V2M
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O37 | C36 | sing | 1.43Å | 1.42Å | |
C36 | C34 | sing | 1.53Å | 1.53Å | |
O35 | C34 | sing | 1.43Å | 1.43Å | |
C20 | C18 | sing | 1.53Å | 1.53Å | |
C34 | C24 | sing | 1.53Å | 1.53Å | |
O22 | C21 | doub | 1.21Å | 1.23Å | |
C17 | C18 | sing | 1.53Å | 1.52Å | |
C17 | C15 | sing | 1.53Å | 1.53Å | |
C18 | C19 | sing | 1.53Å | 1.54Å | |
C24 | N23 | sing | 1.47Å | 1.46Å | |
C24 | C26 | sing | 1.53Å | 1.53Å | |
C21 | N23 | sing | 1.35Å | 1.34Å | |
C21 | C15 | sing | 1.51Å | 1.53Å | |
C1 | O2 | sing | 1.43Å | 1.44Å | |
C15 | N14 | sing | 1.47Å | 1.45Å | |
C29 | C30 | sing | 1.54Å | 1.41Å | |
C29 | C27 | sing | 1.55Å | 1.50Å | |
O2 | C3 | sing | 1.36Å | 1.37Å | |
N14 | C12 | sing | 1.35Å | 1.33Å | |
C26 | C27 | sing | 1.53Å | 1.54Å | |
C10 | C11 | sing | 1.41Å | 1.44Å | Aromatic |
C10 | C9 | doub | 1.36Å | 1.38Å | Aromatic |
C30 | N31 | sing | 1.47Å | 1.34Å | |
C27 | C32 | sing | 1.51Å | 1.52Å | |
C3 | C11 | doub | 1.41Å | 1.40Å | Aromatic |
C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
C12 | C9 | sing | 1.47Å | 1.48Å | |
C12 | O13 | doub | 1.22Å | 1.23Å | |
C11 | C7 | sing | 1.41Å | 1.41Å | Aromatic |
C9 | N8 | sing | 1.38Å | 1.38Å | Aromatic |
C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
N31 | C32 | sing | 1.34Å | 1.36Å | |
C32 | O33 | doub | 1.21Å | 1.23Å | |
C7 | N8 | sing | 1.38Å | 1.38Å | Aromatic |
C7 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H2 | sing | 1.09Å | 1.10Å | |
C1 | H3 | sing | 1.09Å | 1.10Å | |
C4 | H4 | sing | 1.08Å | 1.08Å | |
C5 | H5 | sing | 1.08Å | 1.08Å | |
C6 | H6 | sing | 1.08Å | 1.08Å | |
N8 | H7 | sing | 0.97Å | 1.00Å | |
C10 | H8 | sing | 1.08Å | 1.08Å | |
N14 | H9 | sing | 0.97Å | 1.00Å | |
C15 | H10 | sing | 1.09Å | 1.10Å | |
C17 | H11 | sing | 1.09Å | 1.10Å | |
C17 | H12 | sing | 1.09Å | 1.10Å | |
C18 | H13 | sing | 1.09Å | 1.10Å | |
C19 | H14 | sing | 1.09Å | 1.10Å | |
C19 | H15 | sing | 1.09Å | 1.10Å | |
C19 | H16 | sing | 1.09Å | 1.10Å | |
C20 | H17 | sing | 1.09Å | 1.10Å | |
C20 | H18 | sing | 1.09Å | 1.10Å | |
C20 | H19 | sing | 1.09Å | 1.10Å | |
N23 | H20 | sing | 0.97Å | 1.00Å | |
C24 | H21 | sing | 1.09Å | 1.10Å | |
C26 | H22 | sing | 1.09Å | 1.10Å | |
C26 | H23 | sing | 1.09Å | 1.10Å | |
C27 | H24 | sing | 1.09Å | 1.10Å | |
C29 | H25 | sing | 1.09Å | 1.10Å | |
C29 | H26 | sing | 1.09Å | 1.10Å | |
C30 | H27 | sing | 1.09Å | 1.10Å | |
C30 | H28 | sing | 1.09Å | 1.10Å | |
N31 | H29 | sing | 0.97Å | 1.00Å | |
