NQ2
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O5 | C21 | sing | 1.43Å | 1.44Å | |
O1 | S | doub | 1.42Å | 1.43Å | |
C21 | C23 | sing | 1.53Å | 1.52Å | |
C21 | C22 | sing | 1.53Å | 1.52Å | |
C21 | C18 | sing | 1.53Å | 1.55Å | |
O2 | S | doub | 1.42Å | 1.43Å | |
S | N1 | sing | 1.66Å | 1.62Å | |
S | C6 | sing | 1.81Å | 1.75Å | |
N1 | C5 | sing | 1.40Å | 1.43Å | |
C18 | C17 | sing | 1.53Å | 1.55Å | |
C18 | C19 | sing | 1.53Å | 1.53Å | |
C17 | C16 | sing | 1.53Å | 1.54Å | |
C16 | N2 | sing | 1.47Å | 1.48Å | |
O | C | sing | 1.43Å | 1.43Å | |
O | C1 | sing | 1.36Å | 1.36Å | |
C5 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
C5 | C1 | sing | 1.40Å | 1.41Å | Aromatic |
C19 | C20 | sing | 1.53Å | 1.53Å | |
C4 | C3 | sing | 1.40Å | 1.40Å | Aromatic |
C1 | N | doub | 1.32Å | 1.33Å | Aromatic |
C20 | N2 | sing | 1.47Å | 1.47Å | |
N2 | C15 | sing | 1.47Å | 1.48Å | |
C3 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
C3 | C7 | sing | 1.48Å | 1.49Å | |
N | C2 | sing | 1.32Å | 1.34Å | Aromatic |
C14 | C15 | sing | 1.53Å | 1.52Å | |
C14 | O4 | sing | 1.43Å | 1.45Å | |
C24 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
C24 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
C7 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
O4 | C13 | sing | 1.36Å | 1.38Å | |
C13 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
C12 | C9 | sing | 1.39Å | 1.39Å | Aromatic |
C12 | C11 | sing | 1.51Å | 1.50Å | |
C9 | C10 | sing | 1.51Å | 1.49Å | |
C11 | O3 | sing | 1.44Å | 1.43Å | |
C10 | O3 | sing | 1.44Å | 1.43Å | |
N1 | H1 | sing | 0.97Å | 1.00Å | |
C4 | H2 | sing | 1.08Å | 1.08Å | |
C6 | H3 | sing | 1.09Å | 1.10Å | |
C6 | H4 | sing | 1.09Å | 1.10Å | |
C6 | H5 | sing | 1.09Å | 1.10Å | |
C8 | H6 | sing | 1.08Å | 1.08Å | |
C10 | H7 | sing | 1.09Å | 1.10Å | |
C10 | H8 | sing | 1.09Å | 1.10Å | |
C15 | H9 | sing | 1.09Å | 1.10Å | |
C15 | H10 | sing | 1.09Å | 1.10Å | |
C17 | H11 | sing | 1.09Å | 1.10Å | |
C17 | H12 | sing | 1.09Å | 1.10Å | |
C20 | H13 | sing | 1.09Å | 1.10Å | |
C20 | H14 | sing | 1.09Å | 1.10Å | |
C22 | H15 | sing | 1.09Å | 1.10Å | |
C22 | H16 | sing | 1.09Å | 1.10Å | |
C22 | H17 | sing | 1.09Å | 1.10Å | |
C24 | H18 | sing | 1.08Å | 1.08Å | |
