Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.53Å | 1.54Å | |
C1 | H36 | sing | 1.09Å | 1.10Å | |
C1 | H37 | sing | 1.09Å | 1.10Å | |
C1 | H38 | sing | 1.09Å | 1.10Å | |
C2 | C3 | sing | 1.51Å | 1.53Å | |
C2 | N6 | sing | 1.47Å | 1.48Å | |
C2 | H39 | sing | 1.09Å | 1.10Å | |
C3 | O4 | doub | 1.21Å | 1.24Å | |
C3 | O5 | sing | 1.34Å | 1.26Å | |
O5 | HO5 | sing | 0.97Å | 0.95Å | |
N6 | C7 | sing | 1.47Å | 1.47Å | |
N6 | H40 | sing | 1.01Å | 1.00Å | |
C7 | C8 | sing | 1.53Å | 1.54Å | |
C7 | C16 | sing | 1.51Å | 1.52Å | |
C7 | H41 | sing | 1.09Å | 1.10Å | |
C8 | C9 | sing | 1.53Å | 1.52Å | |
C8 | H42 | sing | 1.09Å | 1.10Å | |
C8 | H43 | sing | 1.09Å | 1.10Å | |
C9 | C10 | sing | 1.51Å | 1.50Å | |
C9 | H44 | sing | 1.09Å | 1.10Å | |
C9 | H45 | sing | 1.09Å | 1.10Å | |
C10 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
C10 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
C11 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
C11 | H46 | sing | 1.08Å | 1.08Å | |
C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
C12 | H47 | sing | 1.08Å | 1.08Å | |
C13 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
C13 | H48 | sing | 1.08Å | 1.08Å | |
C14 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
C14 | H49 | sing | 1.08Å | 1.08Å | |
C15 | H50 | sing | 1.08Å | 1.08Å | |
C16 | O17 | doub | 1.21Å | 1.23Å | |
C16 | N18 | sing | 1.35Å | 1.33Å | |
N18 | C19 | sing | 1.47Å | 1.46Å | |
N18 | H51 | sing | 0.97Å | 1.00Å | |
C19 | C20 | sing | 1.53Å | 1.51Å | |
C19 | C27 | sing | 1.51Å | 1.52Å | |
C19 | H52 | sing | 1.09Å | 1.10Å | |
C20 | C21 | sing | 1.53Å | 1.48Å | |
C20 | H53 | sing | 1.09Å | 1.10Å | |
C20 | H54 | sing | 1.09Å | 1.10Å | |
C21 | C22 | sing | 1.53Å | 1.48Å | |
C21 | H55 | sing | 1.09Å | 1.10Å | |
C21 | H56 | sing | 1.09Å | 1.10Å | |
C22 | N23 | sing | 1.47Å | 1.45Å | |
C22 | H57 | sing | 1.09Å | 1.10Å | |
C22 | H58 | sing | 1.09Å | 1.10Å | |
N23 | C24 | sing | 1.37Å | 1.33Å | |
N23 | H59 | sing | 0.97Å | 1.00Å | |
C24 | N25 | sing | 1.33Å | 1.33Å | |
C24 | N26 | doub | 1.33Å | 1.34Å | |
N25 | H60 | sing | 0.97Å | 1.00Å | |
N25 | H61 | sing | 0.97Å | 1.00Å | |
N26 | H62 | sing | 0.97Å | 1.00Å | |
N26 | H63 | sing | 0.97Å | 1.00Å | |
C27 | O28 | doub | 1.21Å | 1.23Å | |
C27 | N29 | sing | 1.35Å | 1.33Å | |
N29 | C30 | sing | 1.40Å | 1.37Å | |
N29 | H64 | sing | 0.97Å | 1.00Å | |
