Z7F
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O2 | S1 | doub | 1.42Å | 1.44Å | |
C22 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
C22 | C21 | sing | 1.38Å | 1.37Å | Aromatic |
O3 | S1 | doub | 1.42Å | 1.44Å | |
F2 | C21 | sing | 1.35Å | 1.35Å | |
C23 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
S1 | C7 | sing | 1.81Å | 1.83Å | |
S1 | C13 | sing | 1.76Å | 1.76Å | |
C11 | C12 | sing | 1.54Å | 1.52Å | |
C11 | C7 | sing | 1.55Å | 1.55Å | |
C21 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
C3 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
C3 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
C12 | N1 | sing | 1.47Å | 1.47Å | |
C7 | C4 | sing | 1.50Å | 1.53Å | |
C7 | C8 | sing | 1.54Å | 1.60Å | |
C13 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
C24 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
C18 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
C2 | C1 | sing | 1.39Å | 1.38Å | Aromatic |
C29 | C28 | sing | 1.53Å | 1.53Å | |
C29 | C30 | sing | 1.53Å | 1.54Å | |
C20 | C25 | sing | 1.38Å | 1.41Å | Aromatic |
C20 | C19 | sing | 1.51Å | 1.51Å | |
C4 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
N1 | C26 | sing | 1.35Å | 1.35Å | |
N1 | C8 | sing | 1.48Å | 1.47Å | |
O6 | C33 | sing | 1.34Å | 1.31Å | |
C27 | C28 | sing | 1.53Å | 1.53Å | |
C27 | C26 | sing | 1.51Å | 1.53Å | |
C27 | C32 | sing | 1.53Å | 1.53Å | |
C14 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
C26 | O4 | doub | 1.21Å | 1.22Å | |
C25 | CL1 | sing | 1.74Å | 1.73Å | |
C33 | O5 | doub | 1.21Å | 1.22Å | |
C33 | C30 | sing | 1.51Å | 1.51Å | |
C8 | C9 | sing | 1.53Å | 1.53Å | |
C17 | C16 | doub | 1.38Å | 1.37Å | Aromatic |
C30 | C31 | sing | 1.53Å | 1.53Å | |
C31 | C32 | sing | 1.53Å | 1.52Å | |
C19 | O1 | sing | 1.43Å | 1.44Å | |
C1 | O1 | sing | 1.36Å | 1.37Å | |
C1 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
C15 | C16 | sing | 1.38Å | 1.36Å | Aromatic |
C5 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
C5 | C10 | sing | 1.51Å | 1.51Å | |
C16 | F1 | sing | 1.35Å | 1.35Å | |
C9 | C10 | sing | 1.53Å | 1.52Å | |
C2 | H1 | sing | 1.08Å | 1.08Å | |
C3 | H2 | sing | 1.08Å | 1.08Å | |
C6 | H3 | sing | 1.08Å | 1.08Å | |
C8 | H4 | sing | 1.09Å | 1.10Å | |
C9 | H6 | sing | 1.09Å | 1.10Å | |
C9 | H5 | sing | 1.09Å | 1.10Å | |
C10 | H8 | sing | 1.09Å | 1.10Å | |
C10 | H7 | sing | 1.09Å | 1.10Å | |
C11 | H9 | sing | 1.09Å | 1.10Å | |
C11 | H10 | sing | 1.09Å | 1.10Å | |
C12 | H11 | sing | 1.09Å | 1.10Å | |
C12 | H12 | sing | 1.09Å | 1.10Å | |
C14 | H13 | sing | 1.08Å | 1.08Å | |
C15 | H14 | sing | 1.08Å | 1.08Å | |
C17 | H15 | sing | 1.08Å | 1.08Å | |