C | H19 | sing | 1.09Å | 1.10Å | |
C | H20 | sing | 1.09Å | 1.10Å | |
C | H21 | sing | 1.09Å | 1.10Å | |
C2 | H22 | sing | 1.08Å | 1.08Å | |
C11 | H23 | sing | 1.09Å | 1.10Å | |
C11 | H24 | sing | 1.09Å | 1.10Å | |
C14 | H25 | sing | 1.09Å | 1.10Å | |
C14 | H26 | sing | 1.09Å | 1.10Å | |
C19 | H28 | sing | 1.09Å | 1.10Å | |
C19 | H29 | sing | 1.09Å | 1.10Å | |
C18 | H30 | sing | 1.09Å | 1.10Å | |
O5 | H31 | sing | 0.97Å | 0.95Å | |
C23 | H32 | sing | 1.09Å | 1.10Å | |
C23 | H33 | sing | 1.09Å | 1.10Å | |
C23 | H34 | sing | 1.09Å | 1.10Å | |
C16 | H35 | sing | 1.09Å | 1.10Å | |
C16 | H36 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O5 | C21 | C23 | 108.5° | 109.5° |
O5 | C21 | C22 | 106.4° | 109.5° |
O5 | C21 | C18 | 106.3° | 109.5° |
C21 | O5 | H31 | 109.5° | 114.0° |
O1 | S | O2 | 118.8° | 121.0° |
O1 | S | N1 | 106.8° | 104.3° |
O1 | S | C6 | 107.8° | 110.6° |
C23 | C21 | C22 | 110.1° | 109.5° |
C23 | C21 | C18 | 112.2° | 109.4° |
C21 | C23 | H32 | 109.5° | 109.5° |
C21 | C23 | H33 | 109.5° | 109.5° |
C21 | C23 | H34 | 109.5° | 109.4° |
C22 | C21 | C18 | 112.9° | 109.5° |
C21 | C22 | H15 | 109.5° | 109.5° |
C21 | C22 | H16 | 109.4° | 109.4° |
C21 | C22 | H17 | 109.5° | 109.5° |
C21 | C18 | C17 | 114.4° | 109.5° |
C21 | C18 | C19 | 114.1° | 109.6° |
C21 | C18 | H30 | 105.9° | 109.5° |
O2 | S | N1 | 108.2° | 104.3° |
O2 | S | C6 | 108.2° | 110.5° |
N1 | S | C6 | 106.3° | 104.5° |
S | N1 | C5 | 124.2° | 120.0° |
S | N1 | H1 | 105.7° | 120.0° |
S | C6 | H3 | 109.5° | 109.5° |
S | C6 | H4 | 109.5° | 109.4° |
S | C6 | H5 | 109.5° | 109.5° |
N1 | C5 | C4 | 122.5° | 120.4° |
N1 | C5 | C1 | 118.9° | 120.4° |
C5 | N1 | H1 | 105.7° | 120.0° |
C17 | C18 | C19 | 109.7° | 109.1° |
C18 | C17 | C16 | 109.8° | 109.3° |
C18 | C17 | H11 | 109.4° | 109.5° |
C18 | C17 | H12 | 109.4° | 109.5° |
C17 | C18 | H30 | 105.9° | 109.5° |
C18 | C19 | C20 | 110.4° | 109.3° |
C18 | C19 | H28 | 109.2° | 109.5° |
C18 | C19 | H29 | 109.2° | 109.6° |
C19 | C18 | H30 | 106.2° | 109.6° |
C17 | C16 | N2 | 110.7° | 109.5° |
C16 | C17 | H11 | 109.4° | 109.5° |
C16 | C17 | H12 | 109.4° | 109.5° |
C17 | C16 | H35 | 109.2° | 109.5° |
C17 | C16 | H36 | 109.2° | 109.4° |
C16 | N2 | C20 | 110.1° | 111.2° |
C16 | N2 | C15 | 114.8° | 111.0° |