C30 | C31 | doub | 1.39Å | 1.39Å | Aromatic |
C30 | C35 | sing | 1.39Å | 1.39Å | Aromatic |
C31 | C32 | sing | 1.38Å | 1.40Å | Aromatic |
C31 | H65 | sing | 1.08Å | 1.08Å | |
C32 | C33 | doub | 1.38Å | 1.38Å | Aromatic |
C32 | H66 | sing | 1.08Å | 1.08Å | |
C33 | C34 | sing | 1.38Å | 1.38Å | Aromatic |
C33 | H67 | sing | 1.08Å | 1.08Å | |
C34 | C35 | doub | 1.38Å | 1.40Å | Aromatic |
C34 | H68 | sing | 1.08Å | 1.08Å | |
C35 | H69 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | H36 | 109.5° | 109.5° |
C2 | C1 | H37 | 109.4° | 109.5° |
C2 | C1 | H38 | 109.5° | 109.5° |
C1 | C2 | C3 | 111.1° | 109.4° |
C1 | C2 | N6 | 108.8° | 109.5° |
C1 | C2 | H39 | 111.1° | 109.5° |
H36 | C1 | H37 | 109.5° | 109.4° |
H36 | C1 | H38 | 109.5° | 109.5° |
H37 | C1 | H38 | 109.5° | 109.5° |
C3 | C2 | N6 | 115.4° | 109.5° |
C3 | C2 | H39 | 103.8° | 109.4° |
C2 | C3 | O4 | 117.6° | 120.0° |
C2 | C3 | O5 | 121.4° | 120.0° |
N6 | C2 | H39 | 106.4° | 109.5° |
C2 | N6 | C7 | 114.3° | 111.0° |
C2 | N6 | H40 | 107.9° | 111.0° |
O4 | C3 | O5 | 121.1° | 120.0° |
C3 | O5 | HO5 | 109.5° | 117.0° |
C7 | N6 | H40 | 107.9° | 111.0° |
N6 | C7 | C8 | 109.4° | 109.5° |
N6 | C7 | C16 | 108.2° | 109.5° |
N6 | C7 | H41 | 110.5° | 109.5° |
C8 | C7 | C16 | 109.9° | 109.4° |
C8 | C7 | H41 | 108.8° | 109.5° |
C7 | C8 | C9 | 113.7° | 109.5° |
C7 | C8 | H42 | 108.1° | 109.5° |
C7 | C8 | H43 | 107.1° | 109.5° |
C16 | C7 | H41 | 110.0° | 109.5° |
C7 | C16 | O17 | 120.3° | 120.0° |
C7 | C16 | N18 | 116.5° | 120.0° |
C9 | C8 | H42 | 108.1° | 109.4° |
C9 | C8 | H43 | 107.1° | 109.4° |
C8 | C9 | C10 | 117.5° | 109.5° |
C8 | C9 | H44 | 106.9° | 109.5° |
C8 | C9 | H45 | 105.0° | 109.5° |
H42 | C8 | H43 | 112.9° | 109.5° |
C10 | C9 | H44 | 106.9° | 109.5° |
C10 | C9 | H45 | 105.0° | 109.5° |
C9 | C10 | C11 | 120.3° | 120.0° |
C9 | C10 | C15 | 120.9° | 120.0° |
H44 | C9 | H45 | 116.0° | 109.4° |
C11 | C10 | C15 | 118.7° | 120.0° |
C10 | C11 | C12 | 121.0° | 120.0° |
C10 | C11 | H46 | 119.5° | 120.0° |
C10 | C15 | C14 | 120.6° | 119.9° |
C10 | C15 | H50 | 119.7° | 120.0° |
C12 | C11 | H46 | 119.5° | 120.0° |
C11 | C12 | C13 | 119.9° | 120.0° |
C11 | C12 | H47 | 120.1° | 120.0° |
C13 | C12 | H47 | 120.0° | 120.0° |
C12 | C13 | C14 | 120.0° | 120.0° |
C12 | C13 | H48 | 120.0° | 120.0° |
C14 | C13 | H48 | 120.0° | 120.0° |
C13 | C14 | C15 | 119.8° | 120.0° |
