ERW
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O23 | C24 | sing | 1.43Å | 1.44Å | |
O23 | C22 | sing | 1.43Å | 1.43Å | |
C24 | C25 | sing | 1.53Å | 1.51Å | |
C25 | C20 | sing | 1.53Å | 1.53Å | |
C22 | C21 | sing | 1.53Å | 1.51Å | |
C21 | C20 | sing | 1.53Å | 1.52Å | |
C20 | N19 | sing | 1.46Å | 1.46Å | |
N19 | C18 | sing | 1.39Å | 1.34Å | |
C18 | N17 | doub | 1.32Å | 1.35Å | Aromatic |
C18 | N26 | sing | 1.32Å | 1.34Å | Aromatic |
N17 | C16 | sing | 1.33Å | 1.33Å | Aromatic |
N26 | C27 | doub | 1.32Å | 1.34Å | Aromatic |
C16 | C11 | sing | 1.48Å | 1.49Å | |
C16 | C28 | doub | 1.40Å | 1.39Å | Aromatic |
C11 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
C11 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
C27 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
C10 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
C12 | C13 | doub | 1.39Å | 1.41Å | Aromatic |
C9 | C8 | doub | 1.38Å | 1.39Å | Aromatic |
C13 | C8 | sing | 1.40Å | 1.38Å | Aromatic |
C13 | C14 | sing | 1.48Å | 1.49Å | |
C28 | CL2 | sing | 1.74Å | 1.73Å | |
C8 | C7 | sing | 1.51Å | 1.50Å | |
C14 | O15 | doub | 1.22Å | 1.22Å | |
C14 | N6 | sing | 1.34Å | 1.36Å | |
C7 | N6 | sing | 1.47Å | 1.47Å | |
N6 | C5 | sing | 1.47Å | 1.45Å | |
C5 | C3 | sing | 1.51Å | 1.54Å | |
C1 | N2 | sing | 1.46Å | 1.47Å | |
C3 | N2 | sing | 1.35Å | 1.37Å | |
C3 | O4 | doub | 1.21Å | 1.23Å | |
N2 | C30 | sing | 1.47Å | 1.51Å | |
C30 | C33 | sing | 1.53Å | 1.53Å | |
C30 | C31 | sing | 1.53Å | 1.53Å | |
C30 | C32 | sing | 1.53Å | 1.52Å | |
C1 | H36 | sing | 1.09Å | 1.10Å | |
C1 | H35 | sing | 1.09Å | 1.10Å | |
C1 | H34 | sing | 1.09Å | 1.10Å | |
C5 | H37 | sing | 1.09Å | 1.10Å | |
C5 | H38 | sing | 1.09Å | 1.10Å | |
C7 | H39 | sing | 1.09Å | 1.10Å | |
C7 | H40 | sing | 1.09Å | 1.10Å | |
C10 | H42 | sing | 1.08Å | 1.08Å | |
C12 | H43 | sing | 1.08Å | 1.08Å | |
C21 | H46 | sing | 1.09Å | 1.10Å | |
C21 | H47 | sing | 1.09Å | 1.10Å | |
C22 | H48 | sing | 1.09Å | 1.10Å | |
C22 | H49 | sing | 1.09Å | 1.10Å | |
C24 | H51 | sing | 1.09Å | 1.10Å | |
C24 | H50 | sing | 1.09Å | 1.10Å | |
C25 | H52 | sing | 1.09Å | 1.10Å | |
C25 | H53 | sing | 1.09Å | 1.10Å | |
C27 | H54 | sing | 1.08Å | 1.08Å | |
C31 | H57 | sing | 1.09Å | 1.10Å | |
C31 | H56 | sing | 1.09Å | 1.10Å | |
C31 | H55 | sing | 1.09Å | 1.10Å | |
C9 | H41 | sing | 1.08Å | 1.08Å | |
N19 | H44 | sing | 0.97Å | 1.00Å | |