N2 | C16 | H35 | 109.2° | 109.4° |
N2 | C16 | H36 | 109.2° | 109.5° |
C | O | C1 | 117.8° | 117.0° |
O | C | H19 | 109.5° | 109.5° |
O | C | H20 | 109.5° | 109.5° |
O | C | H21 | 109.5° | 109.5° |
O | C1 | C5 | 115.9° | 119.6° |
O | C1 | N | 121.4° | 119.6° |
C4 | C5 | C1 | 118.5° | 119.1° |
C5 | C4 | C3 | 119.2° | 118.3° |
C5 | C4 | H2 | 120.4° | 120.9° |
C5 | C1 | N | 122.6° | 120.8° |
C19 | C20 | N2 | 111.2° | 109.5° |
C19 | C20 | H13 | 109.0° | 109.5° |
C19 | C20 | H14 | 109.0° | 109.5° |
C20 | C19 | H28 | 109.3° | 109.5° |
C20 | C19 | H29 | 109.3° | 109.5° |
C4 | C3 | C2 | 117.1° | 119.1° |
C4 | C3 | C7 | 121.1° | 120.4° |
C3 | C4 | H2 | 120.4° | 120.9° |
C1 | N | C2 | 117.9° | 121.8° |
C20 | N2 | C15 | 114.6° | 111.0° |
N2 | C20 | H13 | 109.0° | 109.5° |
N2 | C20 | H14 | 109.0° | 109.4° |
N2 | C15 | C14 | 116.8° | 109.5° |
N2 | C15 | H9 | 107.6° | 109.5° |
N2 | C15 | H10 | 107.6° | 109.5° |
C2 | C3 | C7 | 121.8° | 120.5° |
C3 | C2 | N | 124.5° | 120.8° |
C3 | C2 | H22 | 117.7° | 119.6° |
C3 | C7 | C24 | 120.7° | 120.1° |
C3 | C7 | C8 | 120.4° | 120.1° |
N | C2 | H22 | 117.8° | 119.5° |
C15 | C14 | O4 | 109.9° | 109.5° |
C14 | C15 | H9 | 107.6° | 109.5° |
C14 | C15 | H10 | 107.6° | 109.5° |
C15 | C14 | H25 | 109.4° | 109.4° |
C15 | C14 | H26 | 109.4° | 109.5° |
C14 | O4 | C13 | 117.8° | 117.0° |
O4 | C14 | H25 | 109.4° | 109.5° |
O4 | C14 | H26 | 109.3° | 109.5° |
C7 | C24 | C13 | 120.3° | 119.8° |
C24 | C7 | C8 | 118.9° | 119.9° |
C7 | C24 | H18 | 119.8° | 120.1° |
C24 | C13 | O4 | 124.1° | 120.0° |
C24 | C13 | C12 | 119.9° | 119.9° |
C13 | C24 | H18 | 119.8° | 120.1° |
C7 | C8 | C9 | 120.8° | 120.0° |
C7 | C8 | H6 | 119.6° | 120.0° |
O4 | C13 | C12 | 115.9° | 120.0° |
C13 | C12 | C9 | 120.2° | 120.2° |
C13 | C12 | C11 | 131.4° | 132.5° |
C8 | C9 | C12 | 119.9° | 120.2° |
C8 | C9 | C10 | 131.2° | 132.6° |
C9 | C8 | H6 | 119.6° | 120.0° |
C9 | C12 | C11 | 108.4° | 107.3° |
C12 | C9 | C10 | 108.8° | 107.3° |
C12 | C11 | O3 | 105.1° | 105.9° |
C12 | C11 | H23 | 110.6° | 110.2° |
C12 | C11 | H24 | 110.6° | 110.2° |
C9 | C10 | O3 | 105.0° | 105.9° |
C9 | C10 | H7 | 110.6° | 110.1° |
C9 | C10 | H8 | 110.6° | 110.1° |
C11 | O3 | C10 | 110.6° | 104.9° |