C13 | C14 | H49 | 120.1° | 120.0° |
C15 | C14 | H49 | 120.1° | 120.0° |
C14 | C15 | H50 | 119.7° | 120.0° |
O17 | C16 | N18 | 123.3° | 120.0° |
C16 | N18 | C19 | 121.2° | 120.0° |
C16 | N18 | H51 | 119.4° | 120.0° |
C19 | N18 | H51 | 119.4° | 120.0° |
N18 | C19 | C20 | 110.8° | 109.5° |
N18 | C19 | C27 | 111.1° | 109.4° |
N18 | C19 | H52 | 106.7° | 109.5° |
C20 | C19 | C27 | 107.1° | 109.5° |
C20 | C19 | H52 | 110.7° | 109.5° |
C19 | C20 | C21 | 115.4° | 109.4° |
C19 | C20 | H53 | 107.5° | 109.5° |
C19 | C20 | H54 | 106.2° | 109.5° |
C27 | C19 | H52 | 110.4° | 109.4° |
C19 | C27 | O28 | 120.3° | 120.0° |
C19 | C27 | N29 | 115.4° | 120.0° |
C21 | C20 | H53 | 107.6° | 109.5° |
C21 | C20 | H54 | 106.2° | 109.4° |
C20 | C21 | C22 | 105.2° | 109.5° |
C20 | C21 | H55 | 110.9° | 109.5° |
C20 | C21 | H56 | 111.9° | 109.5° |
H53 | C20 | H54 | 114.2° | 109.5° |
C22 | C21 | H55 | 110.9° | 109.5° |
C22 | C21 | H56 | 111.8° | 109.4° |
C21 | C22 | N23 | 113.4° | 109.5° |
C21 | C22 | H57 | 108.2° | 109.5° |
C21 | C22 | H58 | 107.3° | 109.5° |
H55 | C21 | H56 | 106.2° | 109.4° |
N23 | C22 | H57 | 108.2° | 109.5° |
N23 | C22 | H58 | 107.3° | 109.4° |
C22 | N23 | C24 | 122.7° | 120.0° |
C22 | N23 | H59 | 118.7° | 120.0° |
H57 | C22 | H58 | 112.6° | 109.5° |
C24 | N23 | H59 | 118.7° | 120.0° |
N23 | C24 | N25 | 120.3° | 120.0° |
N23 | C24 | N26 | 119.6° | 120.0° |
N25 | C24 | N26 | 120.1° | 120.0° |
C24 | N25 | H60 | 110.6° | 119.9° |
C24 | N25 | H61 | 124.7° | 120.0° |
C24 | N26 | H62 | 110.6° | 120.0° |
C24 | N26 | H63 | 124.7° | 120.0° |
H60 | N25 | H61 | 124.7° | 120.0° |
H62 | N26 | H63 | 124.7° | 120.0° |
O28 | C27 | N29 | 124.0° | 120.0° |
C27 | N29 | C30 | 130.5° | 120.0° |
C27 | N29 | H64 | 114.7° | 120.0° |
C30 | N29 | H64 | 114.7° | 120.0° |
N29 | C30 | C31 | 118.2° | 120.1° |
N29 | C30 | C35 | 123.2° | 120.1° |
C31 | C30 | C35 | 118.6° | 119.9° |
C30 | C31 | C32 | 120.8° | 120.0° |
C30 | C31 | H65 | 119.6° | 120.0° |
C30 | C35 | C34 | 120.9° | 119.9° |
C30 | C35 | H69 | 119.6° | 120.1° |
C32 | C31 | H65 | 119.6° | 120.0° |
C31 | C32 | C33 | 119.9° | 120.1° |
C31 | C32 | H66 | 120.1° | 120.0° |
C33 | C32 | H66 | 120.0° | 119.9° |
C32 | C33 | C34 | 119.9° | 120.1° |
C32 | C33 | H67 | 120.0° | 119.9° |
C34 | C33 | H67 | 120.1° | 119.9° |
C33 | C34 | C35 | 119.9° | 120.1° |
C33 | C34 | H68 | 120.0° | 120.0° |
C35 | C34 | H68 | 120.0° | 120.0° |