C34 | H30 | sing | 1.09Å | 1.10Å | |
O35 | H31 | sing | 0.97Å | 0.95Å | |
C36 | H32 | sing | 1.09Å | 1.10Å | |
C36 | H33 | sing | 1.09Å | 1.10Å | |
O37 | H34 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O37 | C36 | C34 | 113.3° | 109.5° |
O37 | C36 | H32 | 108.5° | 109.5° |
O37 | C36 | H33 | 108.5° | 109.5° |
C36 | O37 | H34 | 109.5° | 113.9° |
C36 | C34 | O35 | 107.6° | 109.5° |
C36 | C34 | C24 | 110.4° | 109.5° |
C36 | C34 | H30 | 109.0° | 109.5° |
C34 | C36 | H32 | 108.5° | 109.4° |
C34 | C36 | H33 | 108.5° | 109.4° |
O35 | C34 | C24 | 110.5° | 109.4° |
O35 | C34 | H30 | 110.4° | 109.5° |
C34 | O35 | H31 | 109.5° | 114.0° |
C20 | C18 | C17 | 110.2° | 109.5° |
C20 | C18 | C19 | 111.4° | 109.5° |
C20 | C18 | H13 | 108.0° | 109.5° |
C18 | C20 | H17 | 109.5° | 109.5° |
C18 | C20 | H18 | 109.5° | 109.4° |
C18 | C20 | H19 | 109.4° | 109.5° |
C34 | C24 | N23 | 110.8° | 109.4° |
C34 | C24 | C26 | 114.3° | 109.5° |
C34 | C24 | H21 | 106.6° | 109.5° |
C24 | C34 | H30 | 108.9° | 109.5° |
O22 | C21 | N23 | 123.4° | 120.0° |
O22 | C21 | C15 | 120.9° | 120.0° |
C18 | C17 | C15 | 114.4° | 109.5° |
C17 | C18 | C19 | 111.3° | 109.5° |
C18 | C17 | H11 | 108.2° | 109.4° |
C18 | C17 | H12 | 108.2° | 109.4° |
C17 | C18 | H13 | 108.0° | 109.5° |
C17 | C15 | C21 | 110.6° | 109.5° |
C17 | C15 | N14 | 111.4° | 109.5° |
C17 | C15 | H10 | 107.6° | 109.5° |
C15 | C17 | H11 | 108.2° | 109.5° |
C15 | C17 | H12 | 108.2° | 109.5° |
C19 | C18 | H13 | 107.8° | 109.5° |
C18 | C19 | H14 | 109.5° | 109.5° |
C18 | C19 | H15 | 109.5° | 109.4° |
C18 | C19 | H16 | 109.4° | 109.5° |
N23 | C24 | C26 | 110.9° | 109.5° |
C24 | N23 | C21 | 122.4° | 120.0° |
C24 | N23 | H20 | 118.8° | 120.0° |
N23 | C24 | H21 | 107.4° | 109.5° |
C24 | C26 | C27 | 112.5° | 109.5° |
C26 | C24 | H21 | 106.6° | 109.5° |
C24 | C26 | H22 | 108.7° | 109.5° |
C24 | C26 | H23 | 108.7° | 109.5° |
N23 | C21 | C15 | 115.7° | 120.0° |
C21 | N23 | H20 | 118.8° | 120.0° |
C21 | C15 | N14 | 110.8° | 109.4° |
C21 | C15 | H10 | 107.7° | 109.4° |
C1 | O2 | C3 | 118.1° | 117.0° |
O2 | C1 | H1 | 109.5° | 109.4° |
O2 | C1 | H2 | 109.4° | 109.5° |
O2 | C1 | H3 | 109.5° | 109.5° |
C15 | N14 | C12 | 121.2° | 120.0° |
C15 | N14 | H9 | 119.4° | 120.0° |
N14 | C15 | H10 | 108.6° | 109.5° |
C30 | C29 | C27 | 100.9° | 101.7° |
C29 | C30 | N31 | 117.7° | 105.5° |
C30 | C29 | H25 | 111.6° | 111.0° |
C30 | C29 | H26 | 111.6° | 111.0° |
C29 | C30 | H27 | 107.4° | 110.3° |
C29 | C30 | H28 | 107.4° | 110.2° |
C29 | C27 | C26 | 114.7° | 110.5° |