C18 | H16 | sing | 1.08Å | 1.08Å | |
C19 | H17 | sing | 1.09Å | 1.10Å | |
C19 | H18 | sing | 1.09Å | 1.10Å | |
C22 | H19 | sing | 1.08Å | 1.08Å | |
C23 | H20 | sing | 1.08Å | 1.08Å | |
C24 | H21 | sing | 1.08Å | 1.08Å | |
C27 | H22 | sing | 1.09Å | 1.10Å | |
C28 | H23 | sing | 1.09Å | 1.10Å | |
C28 | H24 | sing | 1.09Å | 1.10Å | |
C29 | H26 | sing | 1.09Å | 1.10Å | |
C29 | H25 | sing | 1.09Å | 1.10Å | |
C30 | H27 | sing | 1.09Å | 1.10Å | |
C31 | H29 | sing | 1.09Å | 1.10Å | |
C31 | H28 | sing | 1.09Å | 1.10Å | |
C32 | H30 | sing | 1.09Å | 1.10Å | |
C32 | H31 | sing | 1.09Å | 1.10Å | |
O6 | H32 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O2 | S1 | O3 | 118.3° | 121.0° |
O2 | S1 | C7 | 107.7° | 110.5° |
O2 | S1 | C13 | 108.4° | 104.3° |
C23 | C22 | C21 | 118.6° | 120.0° |
C22 | C23 | C24 | 120.4° | 120.1° |
C23 | C22 | H19 | 120.7° | 120.0° |
C22 | C23 | H20 | 119.8° | 119.9° |
C22 | C21 | F2 | 117.7° | 120.0° |
C22 | C21 | C20 | 124.4° | 120.0° |
C21 | C22 | H19 | 120.7° | 120.0° |
O3 | S1 | C7 | 107.3° | 110.6° |
O3 | S1 | C13 | 107.7° | 104.3° |
F2 | C21 | C20 | 117.9° | 120.0° |
C23 | C24 | C25 | 119.4° | 120.0° |
C24 | C23 | H20 | 119.8° | 120.0° |
C23 | C24 | H21 | 120.3° | 119.9° |
C7 | S1 | C13 | 106.9° | 104.4° |
S1 | C7 | C11 | 110.9° | 110.6° |
S1 | C7 | C4 | 108.3° | 109.9° |
S1 | C7 | C8 | 110.7° | 110.0° |
S1 | C13 | C18 | 119.5° | 120.0° |
S1 | C13 | C14 | 119.0° | 120.0° |
C12 | C11 | C7 | 106.4° | 102.7° |
C11 | C12 | N1 | 102.9° | 107.3° |
C12 | C11 | H9 | 110.2° | 110.7° |
C12 | C11 | H10 | 110.2° | 110.8° |
C11 | C12 | H11 | 111.1° | 109.9° |
C11 | C12 | H12 | 111.1° | 109.9° |
C11 | C7 | C4 | 108.0° | 110.5° |
C11 | C7 | C8 | 104.9° | 102.4° |
C7 | C11 | H9 | 110.2° | 110.8° |
C7 | C11 | H10 | 110.2° | 110.7° |
C21 | C20 | C25 | 114.8° | 120.0° |
C21 | C20 | C19 | 120.2° | 120.0° |
C2 | C3 | C4 | 121.5° | 120.9° |
C3 | C2 | C1 | 119.6° | 119.9° |
C3 | C2 | H1 | 120.2° | 120.1° |
C2 | C3 | H2 | 119.3° | 119.6° |
C3 | C4 | C7 | 120.9° | 117.6° |
C3 | C4 | C5 | 118.7° | 119.1° |
C4 | C3 | H2 | 119.3° | 119.6° |
C12 | N1 | C26 | 128.5° | 125.7° |
C12 | N1 | C8 | 109.8° | 108.6° |
N1 | C12 | H11 | 111.1° | 109.9° |
N1 | C12 | H12 | 111.1° | 109.9° |
C4 | C7 | C8 | 113.9° | 113.2° |
C7 | C4 | C5 | 120.2° | 123.2° |
C7 | C8 | N1 | 102.5° | 104.7° |
C7 | C8 | C9 | 115.9° | 109.7° |
C7 | C8 | H4 | 108.8° | 111.2° |
C18 | C13 | C14 | 120.8° | 120.1° |
C13 | C18 | C17 | 119.4° | 120.0° |
C13 | C18 | H16 | 120.3° | 120.0° |
C13 | C14 | C15 | 119.5° | 120.0° |
C13 | C14 | H13 | 120.2° | 120.0° |
C24 | C25 | C20 | 122.4° | 120.0° |