C34 | C35 | H69 | 119.6° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | H36 | H37 | 120.0° | 120.0° |
C2 | C1 | H36 | H38 | 120.0° | 120.0° |
C2 | C1 | H37 | H38 | 120.0° | 120.0° |
C1 | C2 | C3 | N6 | 124.5° | 120.0° |
C1 | C2 | C3 | H39 | 119.5° | 120.0° |
C1 | C2 | N6 | H39 | 119.7° | 120.0° |
C1 | C2 | C3 | O4 | 38.3° | 120.0° |
C1 | C2 | C3 | O5 | 141.7° | 60.0° |
C1 | C2 | N6 | C7 | 62.7° | 81.0° |
C1 | C2 | N6 | H40 | 177.3° | 43.0° |
H36 | C1 | H37 | H38 | 120.0° | 120.0° |
H36 | C1 | C2 | C3 | 37.0° | 175.1° |
H36 | C1 | C2 | N6 | 91.2° | 55.1° |
H36 | C1 | C2 | H39 | 152.0° | 64.9° |
H37 | C1 | C2 | C3 | 157.0° | 65.0° |
H37 | C1 | C2 | N6 | 28.8° | 175.0° |
H37 | C1 | C2 | H39 | 88.0° | 55.0° |
H38 | C1 | C2 | C3 | 83.0° | 55.0° |
H38 | C1 | C2 | N6 | 148.8° | 65.0° |
H38 | C1 | C2 | H39 | 32.0° | 175.0° |
C3 | C2 | N6 | H39 | 114.5° | 120.0° |
C2 | C3 | O4 | O5 | 180.0° | 180.0° |
C2 | C3 | O5 | HO5 | 180.0° | 180.0° |
C3 | C2 | N6 | C7 | 63.0° | 159.0° |
C3 | C2 | N6 | H40 | 57.0° | 77.0° |
N6 | C2 | C3 | O4 | 162.8° | 0.0° |
N6 | C2 | C3 | O5 | 17.2° | 180.0° |
C2 | N6 | C7 | H40 | 120.0° | 124.0° |
C2 | N6 | C7 | C8 | 130.7° | 159.2° |
C2 | N6 | C7 | C16 | 109.6° | 80.8° |
C2 | N6 | C7 | H41 | 10.9° | 39.2° |
H39 | C2 | C3 | O4 | 81.2° | 120.0° |
H39 | C2 | C3 | O5 | 98.8° | 60.0° |
H39 | C2 | N6 | C7 | 177.5° | 39.0° |
H39 | C2 | N6 | H40 | 57.5° | 163.0° |
O4 | C3 | O5 | HO5 | 0.0° | 0.0° |
N6 | C7 | C8 | C16 | 118.7° | 120.0° |
N6 | C7 | C8 | H41 | 120.8° | 120.1° |
N6 | C7 | C16 | H41 | 120.8° | 120.1° |
N6 | C7 | C8 | C9 | 174.7° | 65.7° |
N6 | C7 | C8 | H42 | 65.4° | 54.3° |
N6 | C7 | C8 | H43 | 56.5° | 174.4° |
N6 | C7 | C16 | O17 | 37.9° | 16.1° |
N6 | C7 | C16 | N18 | 141.6° | 164.0° |
H40 | N6 | C7 | C8 | 10.7° | 35.2° |
H40 | N6 | C7 | C16 | 130.4° | 155.2° |
H40 | N6 | C7 | H41 | 109.1° | 84.8° |
C8 | C7 | C16 | H41 | 119.8° | 119.9° |
C7 | C8 | C9 | H42 | 120.0° | 120.0° |
C7 | C8 | C9 | H43 | 118.1° | 120.0° |
C7 | C8 | H42 | H43 | 118.2° | 120.1° |
C7 | C8 | C9 | C10 | 171.6° | 180.0° |
C7 | C8 | C9 | H44 | 68.4° | 60.0° |
C7 | C8 | C9 | H45 | 55.4° | 60.0° |
C8 | C7 | C16 | O17 | 81.5° | 103.9° |
C8 | C7 | C16 | N18 | 99.0° | 76.0° |
C16 | C7 | C8 | C9 | 56.0° | 174.3° |
C16 | C7 | C8 | H42 | 176.0° | 65.7° |
C16 | C7 | C8 | H43 | 62.1° | 54.4° |