C20 | H45 | sing | 1.09Å | 1.10Å | |
C32 | H59 | sing | 1.09Å | 1.10Å | |
C32 | H58 | sing | 1.09Å | 1.10Å | |
C32 | H60 | sing | 1.09Å | 1.10Å | |
C33 | H61 | sing | 1.09Å | 1.10Å | |
C33 | H63 | sing | 1.09Å | 1.10Å | |
C33 | H62 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C24 | O23 | C22 | 109.5° | 114.1° |
O23 | C24 | C25 | 111.1° | 109.4° |
O23 | C24 | H51 | 109.1° | 109.5° |
O23 | C24 | H50 | 109.1° | 109.5° |
O23 | C22 | C21 | 111.5° | 109.4° |
O23 | C22 | H48 | 109.0° | 109.5° |
O23 | C22 | H49 | 109.0° | 109.5° |
C24 | C25 | C20 | 110.6° | 109.2° |
C25 | C24 | H51 | 109.1° | 109.5° |
C25 | C24 | H50 | 109.1° | 109.5° |
C24 | C25 | H52 | 109.2° | 109.6° |
C24 | C25 | H53 | 109.2° | 109.6° |
C25 | C20 | C21 | 110.5° | 109.0° |
C25 | C20 | N19 | 110.7° | 109.6° |
C20 | C25 | H52 | 109.2° | 109.5° |
C20 | C25 | H53 | 109.2° | 109.5° |
C25 | C20 | H45 | 108.3° | 109.5° |
C22 | C21 | C20 | 110.1° | 109.2° |
C22 | C21 | H46 | 109.3° | 109.5° |
C22 | C21 | H47 | 109.3° | 109.5° |
C21 | C22 | H48 | 108.9° | 109.5° |
C21 | C22 | H49 | 109.0° | 109.5° |
C21 | C20 | N19 | 109.8° | 109.5° |
C20 | C21 | H46 | 109.3° | 109.6° |
C20 | C21 | H47 | 109.3° | 109.6° |
C21 | C20 | H45 | 108.4° | 109.5° |
C20 | N19 | C18 | 125.8° | 120.0° |
C20 | N19 | H44 | 105.2° | 120.0° |
N19 | C20 | H45 | 109.2° | 109.6° |
N19 | C18 | N17 | 116.8° | 119.1° |
N19 | C18 | N26 | 116.7° | 119.2° |
C18 | N19 | H44 | 105.3° | 120.0° |
N17 | C18 | N26 | 126.5° | 121.7° |
C18 | N17 | C16 | 117.7° | 120.6° |
C18 | N26 | C27 | 115.0° | 121.0° |
N17 | C16 | C11 | 114.3° | 120.5° |
N17 | C16 | C28 | 120.1° | 119.0° |
N26 | C27 | C28 | 122.8° | 119.2° |
N26 | C27 | H54 | 118.6° | 120.4° |
C11 | C16 | C28 | 125.5° | 120.5° |
C16 | C11 | C10 | 119.1° | 120.0° |
C16 | C11 | C12 | 123.1° | 120.0° |
C16 | C28 | C27 | 117.9° | 118.4° |
C16 | C28 | CL2 | 123.0° | 120.8° |
C10 | C11 | C12 | 117.8° | 120.0° |
C11 | C10 | C9 | 121.4° | 120.1° |
C11 | C10 | H42 | 119.3° | 119.9° |
C11 | C12 | C13 | 120.8° | 119.7° |
C11 | C12 | H43 | 119.6° | 120.1° |
C27 | C28 | CL2 | 119.0° | 120.8° |
C28 | C27 | H54 | 118.6° | 120.4° |
C10 | C9 | C8 | 120.5° | 120.1° |
C9 | C10 | H42 | 119.3° | 120.0° |
C10 | C9 | H41 | 119.8° | 119.9° |
C12 | C13 | C8 | 120.0° | 119.5° |
C12 | C13 | C14 | 131.4° | 132.2° |
C13 | C12 | H43 | 119.6° | 120.1° |
C9 | C8 | C13 | 119.6° | 120.5° |
C9 | C8 | C7 | 130.9° | 133.1° |
