9EY
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N10 | C9 | doub | 1.31Å | 1.30Å | Aromatic |
N10 | N11 | sing | 1.28Å | 1.36Å | Aromatic |
C9 | N8 | sing | 1.35Å | 1.34Å | Aromatic |
N11 | N12 | doub | 1.29Å | 1.30Å | Aromatic |
N8 | N12 | sing | 1.41Å | 1.35Å | Aromatic |
N8 | C7 | sing | 1.40Å | 1.43Å | |
C2 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
C2 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
C7 | C6 | sing | 1.40Å | 1.41Å | Aromatic |
N23 | C24 | sing | 1.37Å | 1.36Å | Aromatic |
N23 | C22 | sing | 1.35Å | 1.35Å | Aromatic |
C3 | C4 | doub | 1.39Å | 1.38Å | Aromatic |
C18 | C19 | sing | 1.53Å | 1.57Å | |
C18 | C17 | sing | 1.53Å | 1.54Å | |
C6 | C13 | sing | 1.47Å | 1.47Å | |
C6 | C5 | doub | 1.40Å | 1.41Å | Aromatic |
C24 | C25 | doub | 1.35Å | 1.37Å | Aromatic |
C13 | C14 | doub | 1.35Å | 1.33Å | |
C19 | C20 | sing | 1.53Å | 1.56Å | |
N21 | C17 | sing | 1.46Å | 1.46Å | |
N21 | C15 | sing | 1.35Å | 1.35Å | |
C4 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
C4 | CL1 | sing | 1.74Å | 1.75Å | |
C22 | C17 | sing | 1.51Å | 1.50Å | |
C22 | N26 | doub | 1.30Å | 1.32Å | Aromatic |
O41 | C39 | doub | 1.21Å | 1.23Å | |
C14 | C15 | sing | 1.46Å | 1.48Å | |
C25 | N26 | sing | 1.35Å | 1.38Å | Aromatic |
C25 | C27 | sing | 1.48Å | 1.47Å | |
C15 | O16 | doub | 1.22Å | 1.24Å | |
C20 | C38 | sing | 1.53Å | 1.54Å | |
C39 | C38 | sing | 1.51Å | 1.52Å | |
C39 | N40 | sing | 1.35Å | 1.35Å | |
C27 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
C27 | C32 | sing | 1.40Å | 1.42Å | Aromatic |
C28 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
N40 | C32 | sing | 1.40Å | 1.43Å | |
C32 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
C29 | C30 | doub | 1.39Å | 1.40Å | Aromatic |
C31 | C30 | sing | 1.39Å | 1.39Å | Aromatic |
C30 | N33 | sing | 1.40Å | 1.42Å | |
O35 | C34 | doub | 1.21Å | 1.21Å | |
N33 | C34 | sing | 1.35Å | 1.36Å | |
C34 | O36 | sing | 1.35Å | 1.35Å | |
O36 | C37 | sing | 1.45Å | 1.45Å | |
C13 | H46 | sing | 1.08Å | 1.08Å | |
C18 | H50 | sing | 1.09Å | 1.10Å | |
C18 | H49 | sing | 1.09Å | 1.10Å | |
C17 | H48 | sing | 1.09Å | 1.10Å | |
C19 | H51 | sing | 1.09Å | 1.10Å | |
C19 | H52 | sing | 1.09Å | 1.10Å | |
C20 | H54 | sing | 1.09Å | 1.10Å | |
C20 | H53 | sing | 1.09Å | 1.10Å | |
C24 | H57 | sing | 1.08Å | 1.08Å | |