C7 | C16 | O17 | N18 | 179.6° | 179.9° |
C7 | C16 | N18 | C19 | 179.1° | 180.0° |
C7 | C16 | N18 | H51 | 0.9° | 0.0° |
H41 | C7 | C8 | C9 | 64.5° | 54.4° |
H41 | C7 | C8 | H42 | 55.4° | 174.3° |
H41 | C7 | C8 | H43 | 177.3° | 65.6° |
H41 | C7 | C16 | O17 | 158.7° | 136.2° |
H41 | C7 | C16 | N18 | 20.9° | 43.9° |
C9 | C8 | H42 | H43 | 118.3° | 119.9° |
C8 | C9 | C10 | H44 | 120.0° | 120.0° |
C8 | C9 | C10 | H45 | 116.2° | 120.0° |
C8 | C9 | H44 | H45 | 116.7° | 120.0° |
C8 | C9 | C10 | C11 | 122.1° | 90.0° |
C8 | C9 | C10 | C15 | 59.2° | 90.3° |
H42 | C8 | C9 | C10 | 51.6° | 60.0° |
H42 | C8 | C9 | H44 | 171.6° | 180.0° |
H42 | C8 | C9 | H45 | 64.6° | 60.0° |
H43 | C8 | C9 | C10 | 70.3° | 60.0° |
H43 | C8 | C9 | H44 | 49.7° | 60.0° |
H43 | C8 | C9 | H45 | 173.5° | 180.0° |
C10 | C9 | H44 | H45 | 116.7° | 120.0° |
C9 | C10 | C11 | C15 | 178.7° | 179.7° |
C9 | C10 | C11 | C12 | 178.8° | 180.0° |
C9 | C10 | C11 | H46 | 1.3° | 0.0° |
C9 | C10 | C15 | C14 | 178.7° | 179.8° |
C9 | C10 | C15 | H50 | 1.3° | 0.0° |
H44 | C9 | C10 | C11 | 117.8° | 30.0° |
H44 | C9 | C10 | C15 | 60.8° | 149.7° |
H45 | C9 | C10 | C11 | 5.9° | 149.9° |
H45 | C9 | C10 | C15 | 175.5° | 29.7° |
C10 | C11 | C12 | H46 | 180.0° | 179.9° |
C10 | C11 | C12 | C13 | 0.1° | 0.1° |
C10 | C11 | C12 | H47 | 179.9° | 179.9° |
C11 | C10 | C15 | C14 | 0.0° | 0.5° |
C11 | C10 | C15 | H50 | 180.0° | 179.7° |
C15 | C10 | C11 | C12 | 0.1° | 0.3° |
C15 | C10 | C11 | H46 | 179.9° | 179.7° |
C10 | C15 | C14 | C13 | 0.0° | 0.4° |
C10 | C15 | C14 | H50 | 180.0° | 179.8° |
C10 | C15 | C14 | H49 | 180.0° | 179.7° |
C11 | C12 | C13 | H47 | 180.0° | 180.0° |
C11 | C12 | C13 | C14 | 0.1° | 0.0° |
C11 | C12 | C13 | H48 | 179.9° | 180.0° |
H46 | C11 | C12 | C13 | 179.9° | 180.0° |
H46 | C11 | C12 | H47 | 0.1° | 0.0° |
C12 | C13 | C14 | H48 | 180.0° | 180.0° |
C12 | C13 | C14 | C15 | 0.0° | 0.2° |
C12 | C13 | C14 | H49 | 179.9° | 180.0° |
H47 | C12 | C13 | C14 | 179.9° | 180.0° |
H47 | C12 | C13 | H48 | 0.1° | 0.0° |
C13 | C14 | C15 | H49 | 180.0° | 179.9° |
C13 | C14 | C15 | H50 | 180.0° | 179.8° |
H48 | C13 | C14 | C15 | 180.0° | 179.9° |
H48 | C13 | C14 | H49 | 0.1° | 0.0° |
H49 | C14 | C15 | H50 | 0.0° | 0.1° |
O17 | C16 | N18 | C19 | 1.3° | 0.1° |
O17 | C16 | N18 | H51 | 178.7° | 180.0° |
C16 | N18 | C19 | H51 | 180.0° | 180.0° |
C16 | N18 | C19 | C20 | 143.9° | 155.0° |
