C7 | H5 | 129.8° | 145.5° |
C9 | C8 | C7 | H6 | 10.7° | 25.5° |
N1 | C9 | C8 | C11 | 0.3° | 0.2° |
C9 | N1 | C10 | H4 | 180.0° | 179.8° |
C9 | N1 | C10 | C11 | 0.0° | 0.3° |
C9 | N1 | C10 | C15 | 178.5° | 179.8° |
C5 | N | C6 | H27 | 180.0° | 180.0° |
N | C5 | C3 | O1 | 1.4° | 0.2° |
N | C5 | C3 | C16 | 178.9° | 179.8° |
N | C5 | C3 | C2 | 178.6° | 179.7° |
N | C5 | C16 | C | 178.3° | 179.7° |
C5 | N | C6 | O2 | 17.8° | 5.6° |
N | C5 | C16 | H24 | 1.7° | 0.2° |
C6 | N | C5 | C3 | 162.0° | 155.4° |
C6 | N | C5 | C16 | 19.1° | 24.8° |
N | C6 | C7 | H5 | 42.7° | 60.0° |
N | C6 | C7 | H6 | 76.5° | 60.0° |
O1 | C3 | C5 | C2 | 180.0° | 180.0° |
O1 | C3 | C5 | C16 | 179.7° | 180.0° |
O1 | C3 | C2 | C1 | 179.8° | 179.9° |
C3 | O1 | C4 | H1 | 180.0° | 60.1° |
C3 | O1 | C4 | H2 | 60.0° | 180.0° |
C3 | O1 | C4 | H3 | 60.0° | 60.0° |
O1 | C3 | C2 | H25 | 0.2° | 0.0° |
C5 | C3 | C2 | C1 | 0.2° | 0.0° |
C3 | C5 | C16 | C | 0.5° | 0.1° |
C3 | C5 | C16 | H24 | 179.4° | 180.0° |
C5 | C3 | C2 | H25 | 179.8° | 180.0° |
C3 | C5 | N | H27 | 18.0° | 24.6° |
C2 | C3 | C5 | C16 | 0.3° | 0.0° |
C3 | C2 | C1 | H25 | 180.0° | 180.0° |
C3 | C2 | C1 | C | 0.3° | 0.1° |
C3 | C2 | C1 | H26 | 179.7° | 179.9° |
C5 | C16 | C | H24 | 180.0° | 179.9° |
C5 | C16 | C | C1 | 0.7° | 0.1° |
C5 | C16 | C | S | 177.5° | 180.0° |
C16 | C5 | N | H27 | 160.9° | 155.2° |
C2 | C1 | C | C16 | 0.6° | 0.0° |
C2 | C1 | C | H26 | 180.0° | 179.9° |
C2 | C1 | C | S | 177.6° | 179.9° |
C16 | C | C1 | S | 178.2° | 179.9° |
C16 | C | S | O | 164.6° | 23.5° |
C16 | C | S | N2 | 50.1° | 90.0° |
C16 | C | C1 | H26 | 179.4° | 179.9° |
C1 | C | S | O | 17.2° | 156.4° |
C1 | C | S | N2 | 131.6° | 90.0° |
C1 | C | C16 | H24 | 179.3° | 179.9° |
C | C1 | C2 | H25 | 179.7° | 180.0° |
C | S | O | N2 | 114.4° | 114.1° |
C | S | N2 | C17 | 94.5° | 90.3° |
C | S | N2 | C22 | 80.2° | 90.0° |
S | C | C16 | H24 | 2.5° | 0.1° |
S | C | C1 | H26 | 2.4° | 0.1° |
O | S | N2 | C17 | 150.0° | 23.2° |
O | S | N2 | C22 | 35.3° | 156.5° |
S | N2 | C17 | C22 | 174.3° | 179.7° |
S | N2 | C17 | C18 | 149.6° | 88.3° |
S | N2 | C22 | C21 | 128.5° | 109.6° |
S | N2 | C22 | H12 | 110.7° | 131.0° |
S | N2 | C22 | H13 | 7.8° | 10.0° |
S | N2 | C17 | H22 | 89.7° | 33.6° |
S | N2 | C17 | H23 | 28.9° | 150.2° |
O2 | C6 | C7 | H5 | 137.3° | 120.0° |
O2 | C6 | C7 | H6 | 103.5° | 120.0° |