C24 | C25 | CL1 | 116.5° | 120.0° |
C25 | C24 | H21 | 120.3° | 120.0° |
C18 | C17 | C16 | 118.2° | 120.0° |
C18 | C17 | H15 | 120.9° | 120.0° |
C17 | C18 | H16 | 120.3° | 120.0° |
C2 | C1 | O1 | 125.6° | 120.3° |
C2 | C1 | C6 | 120.0° | 119.4° |
C1 | C2 | H1 | 120.2° | 120.1° |
C28 | C29 | C30 | 111.9° | 109.5° |
C29 | C28 | C27 | 110.8° | 109.4° |
C29 | C28 | H23 | 109.1° | 109.4° |
C29 | C28 | H24 | 109.2° | 109.5° |
C28 | C29 | H26 | 108.9° | 109.4° |
C28 | C29 | H25 | 108.9° | 109.4° |
C29 | C30 | C33 | 111.0° | 109.5° |
C29 | C30 | C31 | 109.9° | 109.5° |
C30 | C29 | H26 | 108.8° | 109.5° |
C30 | C29 | H25 | 108.8° | 109.5° |
C29 | C30 | H27 | 108.5° | 109.5° |
C25 | C20 | C19 | 124.7° | 120.0° |
C20 | C25 | CL1 | 121.0° | 120.0° |
C20 | C19 | O1 | 108.4° | 109.5° |
C20 | C19 | H17 | 109.7° | 109.5° |
C20 | C19 | H18 | 109.7° | 109.5° |
C4 | C5 | C6 | 119.7° | 120.2° |
C4 | C5 | C10 | 120.8° | 121.7° |
C26 | N1 | C8 | 121.3° | 125.7° |
N1 | C26 | C27 | 118.5° | 120.0° |
N1 | C26 | O4 | 120.7° | 120.0° |
N1 | C8 | C9 | 108.9° | 107.9° |
N1 | C8 | H4 | 110.6° | 111.9° |
O6 | C33 | O5 | 123.4° | 120.0° |
O6 | C33 | C30 | 113.9° | 120.0° |
C33 | O6 | H32 | 109.5° | 117.0° |
C28 | C27 | C26 | 111.3° | 109.4° |
C28 | C27 | C32 | 108.4° | 109.5° |
C28 | C27 | H22 | 108.9° | 109.4° |
C27 | C28 | H23 | 109.1° | 109.5° |
C27 | C28 | H24 | 109.1° | 109.5° |
C26 | C27 | C32 | 110.3° | 109.5° |
C27 | C26 | O4 | 120.8° | 120.0° |
C26 | C27 | H22 | 108.9° | 109.5° |
C27 | C32 | C31 | 110.6° | 109.5° |
C32 | C27 | H22 | 108.9° | 109.5° |
C27 | C32 | H30 | 109.2° | 109.4° |
C27 | C32 | H31 | 109.2° | 109.4° |
C14 | C15 | C16 | 118.4° | 120.0° |
C15 | C14 | H13 | 120.2° | 120.0° |
C14 | C15 | H14 | 120.8° | 120.0° |
O5 | C33 | C30 | 122.6° | 120.0° |
C33 | C30 | C31 | 110.0° | 109.4° |
C33 | C30 | H27 | 108.8° | 109.5° |
C8 | C9 | C10 | 107.5° | 109.3° |
C9 | C8 | H4 | 109.8° | 111.1° |
C8 | C9 | H6 | 110.0° | 109.5° |
C8 | C9 | H5 | 110.0° | 109.6° |
C17 | C16 | C15 | 123.4° | 120.0° |
C17 | C16 | F1 | 118.3° | 120.0° |
C16 | C17 | H15 | 120.9° | 120.1° |
C30 | C31 | C32 | 111.6° | 109.5° |
C31 | C30 | H27 | 108.5° | 109.5° |
C30 | C31 | H29 | 108.9° | 109.5° |
C30 | C31 | H28 | 108.9° | 109.5° |
C32 | C31 | H29 | 108.9° | 109.5° |
C32 | C31 | H28 | 108.9° | 109.4° |
C31 | C32 | H30 | 109.2° | 109.5° |
C31 | C32 | H31 | 109.2° | 109.5° |
C19 | O1 | C1 | 118.5° | 117.1° |
O1 | C19 | H17 | 109.7° | 109.5° |
O1 | C19 | H18 | 109.8° | 109.5° |
O1 | C1 | C6 | 114.3° | 120.3° |
C1 | C6 | C5 | 120.5° | 120.5° |
C1 | C6 | H3 | 119.8° | 119.8° |
C15 | C16 | F1 | 118.1° | 120.1° |
C16 | C15 | H14 | 120.8° | 120.0° |