C2 | H42 | sing | 1.08Å | 1.08Å | |
C3 | H43 | sing | 1.08Å | 1.08Å | |
C5 | H44 | sing | 1.08Å | 1.08Å | |
C9 | H45 | sing | 1.08Å | 1.08Å | |
C14 | H47 | sing | 1.08Å | 1.08Å | |
N21 | H55 | sing | 0.97Å | 1.00Å | |
N23 | H56 | sing | 0.97Å | 1.00Å | |
C28 | H58 | sing | 1.08Å | 1.08Å | |
C29 | H59 | sing | 1.08Å | 1.08Å | |
C31 | H60 | sing | 1.08Å | 1.08Å | |
N33 | H61 | sing | 0.97Å | 1.00Å | |
C37 | H62 | sing | 1.09Å | 1.10Å | |
C37 | H63 | sing | 1.09Å | 1.10Å | |
C37 | H64 | sing | 1.09Å | 1.10Å | |
C38 | H65 | sing | 1.09Å | 1.10Å | |
C38 | H66 | sing | 1.09Å | 1.10Å | |
N40 | H67 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C9 | N10 | N11 | 105.6° | 110.6° |
N10 | C9 | N8 | 109.7° | 107.3° |
N10 | C9 | H45 | 125.2° | 126.4° |
N10 | N11 | N12 | 110.9° | 110.2° |
C9 | N8 | N12 | 107.5° | 105.2° |
C9 | N8 | C7 | 132.0° | 127.4° |
N8 | C9 | H45 | 125.1° | 126.3° |
N11 | N12 | N8 | 106.3° | 106.7° |
N12 | N8 | C7 | 120.5° | 127.4° |
N8 | C7 | C2 | 118.9° | 120.2° |
N8 | C7 | C6 | 121.0° | 120.1° |
C7 | C2 | C3 | 120.4° | 120.2° |
C2 | C7 | C6 | 120.1° | 119.7° |
C7 | C2 | H42 | 119.8° | 119.9° |
C2 | C3 | C4 | 119.3° | 120.4° |
C3 | C2 | H42 | 119.8° | 119.9° |
C2 | C3 | H43 | 120.4° | 119.8° |
C7 | C6 | C13 | 123.1° | 120.2° |
C7 | C6 | C5 | 118.8° | 119.6° |
C24 | N23 | C22 | 107.4° | 107.3° |
N23 | C24 | C25 | 106.1° | 106.7° |
N23 | C24 | H57 | 127.0° | 126.6° |
C24 | N23 | H56 | 126.3° | 126.4° |
N23 | C22 | C17 | 124.1° | 126.9° |
N23 | C22 | N26 | 111.5° | 109.1° |
C22 | N23 | H56 | 126.2° | 126.4° |
C3 | C4 | C5 | 121.5° | 120.3° |
C3 | C4 | CL1 | 119.3° | 119.8° |
C4 | C3 | H43 | 120.3° | 119.8° |
C19 | C18 | C17 | 113.6° | 110.2° |
C18 | C19 | C20 | 116.8° | 109.6° |
C19 | C18 | H50 | 108.5° | 109.4° |
C19 | C18 | H49 | 108.4° | 109.4° |
C18 | C19 | H51 | 107.6° | 109.5° |
C18 | C19 | H52 | 107.6° | 109.5° |
C18 | C17 | N21 | 114.1° | 109.5° |
C18 | C17 | C22 | 109.6° | 109.3° |
C17 | C18 | H50 | 108.4° | 109.3° |
C17 | C18 | H49 | 108.4° | 109.3° |
C18 | C17 | H48 | 105.8° | 109.5° |
C13 | C6 | C5 | 117.9° | 120.2° |
C6 | C13 | C14 | 124.3° | 120.0° |
C6 | C13 | H46 | 117.8° | 120.0° |
C6 | C5 | C4 | 119.7° | 119.9° |
C6 | C5 | H44 | 120.1° | 120.0° |
C24 | C25 | N26 | 109.5° | 107.9° |
C24 | C25 | C27 | 133.1° | 129.3° |