C29 | C27 | C32 | 104.5° | 104.2° |
C29 | C27 | H24 | 108.1° | 110.6° |
C27 | C29 | H25 | 111.5° | 110.9° |
C27 | C29 | H26 | 111.6° | 111.0° |
O2 | C3 | C11 | 114.8° | 120.2° |
O2 | C3 | C4 | 125.4° | 120.2° |
N14 | C12 | C9 | 116.0° | 120.0° |
N14 | C12 | O13 | 122.9° | 120.0° |
C12 | N14 | H9 | 119.4° | 120.0° |
C26 | C27 | C32 | 113.6° | 110.5° |
C27 | C26 | H22 | 108.7° | 109.4° |
C27 | C26 | H23 | 108.7° | 109.5° |
C26 | C27 | H24 | 107.7° | 110.4° |
C11 | C10 | C9 | 107.0° | 107.7° |
C10 | C11 | C3 | 135.0° | 133.3° |
C10 | C11 | C7 | 106.5° | 107.1° |
C11 | C10 | H8 | 126.5° | 126.2° |
C10 | C9 | C12 | 131.3° | 125.5° |
C10 | C9 | N8 | 109.4° | 109.1° |
C9 | C10 | H8 | 126.5° | 126.1° |
C30 | N31 | C32 | 106.7° | 111.3° |
N31 | C30 | H27 | 107.4° | 110.3° |
N31 | C30 | H28 | 107.4° | 110.3° |
C30 | N31 | H29 | 126.7° | 124.4° |
C27 | C32 | N31 | 108.9° | 110.1° |
C27 | C32 | O33 | 123.1° | 125.0° |
C32 | C27 | H24 | 107.9° | 110.5° |
C11 | C3 | C4 | 119.7° | 119.6° |
C3 | C11 | C7 | 118.5° | 119.6° |
C3 | C4 | C5 | 120.5° | 120.5° |
C3 | C4 | H4 | 119.8° | 119.8° |
C9 | C12 | O13 | 120.9° | 120.0° |
C12 | C9 | N8 | 119.2° | 125.5° |
C11 | C7 | N8 | 108.4° | 107.4° |
C11 | C7 | C6 | 121.9° | 119.6° |
C9 | N8 | C7 | 108.6° | 108.8° |
C9 | N8 | H7 | 125.7° | 125.6° |
C4 | C5 | C6 | 120.8° | 120.7° |
C5 | C4 | H4 | 119.8° | 119.7° |
C4 | C5 | H5 | 119.6° | 119.7° |
N31 | C32 | O33 | 127.7° | 124.9° |
C32 | N31 | H29 | 126.6° | 124.3° |
N8 | C7 | C6 | 129.8° | 133.0° |
C7 | N8 | H7 | 125.7° | 125.6° |
C7 | C6 | C5 | 118.4° | 120.1° |
C7 | C6 | H6 | 120.8° | 120.0° |
C6 | C5 | H5 | 119.6° | 119.6° |
C5 | C6 | H6 | 120.8° | 120.0° |
H1 | C1 | H2 | 109.5° | 109.4° |
H1 | C1 | H3 | 109.4° | 109.5° |
H2 | C1 | H3 | 109.5° | 109.5° |
H11 | C17 | H12 | 109.5° | 109.5° |
H14 | C19 | H15 | 109.5° | 109.5° |
H14 | C19 | H16 | 109.5° | 109.5° |
H15 | C19 | H16 | 109.5° | 109.4° |
H17 | C20 | H18 | 109.4° | 109.5° |
H17 | C20 | H19 | 109.5° | 109.5° |
H18 | C20 | H19 | 109.5° | 109.5° |
H22 | C26 | H23 | 109.5° | 109.5° |
H25 | C29 | H26 | 109.5° | 110.9° |
H27 | C30 | H28 | 109.5° | 110.2° |
H32 | C36 | H33 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O37 | C36 | C34 | H32 | 120.6° | 120.0° |
O37 | C36 | C34 | H33 | 120.6° | 120.0° |
O37 | C36 | C34 | O35 | 62.4° | 65.0° |
O37 | C36 | C34 | C24 | 176.9° | 54.9° |
O37 | C36 | C34 | H30 | 57.3° | 175.0° |
O37 | C36 | H32 | H33 | 118.3° | 120.0° |
C36 | C34 | O35 | C24 | 120.6° | 119.9° |