C6 | C5 | C10 | 119.4° | 118.1° |
C5 | C6 | H3 | 119.7° | 119.8° |
C5 | C10 | C9 | 112.2° | 109.7° |
C5 | C10 | H8 | 108.8° | 109.5° |
C5 | C10 | H7 | 108.8° | 109.4° |
C10 | C9 | H6 | 109.9° | 109.5° |
C10 | C9 | H5 | 109.9° | 109.5° |
C9 | C10 | H8 | 108.8° | 109.4° |
C9 | C10 | H7 | 108.8° | 109.4° |
H6 | C9 | H5 | 109.5° | 109.6° |
H8 | C10 | H7 | 109.5° | 109.4° |
H9 | C11 | H10 | 109.5° | 110.8° |
H11 | C12 | H12 | 109.5° | 110.0° |
H17 | C19 | H18 | 109.5° | 109.4° |
H23 | C28 | H24 | 109.5° | 109.5° |
H26 | C29 | H25 | 109.5° | 109.5° |
H29 | C31 | H28 | 109.5° | 109.5° |
H30 | C32 | H31 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O2 | S1 | O3 | C7 | 122.0° | 131.5° |
O2 | S1 | O3 | C13 | 123.3° | 116.8° |
O2 | S1 | C7 | C13 | 116.3° | 111.6° |
O2 | S1 | C7 | C11 | 58.6° | 71.6° |
O2 | S1 | C7 | C4 | 59.8° | 166.2° |
O2 | S1 | C7 | C8 | 174.6° | 40.8° |
O2 | S1 | C13 | C18 | 27.3° | 24.7° |
O2 | S1 | C13 | C14 | 161.9° | 155.6° |
C23 | C22 | C21 | H19 | 180.0° | 179.9° |
C23 | C22 | C21 | F2 | 177.0° | 180.0° |
C22 | C23 | C24 | H20 | 180.0° | 179.9° |
C23 | C22 | C21 | C20 | 0.1° | 0.1° |
C22 | C23 | C24 | C25 | 1.0° | 0.1° |
C22 | C23 | C24 | H21 | 179.0° | 179.9° |
C22 | C21 | F2 | C20 | 177.1° | 180.0° |
C21 | C22 | C23 | C24 | 0.9° | 0.1° |
C22 | C21 | C20 | C25 | 0.6° | 0.0° |
C22 | C21 | C20 | C19 | 174.2° | 179.8° |
C21 | C22 | C23 | H20 | 179.1° | 180.0° |
O3 | S1 | C7 | C13 | 115.3° | 111.7° |
O3 | S1 | C7 | C11 | 69.8° | 65.2° |
O3 | S1 | C7 | C4 | 171.8° | 57.1° |
O3 | S1 | C7 | C8 | 46.2° | 177.6° |
O3 | S1 | C13 | C18 | 156.4° | 152.6° |
O3 | S1 | C13 | C14 | 32.8° | 27.7° |
F2 | C21 | C20 | C25 | 176.3° | 180.0° |
F2 | C21 | C20 | C19 | 2.7° | 0.3° |
F2 | C21 | C22 | H19 | 3.0° | 0.0° |
C23 | C24 | C25 | H21 | 180.0° | 179.9° |
C23 | C24 | C25 | C20 | 0.2° | 0.1° |
C23 | C24 | C25 | CL1 | 177.2° | 179.7° |
C24 | C23 | C22 | H19 | 179.1° | 180.0° |
S1 | C7 | C11 | C12 | 127.9° | 82.1° |
S1 | C7 | C11 | C4 | 118.6° | 122.0° |
S1 | C7 | C11 | C8 | 119.6° | 117.2° |
S1 | C7 | C4 | C3 | 70.4° | 48.4° |
S1 | C7 | C4 | C8 | 123.7° | 123.5° |
C7 | S1 | C13 | C18 | 88.6° | 91.3° |
C7 | S1 | C13 | C14 | 82.2° | 88.4° |
S1 | C7 | C4 | C5 | 106.2° | 131.7° |
S1 | C7 | C8 | N1 | 106.0° | 81.0° |
S1 | C7 | C8 | C9 | 135.5° | 163.4° |
S1 | C7 | C8 | H4 | 11.2° | 40.1° |
S1 | C7 | C11 | H9 | 8.4° | 159.6° |
S1 | C7 | C11 | H10 | 112.6° | 36.2° |
C13 | S1 | C7 | C11 | 174.9° | 176.8° |
C13 | S1 | C7 | C4 | 56.5° | 54.6° |
C13 | S1 | C7 | C8 | 69.0° | 70.8° |
S1 | C13 | C18 | C14 | 170.6° | 179.7° |
S1 | C13 | C18 | C17 | 166.5° | 179.8° |