C25 | C24 | H57 | 127.0° | 126.7° |
C13 | C14 | C15 | 129.6° | 120.0° |
C14 | C13 | H46 | 117.9° | 120.0° |
C13 | C14 | H47 | 115.2° | 120.0° |
C19 | C20 | C38 | 115.4° | 110.2° |
C20 | C19 | H51 | 107.6° | 109.4° |
C20 | C19 | H52 | 107.6° | 109.4° |
C19 | C20 | H54 | 107.9° | 109.4° |
C19 | C20 | H53 | 108.0° | 109.4° |
C17 | N21 | C15 | 118.8° | 120.0° |
N21 | C17 | C22 | 113.7° | 109.5° |
N21 | C17 | H48 | 106.7° | 109.6° |
C17 | N21 | H55 | 120.6° | 120.0° |
N21 | C15 | C14 | 116.4° | 120.0° |
N21 | C15 | O16 | 121.8° | 120.0° |
C15 | N21 | H55 | 120.6° | 120.0° |
C5 | C4 | CL1 | 119.2° | 119.8° |
C4 | C5 | H44 | 120.2° | 120.1° |
C17 | C22 | N26 | 123.8° | 123.9° |
C22 | C17 | H48 | 106.2° | 109.5° |
C22 | N26 | C25 | 105.5° | 109.0° |
O41 | C39 | C38 | 121.8° | 121.2° |
O41 | C39 | N40 | 122.8° | 121.2° |
C14 | C15 | O16 | 121.8° | 120.0° |
C15 | C14 | H47 | 115.2° | 120.0° |
N26 | C25 | C27 | 117.1° | 122.8° |
C25 | C27 | C28 | 118.5° | 122.7° |
C25 | C27 | C32 | 122.5° | 117.2° |
C20 | C38 | C39 | 113.9° | 109.1° |
C38 | C20 | H54 | 108.0° | 109.3° |
C38 | C20 | H53 | 108.0° | 109.3° |
C20 | C38 | H65 | 108.3° | 109.6° |
C20 | C38 | H66 | 108.3° | 109.5° |
C38 | C39 | N40 | 115.3° | 117.5° |
C39 | C38 | H65 | 108.4° | 109.6° |
C39 | C38 | H66 | 108.3° | 109.6° |
C39 | N40 | C32 | 124.6° | 122.2° |
C39 | N40 | H67 | 117.7° | 118.9° |
C28 | C27 | C32 | 118.9° | 120.2° |
C27 | C28 | C29 | 120.9° | 119.6° |
C27 | C28 | H58 | 119.5° | 120.2° |
C27 | C32 | N40 | 120.2° | 117.3° |
C27 | C32 | C31 | 119.4° | 120.1° |
C28 | C29 | C30 | 120.2° | 120.3° |
C29 | C28 | H58 | 119.5° | 120.2° |
C28 | C29 | H59 | 119.9° | 119.9° |
N40 | C32 | C31 | 120.3° | 122.7° |
C32 | N40 | H67 | 117.7° | 118.9° |
C32 | C31 | C30 | 121.1° | 119.6° |
C32 | C31 | H60 | 119.5° | 120.2° |
C29 | C30 | C31 | 119.4° | 120.3° |
C29 | C30 | N33 | 124.3° | 119.8° |
C30 | C29 | H59 | 119.9° | 119.9° |
C31 | C30 | N33 | 116.3° | 119.8° |
C30 | C31 | H60 | 119.5° | 120.2° |
C30 | N33 | C34 | 127.2° | 119.9° |
C30 | N33 | H61 | 116.4° | 120.0° |
O35 | C34 | N33 | 126.1° | 120.0° |
O35 | C34 | O36 | 124.3° | 120.0° |
N33 | C34 | O36 | 109.7° | 119.9° |
C34 | N33 | H61 | 116.4° | 120.1° |
C34 | O36 | C37 | 116.1° | 116.9° |
O36 | C37 | H62 | 109.5° | 109.4° |
O36 | C37 | H63 | 109.5° | 109.5° |
O36 | C37 | H64 | 109.5° | 109.5° |