C36 | C34 | O35 | H30 | 118.8° | 120.0° |
C36 | C34 | C24 | H30 | 119.6° | 120.0° |
C36 | C34 | C24 | N23 | 66.4° | 60.1° |
C36 | C34 | C24 | C26 | 167.5° | 180.0° |
C36 | C34 | C24 | H21 | 50.1° | 59.9° |
C36 | C34 | O35 | H31 | 180.0° | 180.0° |
C34 | C36 | H32 | H33 | 118.2° | 120.0° |
C34 | C36 | O37 | H34 | 180.0° | 180.0° |
O35 | C34 | C24 | H30 | 121.4° | 120.0° |
O35 | C34 | C24 | N23 | 174.7° | 180.0° |
O35 | C34 | C24 | C26 | 48.6° | 60.0° |
O35 | C34 | C24 | H21 | 68.8° | 60.0° |
O35 | C34 | C36 | H32 | 58.2° | 55.0° |
O35 | C34 | C36 | H33 | 177.0° | 175.0° |
C20 | C18 | C17 | C19 | 124.1° | 120.0° |
C20 | C18 | C17 | H13 | 117.7° | 120.0° |
C20 | C18 | C17 | C15 | 161.5° | 173.3° |
C20 | C18 | C19 | H13 | 118.3° | 120.0° |
C20 | C18 | C17 | H11 | 77.8° | 66.6° |
C20 | C18 | C17 | H12 | 40.8° | 53.3° |
C20 | C18 | C19 | H14 | 180.0° | 64.2° |
C20 | C18 | C19 | H15 | 60.0° | 175.8° |
C20 | C18 | C19 | H16 | 60.0° | 55.9° |
C18 | C20 | H17 | H18 | 120.0° | 120.0° |
C18 | C20 | H17 | H19 | 120.0° | 120.0° |
C18 | C20 | H18 | H19 | 120.0° | 120.0° |
C34 | C24 | N23 | C26 | 127.9° | 120.0° |
C34 | C24 | N23 | H21 | 116.0° | 120.0° |
C34 | C24 | C26 | H21 | 117.4° | 120.0° |
C34 | C24 | N23 | C21 | 107.3° | 85.0° |
C34 | C24 | C26 | C27 | 164.0° | 175.1° |
C34 | C24 | N23 | H20 | 72.6° | 94.9° |
C34 | C24 | C26 | H22 | 75.5° | 65.0° |
C34 | C24 | C26 | H23 | 43.5° | 55.0° |
C24 | C34 | O35 | H31 | 59.4° | 60.1° |
C24 | C34 | C36 | H32 | 62.5° | 174.9° |
C24 | C34 | C36 | H33 | 56.3° | 65.0° |
O22 | C21 | C15 | C17 | 80.3° | 101.5° |
O22 | C21 | N23 | C24 | 9.7° | 4.0° |
O22 | C21 | N23 | C15 | 179.4° | 180.0° |
O22 | C21 | C15 | N14 | 43.7° | 18.5° |
O22 | C21 | C15 | H10 | 162.3° | 138.5° |
O22 | C21 | N23 | H20 | 170.3° | 175.9° |
C18 | C17 | C15 | H11 | 120.7° | 120.0° |
C18 | C17 | C15 | H12 | 120.7° | 120.0° |
C17 | C18 | C19 | H13 | 118.3° | 120.0° |
C18 | C17 | C15 | C21 | 172.6° | 65.6° |
C18 | C17 | C15 | N14 | 63.7° | 174.5° |
C18 | C17 | C15 | H10 | 55.3° | 54.4° |
C18 | C17 | H11 | H12 | 117.8° | 119.9° |
C17 | C18 | C19 | H14 | 56.5° | 175.8° |
C17 | C18 | C19 | H15 | 176.5° | 55.8° |
C17 | C18 | C19 | H16 | 63.4° | 64.1° |
C17 | C18 | C20 | H17 | 180.0° | 60.0° |
C17 | C18 | C20 | H18 | 60.0° | 180.0° |
C17 | C18 | C20 | H19 | 60.0° | 60.0° |
C15 | C17 | C18 | C19 | 74.4° | 66.7° |
C17 | C15 | C21 | N23 | 99.1° | 78.5° |
C17 | C15 | C21 | N14 | 124.0° | 120.0° |
C17 | C15 | C21 | H10 | 117.4° | 120.0° |