C8 | C9 | H41 | 119.8° | 120.0° |
C8 | C13 | C14 | 108.6° | 108.2° |
C13 | C8 | C7 | 109.5° | 106.4° |
C13 | C14 | O15 | 128.8° | 124.8° |
C13 | C14 | N6 | 106.1° | 110.3° |
C8 | C7 | N6 | 102.3° | 106.2° |
C8 | C7 | H39 | 111.2° | 110.0° |
C8 | C7 | H40 | 111.2° | 110.1° |
O15 | C14 | N6 | 125.1° | 124.9° |
C14 | N6 | C7 | 113.4° | 108.8° |
C14 | N6 | C5 | 124.0° | 125.6° |
C7 | N6 | C5 | 122.6° | 125.6° |
N6 | C7 | H39 | 111.3° | 110.1° |
N6 | C7 | H40 | 111.3° | 110.1° |
N6 | C5 | C3 | 112.6° | 109.5° |
N6 | C5 | H37 | 108.7° | 109.5° |
N6 | C5 | H38 | 108.7° | 109.4° |
C5 | C3 | N2 | 116.9° | 120.0° |
C5 | C3 | O4 | 120.4° | 119.9° |
C3 | C5 | H37 | 108.7° | 109.5° |
C3 | C5 | H38 | 108.7° | 109.4° |
C1 | N2 | C3 | 119.6° | 120.0° |
C1 | N2 | C30 | 119.8° | 120.0° |
N2 | C1 | H36 | 109.5° | 109.5° |
N2 | C1 | H35 | 109.4° | 109.5° |
N2 | C1 | H34 | 109.5° | 109.4° |
N2 | C3 | O4 | 122.6° | 120.1° |
C3 | N2 | C30 | 120.0° | 120.0° |
N2 | C30 | C33 | 112.7° | 109.5° |
N2 | C30 | C31 | 111.4° | 109.5° |
N2 | C30 | C32 | 109.3° | 109.5° |
C33 | C30 | C31 | 106.8° | 109.4° |
C33 | C30 | C32 | 107.5° | 109.5° |
C30 | C33 | H61 | 109.5° | 109.5° |
C30 | C33 | H63 | 109.4° | 109.5° |
C30 | C33 | H62 | 109.5° | 109.5° |
C31 | C30 | C32 | 109.0° | 109.5° |
C30 | C31 | H57 | 109.5° | 109.5° |
C30 | C31 | H56 | 109.5° | 109.5° |
C30 | C31 | H55 | 109.5° | 109.5° |
C30 | C32 | H59 | 109.5° | 109.5° |
C30 | C32 | H58 | 109.4° | 109.5° |
C30 | C32 | H60 | 109.5° | 109.5° |
H36 | C1 | H35 | 109.5° | 109.5° |
H36 | C1 | H34 | 109.5° | 109.5° |
H35 | C1 | H34 | 109.5° | 109.4° |
H37 | C5 | H38 | 109.5° | 109.4° |
H39 | C7 | H40 | 109.5° | 110.1° |
H46 | C21 | H47 | 109.5° | 109.5° |
H48 | C22 | H49 | 109.5° | 109.5° |
H51 | C24 | H50 | 109.5° | 109.4° |
H52 | C25 | H53 | 109.5° | 109.6° |
H57 | C31 | H56 | 109.5° | 109.5° |
H57 | C31 | H55 | 109.4° | 109.5° |
H56 | C31 | H55 | 109.5° | 109.5° |
H59 | C32 | H58 | 109.5° | 109.5° |
H59 | C32 | H60 | 109.5° | 109.4° |
H58 | C32 | H60 | 109.5° | 109.5° |
H61 | C33 | H63 | 109.5° | 109.4° |
H61 | C33 | H62 | 109.5° | 109.5° |
H63 | C33 | H62 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O23 | C24 | C25 | H51 | 120.3° | 120.0° |
O23 | C24 | C25 | H50 | 120.2° | 120.0° |
O23 | C24 | C25 | C20 | 56.6° | 57.6° |
C24 | O23 | C22 | C21 | 63.6° | 61.1° |
C24 | O23 | C22 | H48 | 176.1° | 58.8° |
C24 | O23 | C22 | H49 | 56.7° | 178.9° |