O3 | C11 | H23 | 110.6° | 110.1° |
O3 | C11 | H24 | 110.6° | 110.1° |
O3 | C10 | H7 | 110.6° | 110.2° |
O3 | C10 | H8 | 110.6° | 110.1° |
H3 | C6 | H4 | 109.5° | 109.5° |
H3 | C6 | H5 | 109.4° | 109.5° |
H4 | C6 | H5 | 109.5° | 109.4° |
H7 | C10 | H8 | 109.4° | 110.2° |
H9 | C15 | H10 | 109.5° | 109.5° |
H11 | C17 | H12 | 109.4° | 109.5° |
H13 | C20 | H14 | 109.5° | 109.5° |
H15 | C22 | H16 | 109.5° | 109.5° |
H15 | C22 | H17 | 109.4° | 109.5° |
H16 | C22 | H17 | 109.5° | 109.5° |
H19 | C | H20 | 109.5° | 109.5° |
H19 | C | H21 | 109.5° | 109.5° |
H20 | C | H21 | 109.5° | 109.4° |
H23 | C11 | H24 | 109.4° | 110.2° |
H25 | C14 | H26 | 109.5° | 109.4° |
H28 | C19 | H29 | 109.5° | 109.5° |
H32 | C23 | H33 | 109.5° | 109.5° |
H32 | C23 | H34 | 109.4° | 109.5° |
H33 | C23 | H34 | 109.4° | 109.5° |
H35 | C16 | H36 | 109.4° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O5 | C21 | C23 | C22 | 116.1° | 120.0° |
O5 | C21 | C23 | C18 | 117.2° | 120.0° |
O5 | C21 | C22 | C18 | 116.3° | 120.0° |
O5 | C21 | C18 | C17 | 67.2° | 60.0° |
O5 | C21 | C18 | C19 | 165.4° | 59.7° |
O5 | C21 | C22 | H15 | 180.0° | 60.0° |
O5 | C21 | C22 | H16 | 60.0° | 60.0° |
O5 | C21 | C22 | H17 | 60.0° | 180.0° |
O5 | C21 | C18 | H30 | 49.0° | 179.9° |
O5 | C21 | C23 | H32 | 180.0° | 180.0° |
O5 | C21 | C23 | H33 | 60.0° | 60.0° |
O5 | C21 | C23 | H34 | 60.0° | 60.0° |
O1 | S | O2 | N1 | 121.9° | 116.7° |
O1 | S | O2 | C6 | 123.3° | 131.5° |
O1 | S | N1 | C6 | 114.9° | 116.1° |
O1 | S | N1 | C5 | 167.2° | 51.1° |
O1 | S | N1 | H1 | 70.8° | 129.2° |
O1 | S | C6 | H3 | 180.0° | 68.4° |
O1 | S | C6 | H4 | 60.0° | 51.7° |
O1 | S | C6 | H5 | 60.0° | 171.6° |
C23 | C21 | C22 | C18 | 126.3° | 120.0° |
C23 | C21 | C18 | C17 | 174.3° | 180.0° |
C23 | C21 | C18 | C19 | 47.0° | 60.3° |
C23 | C21 | C22 | H15 | 62.6° | 60.1° |
C23 | C21 | C22 | H16 | 177.4° | 180.0° |
C23 | C21 | C22 | H17 | 57.4° | 60.0° |
C23 | C21 | C18 | H30 | 69.4° | 59.9° |
C23 | C21 | O5 | H31 | 180.0° | 60.0° |
C21 | C23 | H32 | H33 | 120.0° | 120.0° |
C21 | C23 | H32 | H34 | 120.0° | 120.0° |
C21 | C23 | H33 | H34 | 120.0° | 119.9° |
C22 | C21 | C18 | C17 | 49.1° | 60.0° |
C22 | C21 | C18 | C19 | 78.2° | 179.7° |
C21 | C22 | H15 | H16 | 120.0° | 120.0° |