C17 | C15 | N14 | H10 | 118.4° | 120.0° |
C17 | C15 | N14 | C12 | 169.5° | 88.6° |
C17 | C15 | N14 | H9 | 10.5° | 91.3° |
C15 | C17 | H11 | H12 | 117.7° | 120.1° |
C15 | C17 | C18 | H13 | 43.8° | 53.4° |
C19 | C18 | C17 | H11 | 46.3° | 53.4° |
C19 | C18 | C17 | H12 | 164.8° | 173.3° |
C18 | C19 | H14 | H15 | 120.0° | 120.0° |
C18 | C19 | H14 | H16 | 120.0° | 120.1° |
C18 | C19 | H15 | H16 | 120.0° | 120.0° |
C19 | C18 | C20 | H17 | 56.0° | 180.0° |
C19 | C18 | C20 | H18 | 175.9° | 60.0° |
C19 | C18 | C20 | H19 | 64.1° | 60.0° |
N23 | C24 | C26 | H21 | 116.6° | 120.0° |
C24 | N23 | C21 | H20 | 180.0° | 180.0° |
C24 | N23 | C21 | C15 | 169.7° | 176.0° |
N23 | C24 | C26 | C27 | 70.0° | 65.0° |
N23 | C24 | C26 | H22 | 50.5° | 55.0° |
N23 | C24 | C26 | H23 | 169.5° | 175.0° |
N23 | C24 | C34 | H30 | 53.2° | 60.0° |
C26 | C24 | N23 | C21 | 124.7° | 155.0° |
C24 | C26 | C27 | C29 | 65.2° | 178.8° |
C24 | C26 | C27 | H22 | 120.4° | 120.0° |
C24 | C26 | C27 | H23 | 120.5° | 120.0° |
C24 | C26 | C27 | C32 | 174.7° | 66.5° |
C26 | C24 | N23 | H20 | 55.3° | 25.0° |
C24 | C26 | H22 | H23 | 118.6° | 120.0° |
C24 | C26 | C27 | H24 | 55.2° | 56.1° |
C26 | C24 | C34 | H30 | 72.8° | 60.0° |
N23 | C21 | C15 | N14 | 136.9° | 161.6° |
N23 | C21 | C15 | H10 | 18.3° | 41.6° |
C21 | N23 | C24 | H21 | 8.7° | 35.0° |
C21 | C15 | N14 | H10 | 118.0° | 120.0° |
C21 | C15 | N14 | C12 | 66.9° | 151.4° |
C21 | C15 | N14 | H9 | 113.1° | 28.7° |
C21 | C15 | C17 | H11 | 51.9° | 174.4° |
C21 | C15 | C17 | H12 | 66.7° | 54.4° |
C15 | C21 | N23 | H20 | 10.3° | 4.1° |
C1 | O2 | C3 | C11 | 175.0° | 179.9° |
C1 | O2 | C3 | C4 | 3.1° | 0.3° |
O2 | C1 | H1 | H2 | 120.0° | 119.9° |
O2 | C1 | H1 | H3 | 120.0° | 120.0° |
O2 | C1 | H2 | H3 | 120.0° | 120.1° |
C15 | N14 | C12 | H9 | 180.0° | 179.9° |
C15 | N14 | C12 | C9 | 176.5° | 175.0° |
C15 | N14 | C12 | O13 | 0.6° | 5.0° |
N14 | C15 | C17 | H11 | 175.6° | 54.5° |
N14 | C15 | C17 | H12 | 57.0° | 65.6° |
C30 | C29 | C27 | H25 | 118.6° | 118.1° |
C30 | C29 | C27 | H26 | 118.6° | 118.2° |
C30 | C29 | C27 | C26 | 136.0° | 93.9° |
C29 | C30 | N31 | H27 | 121.2° | 119.1° |
C29 | C30 | N31 | H28 | 121.2° | 119.0° |
C30 | C29 | C27 | C32 | 10.9° | 24.8° |
C29 | C30 | N31 | C32 | 3.5° | 17.0° |
C30 | C29 | C27 | H24 | 103.9° | 143.5° |
C30 | C29 | H25 | H26 | 124.0° | 123.9° |
C29 | C30 | H27 | H28 | 116.3° | 121.9° |
C29 | C30 | N31 | H29 | 176.5° | 163.0° |
C29 | C27 | C26 | C32 | 120.1° | 114.8° |
C29 | C27 | C26 | H24 | 120.4° | 122.7° |