H50 | C18 | H49 | 109.5° | 109.2° |
H51 | C19 | H52 | 109.5° | 109.4° |
H54 | C20 | H53 | 109.5° | 109.2° |
H62 | C37 | H63 | 109.5° | 109.5° |
H62 | C37 | H64 | 109.5° | 109.4° |
H63 | C37 | H64 | 109.5° | 109.6° |
H65 | C38 | H66 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N10 | C9 | N8 | H45 | 180.0° | 179.9° |
C9 | N10 | N11 | N12 | 0.4° | 0.0° |
N10 | C9 | N8 | N12 | 0.2° | 0.1° |
N10 | C9 | N8 | C7 | 178.5° | 179.7° |
N11 | N10 | C9 | N8 | 0.3° | 0.1° |
N10 | N11 | N12 | N8 | 0.3° | 0.0° |
N11 | N10 | C9 | H45 | 179.6° | 180.0° |
C9 | N8 | N12 | N11 | 0.1° | 0.1° |
C9 | N8 | N12 | C7 | 178.9° | 179.8° |
C9 | N8 | C7 | C2 | 58.1° | 48.3° |
C9 | N8 | C7 | C6 | 120.0° | 131.6° |
N11 | N12 | N8 | C7 | 179.0° | 179.7° |
N12 | N8 | C7 | C2 | 123.3° | 131.4° |
N12 | N8 | C7 | C6 | 58.6° | 48.7° |
N12 | N8 | C9 | H45 | 179.8° | 180.0° |
N8 | C7 | C2 | C6 | 178.2° | 179.9° |
N8 | C7 | C2 | C3 | 176.9° | 180.0° |
N8 | C7 | C6 | C13 | 6.2° | 0.0° |
N8 | C7 | C6 | C5 | 177.7° | 180.0° |
N8 | C7 | C2 | H42 | 3.1° | 0.2° |
C7 | N8 | C9 | H45 | 1.5° | 0.3° |
C7 | C2 | C3 | H42 | 180.0° | 179.8° |
C7 | C2 | C3 | C4 | 1.3° | 0.0° |
C2 | C7 | C6 | C13 | 175.7° | 179.9° |
C2 | C7 | C6 | C5 | 0.4° | 0.0° |
C7 | C2 | C3 | H43 | 178.7° | 179.9° |
C3 | C2 | C7 | C6 | 1.3° | 0.1° |
C2 | C3 | C4 | H43 | 180.0° | 180.0° |
C2 | C3 | C4 | C5 | 0.5° | 0.0° |
C2 | C3 | C4 | CL1 | 179.4° | 180.0° |
C7 | C6 | C13 | C5 | 176.2° | 180.0° |
C7 | C6 | C13 | C14 | 116.9° | 164.5° |
C7 | C6 | C5 | C4 | 0.4° | 0.0° |
C7 | C6 | C13 | H46 | 63.1° | 15.8° |
C6 | C7 | C2 | H42 | 178.8° | 179.8° |
C7 | C6 | C5 | H44 | 179.6° | 179.9° |
C24 | N23 | C22 | H56 | 180.0° | 180.0° |
N23 | C24 | C25 | H57 | 180.0° | 180.0° |
C24 | N23 | C22 | C17 | 170.3° | 180.0° |
C24 | N23 | C22 | N26 | 1.0° | 0.1° |
N23 | C24 | C25 | N26 | 1.1° | 0.0° |
N23 | C24 | C25 | C27 | 171.8° | 179.8° |
N23 | C22 | C17 | C18 | 58.0° | 154.9° |
C22 | N23 | C24 | C25 | 0.1° | 0.1° |
N23 | C22 | C17 | N21 | 71.1° | 85.2° |
N23 | C22 | C17 | N26 | 170.3° | 179.9° |
N23 | C22 | N26 | C25 | 1.6° | 0.2° |
N23 | C22 | C17 | H48 | 171.9° | 35.0° |
C22 | N23 | C24 | H57 | 179.8° | 180.0° |
C3 | C4 | C5 | C6 | 0.3° | 0.0° |
C3 | C4 | C5 | CL1 | 179.9° | 179.9° |
C4 | C3 | C2 | H42 | 178.7° | 179.8° |
C3 | C4 | C5 | H44 | 179.7° | 180.0° |