C16 | N18 | C19 | C27 | 97.2° | 85.0° |
C16 | N18 | C19 | H52 | 23.2° | 34.9° |
N18 | C19 | C20 | C27 | 121.4° | 120.0° |
N18 | C19 | C20 | H52 | 118.2° | 120.1° |
N18 | C19 | C27 | H52 | 118.2° | 120.0° |
N18 | C19 | C20 | C21 | 55.6° | 65.1° |
N18 | C19 | C20 | H53 | 64.4° | 55.0° |
N18 | C19 | C20 | H54 | 172.9° | 175.0° |
N18 | C19 | C27 | O28 | 32.4° | 0.0° |
N18 | C19 | C27 | N29 | 153.4° | 180.0° |
H51 | N18 | C19 | C20 | 36.1° | 24.9° |
H51 | N18 | C19 | C27 | 82.9° | 95.0° |
H51 | N18 | C19 | H52 | 156.7° | 145.0° |
C20 | C19 | C27 | H52 | 120.7° | 120.0° |
C19 | C20 | C21 | H53 | 120.0° | 120.1° |
C19 | C20 | C21 | H54 | 117.3° | 120.0° |
C19 | C20 | H53 | H54 | 117.6° | 120.0° |
C19 | C20 | C21 | C22 | 178.4° | 180.0° |
C19 | C20 | C21 | H55 | 61.6° | 59.9° |
C19 | C20 | C21 | H56 | 56.8° | 60.0° |
C20 | C19 | C27 | O28 | 88.8° | 119.9° |
C20 | C19 | C27 | N29 | 85.4° | 60.0° |
C27 | C19 | C20 | C21 | 177.0° | 175.0° |
C27 | C19 | C20 | H53 | 56.9° | 65.0° |
C27 | C19 | C20 | H54 | 65.7° | 55.0° |
C19 | C27 | O28 | N29 | 173.7° | 179.9° |
C19 | C27 | N29 | C30 | 179.9° | 175.4° |
C19 | C27 | N29 | H64 | 0.1° | 4.6° |
H52 | C19 | C20 | C21 | 62.6° | 55.0° |
H52 | C19 | C20 | H53 | 177.4° | 175.0° |
H52 | C19 | C20 | H54 | 54.7° | 64.9° |
H52 | C19 | C27 | O28 | 150.6° | 120.0° |
H52 | C19 | C27 | N29 | 35.2° | 60.0° |
C21 | C20 | H53 | H54 | 117.6° | 119.9° |
C20 | C21 | C22 | H55 | 120.0° | 120.1° |
C20 | C21 | C22 | H56 | 121.6° | 120.0° |
C20 | C21 | H55 | H56 | 121.8° | 120.0° |
C20 | C21 | C22 | N23 | 178.0° | 180.0° |
C20 | C21 | C22 | H57 | 58.1° | 60.0° |
C20 | C21 | C22 | H58 | 63.7° | 60.1° |
H53 | C20 | C21 | C22 | 58.4° | 59.9° |
H53 | C20 | C21 | H55 | 178.4° | 180.0° |
H53 | C20 | C21 | H56 | 63.2° | 60.0° |
H54 | C20 | C21 | C22 | 64.3° | 60.1° |
H54 | C20 | C21 | H55 | 55.7° | 60.0° |
H54 | C20 | C21 | H56 | 174.1° | 180.0° |
C22 | C21 | H55 | H56 | 121.7° | 119.9° |
C21 | C22 | N23 | H57 | 120.0° | 120.1° |
C21 | C22 | N23 | H58 | 118.3° | 119.9° |
C21 | C22 | H57 | H58 | 118.4° | 120.0° |
C21 | C22 | N23 | C24 | 154.5° | 180.0° |
C21 | C22 | N23 | H59 | 25.5° | 0.1° |
H55 | C21 | C22 | N23 | 62.0° | 59.9° |
H55 | C21 | C22 | H57 | 178.0° | 179.9° |
H55 | C21 | C22 | H58 | 56.3° | 60.0° |
H56 | C21 | C22 | N23 | 56.4° | 60.0° |
H56 | C21 | C22 | H57 | 63.6° | 60.0° |
H56 | C21 | C22 | H58 | 174.7° | 180.0° |