C27 | C29 | C30 | N31 | 9.6° | 25.4° |
C29 | C27 | C32 | H24 | 114.9° | 118.8° |
C29 | C27 | C32 | N31 | 10.1° | 16.3° |
C29 | C27 | C32 | O33 | 175.5° | 163.7° |
C29 | C27 | C26 | H22 | 174.4° | 61.2° |
C29 | C27 | C26 | H23 | 55.3° | 58.7° |
C27 | C29 | H25 | H26 | 124.0° | 123.8° |
C27 | C29 | C30 | H27 | 130.8° | 93.6° |
C27 | C29 | C30 | H28 | 111.6° | 144.5° |
O2 | C3 | C11 | C10 | 1.1° | 0.7° |
O2 | C3 | C11 | C4 | 178.2° | 179.8° |
O2 | C3 | C11 | C7 | 179.8° | 179.7° |
O2 | C3 | C4 | C5 | 176.9° | 180.0° |
C3 | O2 | C1 | H1 | 180.0° | 60.0° |
C3 | O2 | C1 | H2 | 60.0° | 59.9° |
C3 | O2 | C1 | H3 | 60.0° | 180.0° |
O2 | C3 | C4 | H4 | 3.1° | 0.0° |
N14 | C12 | C9 | C10 | 0.3° | 180.0° |
N14 | C12 | C9 | O13 | 176.0° | 180.0° |
N14 | C12 | C9 | N8 | 175.9° | 0.1° |
C12 | N14 | C15 | H10 | 51.2° | 31.4° |
C26 | C27 | C32 | H24 | 119.4° | 122.5° |
C26 | C27 | C32 | N31 | 135.8° | 102.4° |
C26 | C27 | C32 | O33 | 49.8° | 77.6° |
C27 | C26 | C24 | H21 | 46.6° | 55.0° |
C27 | C26 | H22 | H23 | 118.6° | 120.0° |
C26 | C27 | C29 | H25 | 105.4° | 24.2° |
C26 | C27 | C29 | H26 | 17.4° | 148.0° |
C11 | C10 | C9 | H8 | 180.0° | 179.4° |
C10 | C11 | C3 | C7 | 178.7° | 179.1° |
C10 | C11 | C3 | C4 | 177.1° | 179.6° |
C11 | C10 | C9 | C12 | 178.2° | 179.8° |
C11 | C10 | C9 | N8 | 2.2° | 0.2° |
C10 | C11 | C7 | N8 | 0.6° | 0.4° |
C10 | C11 | C7 | C6 | 179.8° | 179.8° |
C9 | C10 | C11 | C3 | 179.4° | 179.5° |
C10 | C9 | C12 | N8 | 175.6° | 179.9° |
C10 | C9 | C12 | O13 | 175.7° | 0.0° |
C9 | C10 | C11 | C7 | 1.7° | 0.4° |
C10 | C9 | N8 | C7 | 1.9° | 0.0° |
C10 | C9 | N8 | H7 | 178.1° | 180.0° |
C30 | N31 | C32 | C27 | 4.5° | 0.4° |
C30 | N31 | C32 | H29 | 180.0° | 180.0° |
C30 | N31 | C32 | O33 | 178.6° | 179.6° |
N31 | C30 | C29 | H25 | 128.2° | 143.5° |
N31 | C30 | C29 | H26 | 109.0° | 92.7° |
N31 | C30 | H27 | H28 | 116.3° | 122.0° |
C27 | C32 | N31 | O33 | 174.1° | 180.0° |
C32 | C27 | C26 | H22 | 54.3° | 53.6° |
C32 | C27 | C26 | H23 | 64.8° | 173.5° |
C32 | C27 | C29 | H25 | 129.5° | 143.0° |
C32 | C27 | C29 | H26 | 107.7° | 93.3° |
C27 | C32 | N31 | H29 | 175.5° | 179.6° |
C11 | C3 | C4 | C5 | 5.0° | 0.2° |
C3 | C11 | C7 | N8 | 179.7° | 179.7° |
C3 | C11 | C7 | C6 | 0.7° | 0.5° |
C11 | C3 | C4 | H4 | 175.0° | 179.8° |
C3 | C11 | C10 | H8 | 0.6° | 0.1° |
C4 | C3 | C11 | C7 | 1.6° | 0.5° |
C3 | C4 | C5 | H4 | 180.0° | 180.0° |
C3 | C4 | C5 | C6 | 6.2° | 0.0° |
C3 | C4 | C5 | H5 | 173.9° | 180.0° |
C12 | C9 | N8 | C7 | 178.4° | 179.9° |