C19 | C18 | C17 | H50 | 120.6° | 120.2° |
C19 | C18 | C17 | H49 | 120.6° | 120.3° |
C18 | C19 | C20 | H51 | 121.1° | 120.0° |
C18 | C19 | C20 | H52 | 121.1° | 120.1° |
C19 | C18 | C17 | N21 | 179.4° | 63.8° |
C19 | C18 | C17 | C22 | 50.6° | 56.2° |
C18 | C19 | C20 | C38 | 154.7° | 177.1° |
C19 | C18 | H50 | H49 | 118.1° | 119.7° |
C19 | C18 | C17 | H48 | 63.6° | 176.1° |
C18 | C19 | H51 | H52 | 116.7° | 120.0° |
C18 | C19 | C20 | H54 | 33.9° | 56.9° |
C18 | C19 | C20 | H53 | 84.4° | 62.7° |
C17 | C18 | C19 | C20 | 49.8° | 146.3° |
C18 | C17 | N21 | C22 | 126.7° | 119.8° |
C18 | C17 | N21 | H48 | 116.5° | 120.1° |
C18 | C17 | N21 | C15 | 162.0° | 155.0° |
C18 | C17 | C22 | H48 | 113.9° | 119.9° |
C18 | C17 | C22 | N26 | 112.3° | 25.0° |
C17 | C18 | H50 | H49 | 118.1° | 119.5° |
C17 | C18 | C19 | H51 | 170.9° | 93.6° |
C17 | C18 | C19 | H52 | 71.2° | 26.3° |
C18 | C17 | N21 | H55 | 18.0° | 25.0° |
C6 | C13 | C14 | H46 | 180.0° | 179.7° |
C13 | C6 | C5 | C4 | 176.7° | 180.0° |
C6 | C13 | C14 | C15 | 178.9° | 179.7° |
C13 | C6 | C5 | H44 | 3.3° | 0.1° |
C6 | C13 | C14 | H47 | 1.0° | 0.2° |
C5 | C6 | C13 | C14 | 59.3° | 15.6° |
C6 | C5 | C4 | H44 | 180.0° | 179.9° |
C6 | C5 | C4 | CL1 | 179.8° | 180.0° |
C5 | C6 | C13 | H46 | 120.7° | 164.1° |
C24 | C25 | N26 | C22 | 1.7° | 0.1° |
C24 | C25 | N26 | C27 | 174.2° | 179.8° |
C24 | C25 | C27 | C28 | 51.6° | 1.0° |
C24 | C25 | C27 | C32 | 129.6° | 179.1° |
C25 | C24 | N23 | H56 | 179.8° | 180.0° |
C13 | C14 | C15 | N21 | 9.4° | 180.0° |
C13 | C14 | C15 | H47 | 180.0° | 180.0° |
C13 | C14 | C15 | O16 | 167.3° | 0.0° |
C19 | C20 | C38 | H54 | 120.9° | 120.2° |
C19 | C20 | C38 | H53 | 120.9° | 120.2° |
C19 | C20 | C38 | C39 | 66.1° | 85.2° |
C20 | C19 | C18 | H50 | 170.4° | 26.1° |
C20 | C19 | C18 | H49 | 70.8° | 93.4° |
C20 | C19 | H51 | H52 | 116.6° | 119.9° |
C19 | C20 | H54 | H53 | 117.3° | 119.7° |
C19 | C20 | C38 | H65 | 173.3° | 154.9° |
C19 | C20 | C38 | H66 | 54.6° | 34.8° |
C17 | N21 | C15 | H55 | 180.0° | 180.0° |
N21 | C17 | C22 | H48 | 117.0° | 120.2° |
N21 | C17 | C22 | N26 | 118.6° | 94.9° |
C17 | N21 | C15 | C14 | 179.4° | 180.0° |
C17 | N21 | C15 | O16 | 3.9° | 0.0° |
N21 | C17 | C18 | H50 | 58.8° | 176.0° |
N21 | C17 | C18 | H49 | 59.9° | 56.5° |
C15 | N21 | C17 | C22 | 71.3° | 85.2° |