C21 | C22 | H15 | H17 | 120.0° | 120.0° |
C21 | C22 | H16 | H17 | 120.0° | 120.0° |
C22 | C21 | C18 | H30 | 165.4° | 60.1° |
C22 | C21 | O5 | H31 | 61.5° | 180.0° |
C22 | C21 | C23 | H32 | 63.9° | 60.0° |
C22 | C21 | C23 | H33 | 56.1° | 180.0° |
C22 | C21 | C23 | H34 | 176.1° | 60.0° |
C21 | C18 | C17 | C19 | 129.6° | 119.9° |
C21 | C18 | C17 | H30 | 116.2° | 120.1° |
C21 | C18 | C19 | H30 | 116.2° | 120.2° |
C21 | C18 | C17 | C16 | 175.9° | 177.6° |
C21 | C18 | C19 | C20 | 175.7° | 177.5° |
C21 | C18 | C17 | H11 | 55.9° | 62.5° |
C21 | C18 | C17 | H12 | 64.0° | 57.6° |
C18 | C21 | C22 | H15 | 63.7° | 180.0° |
C18 | C21 | C22 | H16 | 56.3° | 60.0° |
C18 | C21 | C22 | H17 | 176.3° | 60.0° |
C21 | C18 | C19 | H28 | 64.2° | 62.5° |
C21 | C18 | C19 | H29 | 55.5° | 57.6° |
C18 | C21 | O5 | H31 | 59.1° | 60.0° |
C18 | C21 | C23 | H32 | 62.8° | 60.0° |
C18 | C21 | C23 | H33 | 177.2° | 60.0° |
C18 | C21 | C23 | H34 | 57.2° | 180.0° |
O2 | S | N1 | C6 | 116.1° | 116.1° |
O2 | S | N1 | C5 | 63.8° | 178.9° |
O2 | S | N1 | H1 | 58.2° | 1.4° |
O2 | S | C6 | H3 | 50.3° | 68.3° |
O2 | S | C6 | H4 | 170.3° | 171.6° |
O2 | S | C6 | H5 | 69.7° | 51.7° |
S | N1 | C5 | H1 | 122.0° | 179.7° |
S | N1 | C5 | C4 | 45.3° | 35.3° |
S | N1 | C5 | C1 | 137.9° | 144.7° |
N1 | S | C6 | H3 | 65.8° | 180.0° |
N1 | S | C6 | H4 | 54.2° | 60.0° |
N1 | S | C6 | H5 | 174.3° | 60.0° |
C6 | S | N1 | C5 | 52.3° | 65.0° |
C6 | S | N1 | H1 | 174.3° | 114.7° |
S | C6 | H3 | H4 | 120.0° | 120.0° |
S | C6 | H3 | H5 | 120.0° | 120.0° |
S | C6 | H4 | H5 | 120.0° | 119.9° |
N1 | C5 | C1 | O | 3.9° | 0.0° |
N1 | C5 | C4 | C1 | 176.8° | 180.0° |
N1 | C5 | C4 | C3 | 175.9° | 179.9° |
N1 | C5 | C1 | N | 179.7° | 180.0° |
N1 | C5 | C4 | H2 | 4.1° | 0.3° |
C17 | C18 | C19 | H30 | 114.0° | 119.9° |
C18 | C17 | C16 | H11 | 120.0° | 119.9° |
C18 | C17 | C16 | H12 | 120.1° | 120.0° |
C18 | C17 | C16 | N2 | 57.8° | 59.2° |
C17 | C18 | C19 | C20 | 54.6° | 57.7° |
C18 | C17 | H11 | H12 | 119.9° | 120.1° |
C17 | C18 | C19 | H28 | 65.6° | 177.6° |
C17 | C18 | C19 | H29 | 174.7° | 62.3° |
C18 | C17 | C16 | H35 | 62.4° | 60.9° |
C18 | C17 | C16 | H36 | 178.0° | 179.2° |
C19 | C18 | C17 | C16 | 54.5° | 57.6° |
C18 | C19 | C20 | H28 | 120.1° | 120.0° |