O23 | C24 | H51 | H50 | 119.2° | 120.0° |
O23 | C24 | C25 | H52 | 176.8° | 177.5° |
O23 | C24 | C25 | H53 | 63.6° | 62.3° |
C22 | O23 | C24 | C25 | 62.9° | 61.2° |
O23 | C22 | C21 | H48 | 120.3° | 120.0° |
O23 | C22 | C21 | H49 | 120.3° | 120.0° |
O23 | C22 | C21 | C20 | 57.8° | 57.6° |
O23 | C22 | C21 | H46 | 62.3° | 62.3° |
O23 | C22 | C21 | H47 | 177.9° | 177.6° |
O23 | C22 | H48 | H49 | 119.1° | 120.0° |
C22 | O23 | C24 | H51 | 57.3° | 178.8° |
C22 | O23 | C24 | H50 | 176.8° | 58.8° |
C24 | C25 | C20 | H52 | 120.2° | 119.9° |
C24 | C25 | C20 | H53 | 120.2° | 119.9° |
C24 | C25 | C20 | C21 | 50.4° | 57.0° |
C24 | C25 | C20 | N19 | 172.2° | 176.9° |
C25 | C24 | H51 | H50 | 119.3° | 120.0° |
C24 | C25 | H52 | H53 | 119.5° | 120.2° |
C24 | C25 | C20 | H45 | 68.2° | 62.8° |
C25 | C20 | C21 | C22 | 50.5° | 57.0° |
C25 | C20 | C21 | N19 | 122.4° | 119.9° |
C25 | C20 | C21 | H45 | 118.5° | 119.8° |
C25 | C20 | N19 | H45 | 119.1° | 120.2° |
C25 | C20 | N19 | C18 | 87.5° | 85.4° |
C25 | C20 | C21 | H46 | 69.5° | 63.0° |
C25 | C20 | C21 | H47 | 170.6° | 176.9° |
C20 | C25 | C24 | H51 | 63.7° | 177.6° |
C20 | C25 | C24 | H50 | 176.8° | 62.4° |
C20 | C25 | H52 | H53 | 119.5° | 120.1° |
C25 | C20 | N19 | H44 | 34.7° | 94.5° |
C22 | C21 | C20 | H46 | 120.1° | 119.9° |
C22 | C21 | C20 | H47 | 120.1° | 119.9° |
C22 | C21 | C20 | N19 | 172.9° | 176.9° |
C22 | C21 | H46 | H47 | 119.7° | 120.1° |
C21 | C22 | H48 | H49 | 119.1° | 120.1° |
C22 | C21 | C20 | H45 | 68.0° | 62.9° |
C21 | C20 | N19 | H45 | 118.6° | 120.2° |
C21 | C20 | N19 | C18 | 150.2° | 155.0° |
C20 | C21 | H46 | H47 | 119.7° | 120.2° |
C20 | C21 | C22 | H48 | 178.1° | 62.4° |
C20 | C21 | C22 | H49 | 62.5° | 177.6° |
C21 | C20 | C25 | H52 | 170.6° | 176.9° |
C21 | C20 | C25 | H53 | 69.8° | 63.0° |
C21 | C20 | N19 | H44 | 87.6° | 25.0° |
C20 | N19 | C18 | H44 | 122.2° | 179.9° |
C20 | N19 | C18 | N17 | 0.3° | 180.0° |
C20 | N19 | C18 | N26 | 179.8° | 0.0° |
N19 | C20 | C21 | H46 | 52.8° | 57.0° |
N19 | C20 | C21 | H47 | 67.0° | 63.2° |
N19 | C20 | C25 | H52 | 67.6° | 63.2° |
N19 | C20 | C25 | H53 | 52.1° | 56.9° |
N19 | C18 | N17 | N26 | 179.4° | 180.0° |
N19 | C18 | N17 | C16 | 179.5° | 180.0° |
N19 | C18 | N26 | C27 | 178.5° | 179.7° |
C18 | N19 | C20 | H45 | 31.6° | 34.8° |
N17 | C18 | N26 | C27 | 1.0° | 0.3° |
C18 | N17 | C16 | C11 | 179.6° | 180.0° |
C18 | N17 | C16 | C28 | 1.1° | 0.2° |