O2 | C6 | N | H27 | 162.2° | 174.4° |
C8 | C11 | C10 | N1 | 0.2° | 0.4° |
C8 | C11 | C10 | C12 | 178.2° | 179.7° |
C8 | C11 | C10 | C15 | 178.9° | 179.7° |
C8 | C11 | C12 | C13 | 177.4° | 180.0° |
C11 | C8 | C7 | H5 | 51.2° | 35.0° |
C11 | C8 | C7 | H6 | 170.4° | 155.0° |
C11 | C8 | C9 | H7 | 179.6° | 179.7° |
C8 | C11 | C12 | H8 | 2.6° | 0.1° |
N1 | C10 | C11 | C15 | 178.7° | 179.9° |
N1 | C10 | C11 | C12 | 178.0° | 179.9° |
N1 | C10 | C15 | C14 | 177.2° | 178.9° |
C10 | N1 | C9 | H7 | 179.7° | 180.0° |
N1 | C10 | C15 | H11 | 2.8° | 0.1° |
N2 | C17 | C18 | H22 | 120.7° | 121.9° |
N2 | C17 | C18 | H23 | 120.7° | 121.7° |
N2 | C17 | C18 | C19 | 64.1° | 41.3° |
C17 | N2 | C22 | C21 | 45.6° | 70.1° |
C17 | N2 | C22 | H12 | 75.2° | 49.3° |
C17 | N2 | C22 | H13 | 166.4° | 170.3° |
N2 | C17 | C18 | H20 | 175.6° | 161.6° |
N2 | C17 | C18 | H21 | 56.1° | 78.8° |
N2 | C17 | H22 | H23 | 117.8° | 116.8° |
C18 | C17 | N2 | C22 | 36.1° | 91.4° |
C17 | C18 | C19 | H20 | 120.3° | 120.3° |
C17 | C18 | C19 | H21 | 120.3° | 120.0° |
C17 | C18 | C19 | C20 | 6.7° | 39.0° |
C17 | C18 | C19 | H18 | 127.5° | 159.3° |
C17 | C18 | C19 | H19 | 114.1° | 81.3° |
C17 | C18 | H20 | H21 | 119.2° | 119.6° |
C18 | C17 | H22 | H23 | 117.8° | 116.4° |
N2 | C22 | C21 | H12 | 120.8° | 119.5° |
N2 | C22 | C21 | H13 | 120.8° | 119.5° |
N2 | C22 | C21 | C20 | 37.8° | 58.4° |
N2 | C22 | H12 | H13 | 117.5° | 121.0° |
N2 | C22 | C21 | H14 | 158.3° | 179.6° |
N2 | C22 | C21 | H15 | 82.7° | 62.7° |
C22 | N2 | C17 | H22 | 84.6° | 146.7° |
C22 | N2 | C17 | H23 | 156.9° | 30.1° |
C18 | C19 | C20 | H18 | 120.8° | 120.3° |
C18 | C19 | C20 | H19 | 120.8° | 120.3° |
C18 | C19 | C20 | C21 | 85.0° | 97.7° |
C18 | C19 | C20 | H16 | 35.7° | 21.3° |
C18 | C19 | C20 | H17 | 154.3° | 143.3° |
C18 | C19 | H18 | H19 | 117.5° | 119.3° |
C19 | C18 | H20 | H21 | 119.2° | 119.7° |
C19 | C18 | C17 | H22 | 56.6° | 163.2° |
C19 | C18 | C17 | H23 | 175.1° | 80.4° |
C10 | C11 | C12 | C13 | 0.2° | 0.4° |
C11 | C10 | C15 | C14 | 1.2° | 1.0° |
C11 | C10 | N1 | H4 | 179.9° | 179.9° |
C10 | C11 | C12 | H8 | 179.8° | 179.5° |
C11 | C10 | C15 | H11 | 178.8° | 179.9° |
C12 | C11 | C10 | C15 | 0.7° | 0.0° |
C11 | C12 | C13 | H8 | 180.0° | 179.9° |
C11 | C12 | C13 | C14 | 0.6° | 0.1° |
C11 | C12 | C13 | H9 | 179.4° | 180.0° |
C10 | C15 | C14 | H11 | 180.0° | 179.0° |