N21 | C15 | C14 | O16 | 176.7° | 180.0° |
C15 | N21 | C17 | H48 | 45.5° | 34.9° |
N21 | C15 | C14 | H47 | 170.7° | 0.0° |
C5 | C4 | C3 | H43 | 179.5° | 180.0° |
CL1 | C4 | C3 | H43 | 0.6° | 0.1° |
CL1 | C4 | C5 | H44 | 0.2° | 0.1° |
C17 | C22 | N26 | C25 | 169.7° | 179.9° |
C22 | C17 | C18 | H50 | 70.1° | 64.0° |
C22 | C17 | C18 | H49 | 171.2° | 176.5° |
C22 | C17 | N21 | H55 | 108.7° | 94.8° |
C17 | C22 | N23 | H56 | 9.6° | 0.0° |
C22 | N26 | C25 | C27 | 172.5° | 179.7° |
N26 | C22 | C17 | H48 | 1.6° | 144.9° |
N26 | C22 | N23 | H56 | 179.0° | 179.9° |
O41 | C39 | C38 | C20 | 91.0° | 149.7° |
O41 | C39 | C38 | N40 | 177.0° | 180.0° |
O41 | C39 | N40 | C32 | 3.6° | 0.1° |
O41 | C39 | C38 | H65 | 148.4° | 29.8° |
O41 | C39 | C38 | H66 | 29.6° | 90.4° |
O41 | C39 | N40 | H67 | 176.4° | 179.9° |
C15 | C14 | C13 | H46 | 1.1° | 0.0° |
C14 | C15 | N21 | H55 | 0.6° | 0.0° |
N26 | C25 | C27 | C28 | 136.0° | 178.8° |
N26 | C25 | C27 | C32 | 42.9° | 1.1° |
N26 | C25 | C24 | H57 | 178.8° | 179.9° |
C25 | C27 | C28 | C32 | 178.9° | 179.9° |
C25 | C27 | C28 | C29 | 177.5° | 179.8° |
C25 | C27 | C32 | N40 | 5.1° | 0.3° |
C25 | C27 | C32 | C31 | 176.8° | 179.8° |
C27 | C25 | C24 | H57 | 8.3° | 0.2° |
C25 | C27 | C28 | H58 | 2.5° | 0.2° |
O16 | C15 | C14 | H47 | 12.6° | 180.0° |
O16 | C15 | N21 | H55 | 176.1° | 180.0° |
C20 | C38 | C39 | H65 | 120.7° | 119.9° |
C20 | C38 | C39 | H66 | 120.6° | 119.9° |
C20 | C38 | C39 | N40 | 86.0° | 30.3° |
C38 | C20 | C19 | H51 | 84.2° | 62.8° |
C38 | C20 | C19 | H52 | 33.7° | 57.1° |
C38 | C20 | H54 | H53 | 117.3° | 119.6° |
C20 | C38 | H65 | H66 | 118.0° | 120.2° |
C38 | C39 | N40 | C32 | 173.4° | 179.9° |
C39 | C38 | C20 | H54 | 54.8° | 35.1° |
C39 | C38 | C20 | H53 | 173.1° | 154.6° |
C39 | C38 | H65 | H66 | 118.0° | 120.2° |
C38 | C39 | N40 | H67 | 6.7° | 0.1° |
C39 | N40 | C32 | C27 | 59.8° | 179.9° |
C39 | N40 | C32 | H67 | 180.0° | 180.0° |
C39 | N40 | C32 | C31 | 118.3° | 0.1° |
N40 | C39 | C38 | H65 | 34.7° | 150.2° |
N40 | C39 | C38 | H66 | 153.4° | 89.6° |
C27 | C28 | C29 | H58 | 180.0° | 180.0° |
C28 | C27 | C32 | N40 | 176.0° | 179.8° |
C28 | C27 | C32 | C31 | 2.1° | 0.1° |
C27 | C28 | C29 | C30 | 0.9° | 0.0° |
C27 | C28 | C29 | H59 | 179.0° | 179.9° |
C32 | C27 | C28 | C29 | 1.3° | 0.1° |
C27 | C32 | N40 | C31 | 178.1° | 179.9° |