C12 | C9 | N8 | H7 | 1.6° | 0.1° |
C12 | C9 | C10 | H8 | 1.8° | 0.8° |
C9 | C12 | N14 | H9 | 3.5° | 5.1° |
O13 | C12 | C9 | N8 | 0.1° | 180.0° |
O13 | C12 | N14 | H9 | 179.4° | 174.9° |
C11 | C7 | N8 | C9 | 0.7° | 0.2° |
C11 | C7 | N8 | C6 | 179.5° | 179.8° |
C11 | C7 | C6 | C5 | 0.3° | 0.3° |
C11 | C7 | C6 | H6 | 179.7° | 179.7° |
C11 | C7 | N8 | H7 | 179.3° | 179.8° |
C7 | C11 | C10 | H8 | 178.2° | 179.0° |
C9 | N8 | C7 | H7 | 180.0° | 180.0° |
C9 | N8 | C7 | C6 | 178.8° | 180.0° |
N8 | C9 | C10 | H8 | 177.8° | 179.2° |
C4 | C5 | C6 | C7 | 3.7° | 0.0° |
C4 | C5 | C6 | H5 | 180.0° | 180.0° |
C4 | C5 | C6 | H6 | 176.3° | 180.0° |
N31 | C32 | C27 | H24 | 104.9° | 135.0° |
C32 | N31 | C30 | H27 | 124.7° | 102.0° |
C32 | N31 | C30 | H28 | 117.7° | 136.0° |
O33 | C32 | C27 | H24 | 69.6° | 44.9° |
O33 | C32 | N31 | H29 | 1.4° | 0.4° |
N8 | C7 | C6 | C5 | 179.2° | 179.9° |
N8 | C7 | C6 | H6 | 0.8° | 0.0° |
C7 | C6 | C5 | H6 | 180.0° | 179.9° |
C7 | C6 | C5 | H5 | 176.3° | 179.9° |
C6 | C7 | N8 | H7 | 1.2° | 0.0° |
C6 | C5 | C4 | H4 | 173.8° | 180.0° |
H1 | C1 | H2 | H3 | 120.0° | 120.0° |
H4 | C4 | C5 | H5 | 6.2° | 0.0° |
H5 | C5 | C6 | H6 | 3.7° | 0.0° |
H9 | N14 | C15 | H10 | 128.9° | 148.7° |
H10 | C15 | C17 | H11 | 65.5° | 65.6° |
H10 | C15 | C17 | H12 | 176.0° | 174.4° |
H11 | C17 | C18 | H13 | 164.5° | 173.4° |
H12 | C17 | C18 | H13 | 77.0° | 66.7° |
H13 | C18 | C19 | H14 | 61.8° | 55.8° |
H13 | C18 | C19 | H15 | 58.3° | 64.2° |
H13 | C18 | C19 | H16 | 178.3° | 175.9° |
H13 | C18 | C20 | H17 | 62.2° | 60.0° |
H13 | C18 | C20 | H18 | 57.7° | 60.0° |
H13 | C18 | C20 | H19 | 177.8° | NaN° |
H14 | C19 | H15 | H16 | 120.0° | 120.0° |
H17 | C20 | H18 | H19 | 120.0° | 120.0° |
H20 | N23 | C24 | H21 | 171.4° | 145.1° |
H21 | C24 | C26 | H22 | 167.0° | 175.0° |
H21 | C24 | C26 | H23 | 73.9° | 65.0° |
H21 | C24 | C34 | H30 | 169.7° | 179.9° |
H22 | C26 | C27 | H24 | 65.2° | 176.1° |
H23 | C26 | C27 | H24 | 175.7° | 63.9° |
H24 | C27 | C29 | H25 | 14.7° | 98.4° |
H24 | C27 | C29 | H26 | 137.5° | 25.4° |
H25 | C29 | C30 | H27 | 110.6° | 24.4° |
H25 | C29 | C30 | H28 | 7.0° | 97.5° |
H26 | C29 | C30 | H27 | 12.1° | 148.2° |
H26 | C29 | C30 | H28 | 129.8° | 26.3° |
H27 | C30 | N31 | H29 | 55.3° | 78.0° |
H28 | C30 | N31 | H29 | 62.3° | 44.0° |
H30 | C34 | O35 | H31 | 61.2° | 60.0° |
H30 | C34 | C36 | H32 | 177.9° | 65.0° |
H30 | C34 | C36 | H33 | 63.3° | 55.0° |
H32 | C36 | O37 | H34 | 59.5° | 60.0° |
H33 | C36 | O37 | H34 | 59.4° | 60.0° |