C10 | C15 | C14 | C13 | 0.7° | 1.5° |
C15 | C10 | N1 | H4 | 1.5° | 0.0° |
C10 | C15 | C14 | H10 | 179.3° | 179.5° |
C22 | C21 | C20 | C19 | 46.2° | 89.4° |
C22 | C21 | C20 | H14 | 120.5° | 121.2° |
C22 | C21 | C20 | H15 | 120.5° | 121.2° |
C21 | C22 | H12 | H13 | 117.5° | 121.0° |
C22 | C21 | H14 | H15 | 118.4° | 117.8° |
C22 | C21 | C20 | H16 | 74.6° | 29.6° |
C22 | C21 | C20 | H17 | 166.9° | 151.5° |
C12 | C13 | C14 | C15 | 0.1° | 1.1° |
C12 | C13 | C14 | H9 | 180.0° | 179.9° |
C12 | C13 | C14 | H10 | 179.9° | 179.9° |
C19 | C20 | C21 | H16 | 120.7° | 119.0° |
C19 | C20 | C21 | H17 | 120.7° | 119.1° |
C19 | C20 | C21 | H14 | 74.4° | 149.3° |
C19 | C20 | C21 | H15 | 166.6° | 31.8° |
C19 | C20 | H16 | H17 | 117.8° | 122.1° |
C20 | C19 | H18 | H19 | 117.6° | 119.4° |
C20 | C19 | C18 | H20 | 113.5° | 81.4° |
C20 | C19 | C18 | H21 | 127.0° | 158.9° |
C15 | C14 | C13 | H10 | 180.0° | 179.0° |
C15 | C14 | C13 | H9 | 179.9° | 179.0° |
C20 | C21 | C22 | H12 | 83.0° | 61.1° |
C20 | C21 | C22 | H13 | 158.6° | 177.9° |
C20 | C21 | H14 | H15 | 118.4° | 117.5° |
C21 | C20 | H16 | H17 | 117.7° | 121.9° |
C21 | C20 | C19 | H18 | 154.2° | 142.0° |
C21 | C20 | C19 | H19 | 35.7° | 22.6° |
C14 | C13 | C12 | H8 | 179.4° | 180.0° |
C13 | C14 | C15 | H11 | 179.2° | 179.5° |
H1 | C4 | H2 | H3 | 120.0° | 120.1° |
H4 | N1 | C9 | H7 | 0.3° | 0.3° |
H8 | C12 | C13 | H9 | 0.6° | 0.0° |
H9 | C13 | C14 | H10 | 0.1° | 0.0° |
H10 | C14 | C15 | H11 | 0.7° | 0.6° |
H12 | C22 | C21 | H14 | 37.5° | 60.1° |
H12 | C22 | C21 | H15 | 156.5° | 177.8° |
H13 | C22 | C21 | H14 | 80.9° | 60.8° |
H13 | C22 | C21 | H15 | 38.1° | 56.8° |
H14 | C21 | C20 | H16 | 164.9° | 91.6° |
H14 | C21 | C20 | H17 | 46.3° | 30.2° |
H15 | C21 | C20 | H16 | 45.9° | 150.8° |
H15 | C21 | C20 | H17 | 72.7° | 87.3° |
H16 | C20 | C19 | H18 | 85.1° | 99.0° |
H16 | C20 | C19 | H19 | 156.5° | 141.6° |
H17 | C20 | C19 | H18 | 33.5° | 22.9° |
H17 | C20 | C19 | H19 | 84.9° | 96.4° |
H18 | C19 | C18 | H20 | 7.2° | 39.0° |
H18 | C19 | C18 | H21 | 112.2° | 80.7° |
H19 | C19 | C18 | H20 | 125.7° | 158.3° |
H19 | C19 | C18 | H21 | 6.2° | 38.6° |
H20 | C18 | C17 | H22 | 63.7° | 76.5° |
H20 | C18 | C17 | H23 | 54.9° | 39.9° |
H21 | C18 | C17 | H22 | 176.8° | 43.1° |
H21 | C18 | C17 | H23 | 64.6° | 159.5° |
H25 | C2 | C1 | H26 | 0.3° | 0.1° |