S1 | C13 | C14 | C15 | 166.7° | 180.0° |
S1 | C13 | C14 | H13 | 13.3° | 0.1° |
S1 | C13 | C18 | H16 | 13.5° | 0.0° |
C12 | C11 | C7 | H9 | 119.5° | 118.3° |
C12 | C11 | C7 | H10 | 119.5° | 118.3° |
C11 | C12 | N1 | H11 | 119.0° | 119.4° |
C11 | C12 | N1 | H12 | 118.9° | 119.5° |
C12 | C11 | C7 | C4 | 113.6° | 155.9° |
C12 | C11 | C7 | C8 | 8.3° | 35.1° |
C11 | C12 | N1 | C26 | 148.5° | 178.8° |
C11 | C12 | N1 | C8 | 38.5° | 1.2° |
C12 | C11 | H9 | H10 | 121.4° | 123.4° |
C11 | C12 | H11 | H12 | 123.0° | 121.1° |
C11 | C7 | C4 | C3 | 49.8° | 74.0° |
C7 | C11 | C12 | N1 | 27.2° | 21.6° |
C11 | C7 | C4 | C8 | 116.1° | 114.1° |
C11 | C7 | C4 | C5 | 133.6° | 105.9° |
C11 | C7 | C8 | N1 | 13.7° | 36.7° |
C11 | C7 | C8 | C9 | 104.8° | 78.9° |
C11 | C7 | C8 | H4 | 130.9° | 157.8° |
C7 | C11 | H9 | H10 | 121.4° | 123.3° |
C7 | C11 | C12 | H11 | 91.8° | 141.0° |
C7 | C11 | C12 | H12 | 146.1° | 97.9° |
C21 | C20 | C25 | C24 | 0.5° | 0.0° |
C21 | C20 | C25 | C19 | 173.3° | 179.7° |
C21 | C20 | C25 | CL1 | 176.3° | 179.8° |
C21 | C20 | C19 | O1 | 131.9° | 89.7° |
C21 | C20 | C19 | H17 | 108.2° | 150.2° |
C21 | C20 | C19 | H18 | 12.1° | 30.3° |
C20 | C21 | C22 | H19 | 179.9° | 180.0° |
C2 | C3 | C4 | H2 | 180.0° | 180.0° |
C2 | C3 | C4 | C7 | 176.3° | 179.9° |
C3 | C2 | C1 | H1 | 180.0° | 179.9° |
C2 | C3 | C4 | C5 | 0.3° | 0.0° |
C3 | C2 | C1 | O1 | 175.5° | 180.0° |
C3 | C2 | C1 | C6 | 0.8° | 0.4° |
C3 | C4 | C7 | C5 | 176.5° | 179.9° |
C3 | C4 | C7 | C8 | 166.0° | 171.9° |
C4 | C3 | C2 | C1 | 1.1° | 0.0° |
C3 | C4 | C5 | C6 | 1.9° | 0.3° |
C3 | C4 | C5 | C10 | 175.6° | 180.0° |
C4 | C3 | C2 | H1 | 178.9° | 179.9° |
C12 | N1 | C8 | C7 | 32.7° | 23.9° |
C12 | N1 | C26 | C8 | 172.3° | 180.0° |
C12 | N1 | C26 | C27 | 8.0° | 5.1° |
C12 | N1 | C26 | O4 | 169.3° | 174.9° |
C12 | N1 | C8 | C9 | 90.6° | 92.9° |
C12 | N1 | C8 | H4 | 148.6° | 144.5° |
N1 | C12 | C11 | H9 | 92.3° | 96.7° |
N1 | C12 | C11 | H10 | 146.7° | 139.9° |
N1 | C12 | H11 | H12 | 123.1° | 121.1° |
C4 | C7 | C8 | N1 | 131.7° | 155.6° |
C4 | C7 | C8 | C9 | 13.1° | 40.0° |
C7 | C4 | C5 | C6 | 174.7° | 179.8° |
C7 | C4 | C5 | C10 | 7.7° | 0.1° |
C7 | C4 | C3 | H2 | 3.7° | 0.0° |
C4 | C7 | C8 | H4 | 111.2° | 83.3° |
C4 | C7 | C11 | H9 | 126.9° | 37.6° |
C4 | C7 | C11 | H10 | 6.0° | 85.8° |
C8 | C7 | C4 | C5 | 17.5° | 8.2° |
C7 | C8 | N1 | C26 | 153.7° | 156.1° |
C7 | C8 | N1 | C9 | 123.4° | 116.8° |
C7 | C8 | N1 | H4 | 115.9° | 120.6° |
C7 | C8 | C9 | H4 | 123.8° | 123.4° |
C7 | C8 | C9 | C10 | 50.5° | 65.3° |
C7 | C8 | C9 | H6 | 69.2° | 54.6° |
C7 | C8 | C9 | H5 | 170.1° | 174.7° |
C8 | C7 | C11 | H9 | 111.2° | 83.2° |