C27 | C32 | C31 | C30 | 0.5° | 0.0° |
C32 | C27 | C28 | H58 | 178.7° | 179.9° |
C27 | C32 | C31 | H60 | 179.5° | 179.9° |
C27 | C32 | N40 | H67 | 120.2° | 0.1° |
C28 | C29 | C30 | H59 | 180.0° | 179.9° |
C28 | C29 | C30 | C31 | 2.5° | 0.2° |
C28 | C29 | C30 | N33 | 178.8° | 179.9° |
N40 | C32 | C31 | C30 | 177.6° | 179.9° |
N40 | C32 | C31 | H60 | 2.4° | 0.2° |
C32 | C31 | C30 | C29 | 1.7° | 0.2° |
C32 | C31 | C30 | H60 | 180.0° | 179.9° |
C32 | C31 | C30 | N33 | 178.3° | 179.9° |
C31 | C32 | N40 | H67 | 61.7° | 179.9° |
C29 | C30 | C31 | N33 | 176.6° | 179.9° |
C29 | C30 | N33 | C34 | 11.0° | 148.0° |
C30 | C29 | C28 | H58 | 179.0° | 180.0° |
C29 | C30 | C31 | H60 | 178.3° | 179.9° |
C29 | C30 | N33 | H61 | 169.0° | 32.1° |
C31 | C30 | N33 | C34 | 165.5° | 32.1° |
C31 | C30 | C29 | H59 | 177.5° | 179.9° |
C31 | C30 | N33 | H61 | 14.6° | 147.8° |
C30 | N33 | C34 | O35 | 9.1° | 5.2° |
C30 | N33 | C34 | H61 | 180.0° | 180.0° |
C30 | N33 | C34 | O36 | 171.1° | 174.8° |
N33 | C30 | C29 | H59 | 1.2° | 0.0° |
N33 | C30 | C31 | H60 | 1.7° | 0.0° |
O35 | C34 | N33 | O36 | 179.8° | 180.0° |
O35 | C34 | O36 | C37 | 6.4° | 0.0° |
O35 | C34 | N33 | H61 | 170.9° | 174.8° |
N33 | C34 | O36 | C37 | 173.4° | 180.0° |
O36 | C34 | N33 | H61 | 8.9° | 5.1° |
C34 | O36 | C37 | H62 | 180.0° | 180.0° |
C34 | O36 | C37 | H63 | 60.0° | 60.0° |
C34 | O36 | C37 | H64 | 60.0° | 60.1° |
O36 | C37 | H62 | H63 | 120.0° | 120.0° |
O36 | C37 | H62 | H64 | 120.0° | 119.9° |
O36 | C37 | H63 | H64 | 120.0° | 120.1° |
H46 | C13 | C14 | H47 | 179.0° | 179.9° |
H50 | C18 | C17 | H48 | 175.8° | 55.9° |
H50 | C18 | C19 | H51 | 68.5° | 146.2° |
H50 | C18 | C19 | H52 | 49.4° | 93.9° |
H49 | C18 | C17 | H48 | 57.0° | 63.6° |
H49 | C18 | C19 | H51 | 50.3° | 26.6° |
H49 | C18 | C19 | H52 | 168.1° | 146.5° |
H48 | C17 | N21 | H55 | 134.5° | 145.0° |
H51 | C19 | C20 | H54 | 154.9° | 177.0° |
H51 | C19 | C20 | H53 | 36.7° | 57.4° |
H52 | C19 | C20 | H54 | 87.2° | 63.1° |
H52 | C19 | C20 | H53 | 154.6° | 177.3° |
H54 | C20 | C38 | H65 | 65.9° | 84.8° |
H54 | C20 | C38 | H66 | 175.4° | 155.0° |
H53 | C20 | C38 | H65 | 52.4° | 34.7° |
H53 | C20 | C38 | H66 | 66.3° | 85.5° |
H57 | C24 | N23 | H56 | 0.2° | 0.0° |
H42 | C2 | C3 | H43 | 1.3° | 0.3° |
H58 | C28 | C29 | H59 | 1.0° | 0.1° |
H62 | C37 | H63 | H64 | 120.0° | 120.0° |