N23 | C22 | H57 | H58 | 118.4° | 119.9° |
C22 | N23 | C24 | H59 | 180.0° | 179.9° |
C22 | N23 | C24 | N25 | 179.4° | 0.0° |
C22 | N23 | C24 | N26 | 1.0° | 180.0° |
H57 | C22 | N23 | C24 | 34.5° | 59.9° |
H57 | C22 | N23 | H59 | 145.5° | 120.0° |
H58 | C22 | N23 | C24 | 87.2° | 60.0° |
H58 | C22 | N23 | H59 | 92.8° | 120.1° |
N23 | C24 | N25 | N26 | 179.6° | 180.0° |
N23 | C24 | N25 | H60 | 180.0° | 0.1° |
N23 | C24 | N25 | H61 | 0.0° | 180.0° |
N23 | C24 | N26 | H62 | 0.2° | 180.0° |
N23 | C24 | N26 | H63 | 179.8° | 0.0° |
H59 | N23 | C24 | N25 | 0.6° | 179.9° |
H59 | N23 | C24 | N26 | 179.0° | 0.1° |
C24 | N25 | H60 | H61 | 180.0° | 179.9° |
N25 | C24 | N26 | H62 | 179.8° | 0.1° |
N25 | C24 | N26 | H63 | 0.2° | 180.0° |
N26 | C24 | N25 | H60 | 0.4° | 180.0° |
N26 | C24 | N25 | H61 | 179.5° | 0.1° |
C24 | N26 | H62 | H63 | 180.0° | 180.0° |
O28 | C27 | N29 | C30 | 6.1° | 4.7° |
O28 | C27 | N29 | H64 | 173.9° | 175.3° |
C27 | N29 | C30 | H64 | 180.0° | 180.0° |
C27 | N29 | C30 | C31 | 163.1° | 34.1° |
C27 | N29 | C30 | C35 | 15.1° | 146.2° |
N29 | C30 | C31 | C35 | 178.2° | 179.7° |
N29 | C30 | C31 | C32 | 177.9° | 180.0° |
N29 | C30 | C31 | H65 | 2.1° | 0.1° |
N29 | C30 | C35 | C34 | 177.8° | 179.7° |
N29 | C30 | C35 | H69 | 2.2° | 0.0° |
H64 | N29 | C30 | C31 | 17.0° | 145.8° |
H64 | N29 | C30 | C35 | 164.9° | 33.8° |
C30 | C31 | C32 | H65 | 180.0° | 179.9° |
C30 | C31 | C32 | C33 | 0.2° | 0.0° |
C30 | C31 | C32 | H66 | 179.8° | 179.9° |
C31 | C30 | C35 | C34 | 0.3° | 0.6° |
C31 | C30 | C35 | H69 | 179.7° | 179.6° |
C35 | C30 | C31 | C32 | 0.4° | 0.3° |
C35 | C30 | C31 | H65 | 179.6° | 179.8° |
C30 | C35 | C34 | C33 | 0.1° | 0.6° |
C30 | C35 | C34 | H69 | 180.0° | 179.8° |
C30 | C35 | C34 | H68 | 180.0° | 179.7° |
C31 | C32 | C33 | H66 | 180.0° | 179.9° |
C31 | C32 | C33 | C34 | 0.1° | 0.0° |
C31 | C32 | C33 | H67 | 179.9° | 180.0° |
H65 | C31 | C32 | C33 | 179.8° | 179.9° |
H65 | C31 | C32 | H66 | 0.2° | 0.0° |
C32 | C33 | C34 | H67 | 180.0° | 180.0° |
C32 | C33 | C34 | C35 | 0.1° | 0.2° |
C32 | C33 | C34 | H68 | 179.9° | 180.0° |
H66 | C32 | C33 | C34 | 179.9° | 180.0° |
H66 | C32 | C33 | H67 | 0.1° | 0.0° |
C33 | C34 | C35 | H68 | 180.0° | 179.8° |
C33 | C34 | C35 | H69 | 179.9° | 179.7° |
H67 | C33 | C34 | C35 | 179.9° | 179.7° |
H67 | C33 | C34 | H68 | 0.2° | 0.0° |
H68 | C34 | C35 | H69 | 0.1° | 0.1° |