C8 | C7 | C11 | H10 | 127.8° | 153.4° |
C13 | C18 | C17 | H16 | 180.0° | 179.8° |
C18 | C13 | C14 | C15 | 3.9° | 0.3° |
C13 | C18 | C17 | C16 | 0.9° | 0.5° |
C18 | C13 | C14 | H13 | 176.1° | 179.8° |
C13 | C18 | C17 | H15 | 179.1° | 179.8° |
C14 | C13 | C18 | C17 | 4.1° | 0.5° |
C13 | C14 | C15 | H13 | 180.0° | 179.9° |
C13 | C14 | C15 | C16 | 0.6° | 0.0° |
C13 | C14 | C15 | H14 | 179.4° | 180.0° |
C14 | C13 | C18 | H16 | 175.9° | 179.7° |
C24 | C25 | C20 | CL1 | 176.9° | 179.8° |
C24 | C25 | C20 | C19 | 173.8° | 179.8° |
C25 | C24 | C23 | H20 | 179.1° | 180.0° |
C18 | C17 | C16 | H15 | 180.0° | 179.7° |
C18 | C17 | C16 | C15 | 2.5° | 0.2° |
C18 | C17 | C16 | F1 | 173.1° | 179.8° |
C2 | C1 | O1 | C19 | 6.8° | 0.3° |
C2 | C1 | O1 | C6 | 175.0° | 179.6° |
C2 | C1 | C6 | C5 | 0.8° | 0.7° |
C1 | C2 | C3 | H2 | 178.9° | 180.0° |
C2 | C1 | C6 | H3 | 179.2° | 179.7° |
C28 | C29 | C30 | H26 | 120.4° | 120.0° |
C28 | C29 | C30 | H25 | 120.4° | 119.9° |
C29 | C28 | C27 | H23 | 120.2° | 120.0° |
C29 | C28 | C27 | H24 | 120.2° | 120.0° |
C29 | C28 | C27 | C26 | 179.4° | 180.0° |
C29 | C28 | C27 | C32 | 59.1° | 60.0° |
C28 | C29 | C30 | C33 | 175.1° | 180.0° |
C28 | C29 | C30 | C31 | 53.2° | 60.0° |
C29 | C28 | C27 | H22 | 59.3° | 60.0° |
C29 | C28 | H23 | H24 | 119.4° | 120.0° |
C28 | C29 | H26 | H25 | 118.9° | 119.9° |
C28 | C29 | C30 | H27 | 65.3° | 60.0° |
C29 | C30 | C33 | O6 | 41.7° | 180.0° |
C30 | C29 | C28 | C27 | 56.7° | 60.0° |
C29 | C30 | C33 | O5 | 136.1° | 0.0° |
C29 | C30 | C33 | C31 | 121.9° | 120.0° |
C29 | C30 | C33 | H27 | 119.4° | 120.0° |
C29 | C30 | C31 | H27 | 118.5° | 120.0° |
C29 | C30 | C31 | C32 | 54.5° | 60.0° |
C30 | C29 | C28 | H23 | 63.5° | 180.0° |
C30 | C29 | C28 | H24 | 176.9° | 60.0° |
C30 | C29 | H26 | H25 | 118.9° | 120.0° |
C29 | C30 | C31 | H29 | 65.8° | 60.0° |
C29 | C30 | C31 | H28 | 174.8° | 180.0° |
C25 | C20 | C19 | O1 | 55.1° | 90.0° |
C25 | C20 | C19 | H17 | 64.7° | 30.0° |
C25 | C20 | C19 | H18 | 175.0° | 150.0° |
C20 | C25 | C24 | H21 | 179.8° | 180.0° |
C19 | C20 | C25 | CL1 | 3.1° | 0.0° |
C20 | C19 | O1 | H17 | 119.8° | 120.0° |
C20 | C19 | O1 | H18 | 119.8° | 120.0° |
C20 | C19 | O1 | C1 | 80.1° | 180.0° |
C20 | C19 | H17 | H18 | 120.5° | 120.0° |
C4 | C5 | C6 | C1 | 2.2° | 0.6° |
C4 | C5 | C6 | C10 | 177.6° | 179.7° |
C4 | C5 | C10 | C9 | 33.0° | 24.1° |
C5 | C4 | C3 | H2 | 179.7° | 180.0° |
C4 | C5 | C6 | H3 | 177.8° | 179.7° |
C4 | C5 | C10 | H8 | 87.4° | 95.9° |
C4 | C5 | C10 | H7 | 153.4° | 144.2° |
N1 | C26 | C27 | C28 | 163.7° | 153.1° |
N1 | C26 | C27 | O4 | 177.3° | 180.0° |
N1 | C26 | C27 | C32 | 75.9° | 86.9° |
C26 | N1 | C8 | C9 | 82.9° | 87.1° |