C18 | C19 | C20 | H29 | 120.1° | 120.0° |
C18 | C19 | C20 | N2 | 58.4° | 59.2° |
C19 | C18 | C17 | H11 | 174.5° | 177.6° |
C19 | C18 | C17 | H12 | 65.6° | 62.3° |
C18 | C19 | C20 | H13 | 178.7° | 60.8° |
C18 | C19 | C20 | H14 | 61.9° | 179.2° |
C18 | C19 | H28 | H29 | 119.6° | 120.1° |
C17 | C16 | N2 | H35 | 120.2° | 120.1° |
C17 | C16 | N2 | H36 | 120.2° | 120.0° |
C17 | C16 | N2 | C20 | 60.9° | 61.8° |
C17 | C16 | N2 | C15 | 168.1° | 174.2° |
C16 | C17 | H11 | H12 | 119.9° | 120.1° |
C16 | C17 | C18 | H30 | 59.7° | 62.3° |
C17 | C16 | H35 | H36 | 119.4° | 119.9° |
C16 | N2 | C20 | C19 | 61.1° | 61.7° |
C16 | N2 | C20 | C15 | 131.2° | 124.1° |
C16 | N2 | C15 | C14 | 79.8° | 65.8° |
C16 | N2 | C15 | H9 | 41.3° | 54.2° |
C16 | N2 | C15 | H10 | 159.2° | 174.2° |
N2 | C16 | C17 | H11 | 177.8° | 179.1° |
N2 | C16 | C17 | H12 | 62.3° | 60.8° |
C16 | N2 | C20 | H13 | 178.7° | 58.3° |
C16 | N2 | C20 | H14 | 59.2° | 178.3° |
N2 | C16 | H35 | H36 | 119.4° | 120.0° |
C | O | C1 | C5 | 170.2° | 180.0° |
C | O | C1 | N | 5.6° | 0.0° |
O | C | H19 | H20 | 120.0° | 120.0° |
O | C | H19 | H21 | 120.0° | 120.0° |
O | C | H20 | H21 | 120.0° | 120.0° |
O | C1 | C5 | C4 | 173.0° | 180.0° |
O | C1 | C5 | N | 175.7° | 180.0° |
O | C1 | N | C2 | 172.3° | 179.7° |
C1 | O | C | H19 | 180.0° | 60.0° |
C1 | O | C | H20 | 60.0° | 60.0° |
C1 | O | C | H21 | 60.0° | 180.0° |
C5 | C4 | C3 | H2 | 180.0° | 179.7° |
C4 | C5 | C1 | N | 2.7° | 0.0° |
C5 | C4 | C3 | C2 | 3.6° | 0.2° |
C5 | C4 | C3 | C7 | 175.1° | 179.7° |
C4 | C5 | N1 | H1 | 76.7° | 145.0° |
C1 | C5 | C4 | C3 | 0.9° | 0.0° |
C5 | C1 | N | C2 | 3.3° | 0.3° |
C1 | C5 | N1 | H1 | 100.1° | 34.9° |
C1 | C5 | C4 | H2 | 179.1° | 179.7° |
C19 | C20 | N2 | H13 | 120.3° | 120.0° |
C19 | C20 | N2 | H14 | 120.3° | 120.0° |
C19 | C20 | N2 | C15 | 167.8° | 174.2° |
C19 | C20 | H13 | H14 | 119.2° | 120.0° |
C20 | C19 | H28 | H29 | 119.6° | 120.0° |
C20 | C19 | C18 | H30 | 59.4° | 62.3° |
C4 | C3 | C2 | C7 | 178.7° | 180.0° |
C4 | C3 | C2 | N | 3.2° | 0.5° |
C4 | C3 | C7 | C24 | 28.5° | 0.3° |
C4 | C3 | C7 | C8 | 151.3° | 179.9° |
C4 | C3 | C2 | H22 | 176.7° | 179.9° |
C1 | N | C2 | C3 | 0.2° | 0.6° |
C1 | N | C2 | H22 | 179.8° | 180.0° |