C26 | N1 | C8 | H4 | 37.8° | 35.5° |
C26 | N1 | C12 | H11 | 92.5° | 61.8° |
C26 | N1 | C12 | H12 | 29.6° | 59.3° |
N1 | C26 | C27 | H22 | 43.6° | 33.2° |
C8 | N1 | C26 | C27 | 164.3° | 174.9° |
C8 | N1 | C26 | O4 | 18.4° | 5.1° |
N1 | C8 | C9 | H4 | 121.2° | 123.1° |
N1 | C8 | C9 | C10 | 165.4° | 178.8° |
N1 | C8 | C9 | H6 | 45.8° | 59.0° |
N1 | C8 | C9 | H5 | 74.9° | 61.2° |
C8 | N1 | C12 | H11 | 80.5° | 118.2° |
C8 | N1 | C12 | H12 | 157.4° | 120.7° |
O6 | C33 | O5 | C30 | 177.6° | 180.0° |
O6 | C33 | C30 | C31 | 163.5° | 60.0° |
O6 | C33 | C30 | H27 | 77.7° | 60.0° |
C28 | C27 | C26 | C32 | 120.4° | 120.0° |
C28 | C27 | C26 | H22 | 120.1° | 120.0° |
C28 | C27 | C32 | H22 | 118.4° | 120.0° |
C28 | C27 | C26 | O4 | 13.6° | 26.9° |
C28 | C27 | C32 | C31 | 60.4° | 60.0° |
C27 | C28 | H23 | H24 | 119.4° | 120.1° |
C27 | C28 | C29 | H26 | 63.6° | 60.0° |
C27 | C28 | C29 | H25 | 177.1° | 180.0° |
C28 | C27 | C32 | H30 | 59.7° | 60.0° |
C28 | C27 | C32 | H31 | 179.4° | 180.0° |
C26 | C27 | C32 | H22 | 119.5° | 120.1° |
C26 | C27 | C32 | C31 | 177.5° | 180.0° |
C26 | C27 | C28 | H23 | 60.4° | 60.0° |
C26 | C27 | C28 | H24 | 59.2° | 60.0° |
C26 | C27 | C32 | H30 | 62.4° | 60.0° |
C26 | C27 | C32 | H31 | 57.3° | 60.0° |
C32 | C27 | C26 | O4 | 106.8° | 93.1° |
C27 | C32 | C31 | C30 | 59.2° | 60.0° |
C27 | C32 | C31 | H30 | 120.2° | 120.0° |
C27 | C32 | C31 | H31 | 120.2° | 119.9° |
C32 | C27 | C28 | H23 | 61.1° | 179.9° |
C32 | C27 | C28 | H24 | 179.3° | 60.0° |
C27 | C32 | C31 | H29 | 61.0° | 60.0° |
C27 | C32 | C31 | H28 | 179.5° | 180.0° |
C27 | C32 | H30 | H31 | 119.5° | 119.9° |
C14 | C15 | C16 | C17 | 2.7° | 0.0° |
C14 | C15 | C16 | H14 | 180.0° | 180.0° |
C14 | C15 | C16 | F1 | 172.9° | 180.0° |
O4 | C26 | C27 | H22 | 133.7° | 146.8° |
CL1 | C25 | C24 | H21 | 2.8° | 0.2° |
O5 | C33 | C30 | C31 | 14.3° | 120.0° |
O5 | C33 | C30 | H27 | 104.5° | 120.0° |
O5 | C33 | O6 | H32 | 0.0° | 0.0° |
C33 | C30 | C31 | H27 | 119.0° | 120.0° |
C33 | C30 | C31 | C32 | 177.0° | 180.0° |
C33 | C30 | C29 | H26 | 54.8° | 60.0° |
C33 | C30 | C29 | H25 | 64.5° | 60.1° |
C33 | C30 | C31 | H29 | 56.7° | 60.0° |
C33 | C30 | C31 | H28 | 62.7° | 60.0° |
C30 | C33 | O6 | H32 | 177.8° | 180.0° |
C8 | C9 | C10 | C5 | 60.3° | 56.0° |
C8 | C9 | C10 | H6 | 119.7° | 119.9° |
C8 | C9 | C10 | H5 | 119.7° | 120.0° |
C8 | C9 | H6 | H5 | 121.0° | 120.1° |
C8 | C9 | C10 | H8 | 60.2° | 64.1° |
C8 | C9 | C10 | H7 | 179.3° | 176.1° |
C17 | C16 | C15 | F1 | 175.6° | 180.0° |
C17 | C16 | C15 | H14 | 177.3° | 180.0° |
C16 | C17 | C18 | H16 | 179.1° | 179.7° |
C30 | C31 | C32 | H29 | 120.3° | 120.0° |
C30 | C31 | C32 | H28 | 120.3° | 120.0° |
C31 | C30 | C29 | H26 | 67.1° | 60.0° |
C31 | C30 | C29 | H25 | 173.6° | 180.0° |
C30 | C31 | H29 | H28 | 119.1° | 120.0° |
C30 | C31 | C32 | H30 | 60.9° | 60.0° |
C30 | C31 | C32 | H31 | 179.4° | 179.9° |
C31 | C32 | C27 | H22 | 58.0° | 59.9° |
C32 | C31 | C30 | H27 | 64.0° | 60.0° |
C32 | C31 | H29 | H28 | 119.0° | 120.0° |
C31 | C32 | H30 | H31 | 119.5° | 120.1° |
C19 | O1 | C1 | C6 | 168.1° | 180.0° |
O1 | C19 | H17 | H18 | 120.5° | 120.0° |
O1 | C1 | C6 | C5 | 174.5° | 179.7° |
O1 | C1 | C2 | H1 | 4.5° | 0.1° |
O1 | C1 | C6 | H3 | 5.5° | 0.0° |
C1 | O1 | C19 | H17 | 160.1° | 60.0° |
C1 | O1 | C19 | H18 | 39.8° | 59.9° |
C1 | C6 | C5 | H3 | 180.0° | 179.7° |
C1 | C6 | C5 | C10 | 175.4° | 179.7° |
C6 | C1 | C2 | H1 | 179.2° | 179.7° |
C16 | C15 | C14 | H13 | 179.4° | 179.9° |
C15 | C16 | C17 | H15 | 177.5° | 180.0° |
C6 | C5 | C10 | C9 | 144.5° | 156.1° |
C6 | C5 | C10 | H8 | 95.1° | 83.8° |
C6 | C5 | C10 | H7 | 24.1° | 36.1° |
C5 | C10 | C9 | H8 | 120.4° | 120.1° |
C5 | C10 | C9 | H7 | 120.4° | 120.1° |
C10 | C5 | C6 | H3 | 4.6° | 0.0° |
C5 | C10 | C9 | H6 | 59.4° | 63.9° |
C5 | C10 | C9 | H5 | 180.0° | 176.0° |
C5 | C10 | H8 | H7 | 118.7° | 119.9° |
F1 | C16 | C15 | H14 | 7.1° | 0.0° |
F1 | C16 | C17 | H15 | 6.9° | 0.0° |
C10 | C9 | C8 | H4 | 73.4° | 58.1° |
C10 | C9 | H6 | H5 | 120.9° | 120.1° |
C9 | C10 | H8 | H7 | 118.8° | 119.8° |
H1 | C2 | C3 | H2 | 1.1° | 0.1° |
H4 | C8 | C9 | H6 | 167.0° | 177.9° |
H4 | C8 | C9 | H5 | 46.3° | 61.9° |
H6 | C9 | C10 | H8 | 179.9° | 176.0° |
H6 | C9 | C10 | H7 | 61.0° | 56.2° |
H5 | C9 | C10 | H8 | 59.6° | 55.9° |
H5 | C9 | C10 | H7 | 59.6° | 63.9° |
H9 | C11 | C12 | H11 | 148.7° | 22.7° |
H9 | C11 | C12 | H12 | 26.6° | 143.8° |
H10 | C11 | C12 | H11 | 27.8° | 100.7° |
H10 | C11 | C12 | H12 | 94.3° | 20.4° |
H13 | C14 | C15 | H14 | 0.6° | 0.0° |
H15 | C17 | C18 | H16 | 1.0° | 0.0° |
H19 | C22 | C23 | H20 | 0.9° | 0.1° |
H20 | C23 | C24 | H21 | 0.9° | 0.0° |
H22 | C27 | C28 | H23 | 179.5° | 60.0° |
H22 | C27 | C28 | H24 | 60.9° | 180.0° |
H22 | C27 | C32 | H30 | 178.1° | 180.0° |
H22 | C27 | C32 | H31 | 62.2° | 60.0° |
H23 | C28 | C29 | H26 | 176.2° | 60.0° |
H23 | C28 | C29 | H25 | 56.9° | 60.0° |
H24 | C28 | C29 | H26 | 56.6° | 180.0° |
H24 | C28 | C29 | H25 | 62.7° | 60.0° |
H26 | C29 | C30 | H27 | 174.3° | 180.0° |
H25 | C29 | C30 | H27 | 55.1° | 59.9° |
H27 | C30 | C31 | H29 | 175.7° | 180.0° |
H27 | C30 | C31 | H28 | 56.2° | 59.9° |
H29 | C31 | C32 | H30 | 178.8° | 180.0° |
H29 | C31 | C32 | H31 | 59.1° | 59.9° |
H28 | C31 | C32 | H30 | 59.4° | 60.0° |
H28 | C31 | C32 | H31 | 60.3° | 60.1° |