C20 | N2 | C15 | C14 | 49.0° | 170.0° |
C20 | N2 | C15 | H9 | 170.1° | 70.0° |
C20 | N2 | C15 | H10 | 72.0° | 50.1° |
N2 | C20 | H13 | H14 | 119.2° | 120.0° |
N2 | C20 | C19 | H28 | 61.7° | 179.2° |
N2 | C20 | C19 | H29 | 178.5° | 60.8° |
C20 | N2 | C16 | H35 | 59.3° | 58.3° |
C20 | N2 | C16 | H36 | 178.9° | 178.2° |
N2 | C15 | C14 | H9 | 121.1° | 120.0° |
N2 | C15 | C14 | H10 | 121.1° | 120.0° |
N2 | C15 | C14 | O4 | 80.6° | 65.0° |
N2 | C15 | H9 | H10 | 116.7° | 120.0° |
C15 | N2 | C20 | H13 | 47.5° | 65.8° |
C15 | N2 | C20 | H14 | 72.0° | 54.2° |
N2 | C15 | C14 | H25 | 39.5° | 175.0° |
N2 | C15 | C14 | H26 | 159.4° | 55.0° |
C15 | N2 | C16 | H35 | 71.7° | 65.8° |
C15 | N2 | C16 | H36 | 47.8° | 54.1° |
C3 | C2 | N | H22 | 180.0° | 179.4° |
C2 | C3 | C7 | C24 | 152.8° | 179.7° |
C2 | C3 | C7 | C8 | 27.4° | 0.0° |
C2 | C3 | C4 | H2 | 176.4° | 180.0° |
C7 | C3 | C2 | N | 175.5° | 179.4° |
C3 | C7 | C24 | C8 | 179.8° | 179.7° |
C3 | C7 | C24 | C13 | 179.6° | 179.8° |
C3 | C7 | C8 | C9 | 179.0° | 179.7° |
C7 | C3 | C4 | H2 | 4.9° | 0.0° |
C3 | C7 | C8 | H6 | 1.0° | 0.3° |
C3 | C7 | C24 | H18 | 0.4° | 0.3° |
C7 | C3 | C2 | H22 | 4.5° | 0.0° |
C15 | C14 | O4 | H25 | 120.1° | 120.0° |
C15 | C14 | O4 | H26 | 120.1° | 120.1° |
C15 | C14 | O4 | C13 | 171.7° | 179.9° |
C14 | C15 | H9 | H10 | 116.7° | 120.0° |
C15 | C14 | H25 | H26 | 119.8° | 120.0° |
C14 | O4 | C13 | C24 | 10.5° | 0.1° |
C14 | O4 | C13 | C12 | 167.0° | 180.0° |
O4 | C14 | C15 | H9 | 158.4° | 175.0° |
O4 | C14 | C15 | H10 | 40.5° | 55.0° |
O4 | C14 | H25 | H26 | 119.8° | 120.0° |
C7 | C24 | C13 | H18 | 180.0° | 179.9° |
C7 | C24 | C13 | O4 | 176.4° | 180.0° |
C7 | C24 | C13 | C12 | 1.0° | 0.0° |
C24 | C7 | C8 | C9 | 0.8° | 0.1° |
C24 | C7 | C8 | H6 | 179.2° | 180.0° |
C13 | C24 | C7 | C8 | 0.2° | 0.1° |
C24 | C13 | O4 | C12 | 177.4° | 179.9° |
C24 | C13 | C12 | C9 | 1.6° | 0.0° |
C24 | C13 | C12 | C11 | 177.3° | 180.0° |
C7 | C8 | C9 | H6 | 180.0° | 179.9° |
C7 | C8 | C9 | C12 | 0.2° | 0.0° |
C7 | C8 | C9 | C10 | 176.8° | 180.0° |
C8 | C7 | C24 | H18 | 179.8° | 180.0° |
O4 | C13 | C12 | C9 | 176.0° | 179.9° |
O4 | C13 | C12 | C11 | 5.1° | 0.0° |
O4 | C13 | C24 | H18 | 3.6° | 0.1° |
C13 | O4 | C14 | H25 | 68.3° | 60.0° |
C13 | O4 | C14 | H26 | 51.6° | 60.0° |
C13 | C12 | C9 | C8 | 1.0° | 0.1° |
C13 | C12 | C9 | C11 | 179.1° | 179.9° |
C13 | C12 | C9 | C10 | 176.3° | 180.0° |
C13 | C12 | C11 | O3 | 174.6° | 162.3° |
C12 | C13 | C24 | H18 | 179.0° | 180.0° |
C13 | C12 | C11 | H23 | 66.1° | 78.6° |
C13 | C12 | C11 | H24 | 55.3° | 43.2° |
C8 | C9 | C12 | C10 | 177.3° | 180.0° |
C8 | C9 | C12 | C11 | 178.1° | 180.0° |
C8 | C9 | C10 | O3 | 171.3° | 162.2° |
C8 | C9 | C10 | H7 | 52.0° | 78.6° |
C8 | C9 | C10 | H8 | 69.4° | 43.2° |
C9 | C12 | C11 | O3 | 4.4° | 17.8° |
C12 | C9 | C10 | O3 | 11.7° | 17.7° |
C12 | C9 | C8 | H6 | 179.8° | 179.9° |
C12 | C9 | C10 | H7 | 131.1° | 101.4° |
C12 | C9 | C10 | H8 | 107.6° | 136.8° |
C9 | C12 | C11 | H23 | 114.9° | 101.3° |
C9 | C12 | C11 | H24 | 123.7° | 136.9° |
C11 | C12 | C9 | C10 | 4.6° | 0.0° |
C12 | C11 | O3 | H23 | 119.3° | 119.1° |
C12 | C11 | O3 | H24 | 119.3° | 119.1° |
C12 | C11 | O3 | C10 | 12.1° | 28.6° |
C12 | C11 | H23 | H24 | 122.0° | 121.8° |
C9 | C10 | O3 | C11 | 14.8° | 28.5° |
C9 | C10 | O3 | H7 | 119.3° | 119.1° |
C9 | C10 | O3 | H8 | 119.3° | 119.0° |
C10 | C9 | C8 | H6 | 3.2° | 0.0° |
C9 | C10 | H7 | H8 | 122.0° | 121.7° |
C11 | O3 | C10 | H7 | 134.1° | 90.6° |
C11 | O3 | C10 | H8 | 104.5° | 147.6° |
O3 | C11 | H23 | H24 | 122.0° | 121.7° |
O3 | C10 | H7 | H8 | 122.0° | 121.8° |
C10 | O3 | C11 | H23 | 107.2° | 90.6° |
C10 | O3 | C11 | H24 | 131.5° | 147.7° |
H3 | C6 | H4 | H5 | 119.9° | 120.0° |
H9 | C15 | C14 | H25 | 81.6° | 55.0° |
H9 | C15 | C14 | H26 | 38.3° | 65.0° |
H10 | C15 | C14 | H25 | 160.6° | 65.0° |
H10 | C15 | C14 | H26 | 79.6° | 175.1° |
H11 | C17 | C18 | H30 | 60.4° | 57.6° |
H11 | C17 | C16 | H35 | 57.6° | 59.1° |
H11 | C17 | C16 | H36 | 61.9° | 60.9° |
H12 | C17 | C18 | H30 | 179.8° | 177.8° |
H12 | C17 | C16 | H35 | 177.5° | 179.2° |
H12 | C17 | C16 | H36 | 57.9° | 59.3° |
H13 | C20 | C19 | H28 | 58.5° | 59.1° |
H13 | C20 | C19 | H29 | 61.2° | 179.2° |
H14 | C20 | C19 | H28 | 178.0° | 60.8° |
H14 | C20 | C19 | H29 | 58.2° | 59.2° |
H15 | C22 | H16 | H17 | 120.0° | 120.1° |
H19 | C | H20 | H21 | 120.0° | 120.1° |
H28 | C19 | C18 | H30 | 179.6° | 57.7° |
H29 | C19 | C18 | H30 | 60.7° | 177.8° |
H32 | C23 | H33 | H34 | 120.0° | 120.0° |