N17 | C18 | N19 | H44 | 122.5° | 0.0° |
N26 | C18 | N17 | C16 | 0.0° | 0.0° |
C18 | N26 | C27 | C28 | 0.9° | 0.3° |
C18 | N26 | C27 | H54 | 179.1° | 179.7° |
N26 | C18 | N19 | H44 | 58.0° | 180.0° |
N17 | C16 | C11 | C28 | 178.4° | 179.7° |
N17 | C16 | C11 | C10 | 34.5° | 144.7° |
N17 | C16 | C11 | C12 | 146.4° | 35.4° |
N17 | C16 | C28 | C27 | 1.1° | 0.2° |
N17 | C16 | C28 | CL2 | 178.7° | 179.8° |
N26 | C27 | C28 | C16 | 0.1° | 0.0° |
N26 | C27 | C28 | H54 | 180.0° | 180.0° |
N26 | C27 | C28 | CL2 | 179.8° | 180.0° |
C16 | C11 | C10 | C12 | 179.2° | 179.9° |
C11 | C16 | C28 | C27 | 179.5° | 179.9° |
C16 | C11 | C10 | C9 | 180.0° | 180.0° |
C16 | C11 | C12 | C13 | 179.2° | 180.0° |
C11 | C16 | C28 | CL2 | 0.4° | 0.1° |
C16 | C11 | C10 | H42 | 0.0° | 0.1° |
C16 | C11 | C12 | H43 | 0.8° | 0.1° |
C28 | C16 | C11 | C10 | 143.9° | 35.0° |
C28 | C16 | C11 | C12 | 35.2° | 144.9° |
C16 | C28 | C27 | CL2 | 179.9° | 180.0° |
C16 | C28 | C27 | H54 | 179.9° | 180.0° |
C11 | C10 | C9 | H42 | 180.0° | 180.0° |
C10 | C11 | C12 | C13 | 0.0° | 0.1° |
C11 | C10 | C9 | C8 | 1.8° | 0.0° |
C10 | C11 | C12 | H43 | 180.0° | 180.0° |
C11 | C10 | C9 | H41 | 178.2° | 180.0° |
C12 | C11 | C10 | C9 | 0.8° | 0.1° |
C11 | C12 | C13 | H43 | 180.0° | 180.0° |
C11 | C12 | C13 | C8 | 0.2° | 0.0° |
C11 | C12 | C13 | C14 | 177.7° | 180.0° |
C12 | C11 | C10 | H42 | 179.2° | 180.0° |
C10 | C9 | C8 | H41 | 180.0° | 180.0° |
C10 | C9 | C8 | C13 | 2.0° | 0.0° |
C10 | C9 | C8 | C7 | 179.9° | 179.9° |
C12 | C13 | C8 | C9 | 1.2° | 0.0° |
C12 | C13 | C8 | C14 | 178.0° | 180.0° |
C12 | C13 | C8 | C7 | 179.5° | 180.0° |
C12 | C13 | C14 | O15 | 1.2° | 0.0° |
C12 | C13 | C14 | N6 | 178.3° | 179.9° |
C9 | C8 | C13 | C7 | 178.3° | 180.0° |
C9 | C8 | C13 | C14 | 179.2° | 180.0° |
C9 | C8 | C7 | N6 | 178.7° | 179.9° |
C9 | C8 | C7 | H39 | 59.8° | 60.8° |
C9 | C8 | C7 | H40 | 62.5° | 60.7° |
C8 | C9 | C10 | H42 | 178.2° | 180.0° |
C8 | C13 | C14 | O15 | 178.9° | 180.0° |
C8 | C13 | C14 | N6 | 0.5° | 0.0° |
C13 | C8 | C7 | N6 | 3.3° | 0.0° |
C13 | C8 | C7 | H39 | 122.1° | 119.2° |
C13 | C8 | C7 | H40 | 115.6° | 119.2° |
C8 | C13 | C12 | H43 | 179.7° | 180.0° |
C13 | C8 | C9 | H41 | 178.1° | 180.0° |
C14 | C13 | C8 | C7 | 2.5° | 0.0° |
C13 | C14 | O15 | N6 | 179.3° | 180.0° |
C13 | C14 | N6 | C7 | 1.7° | 0.0° |
C13 | C14 | N6 | C5 | 179.6° | 180.0° |
C14 | C13 | C12 | H43 | 2.2° | 0.0° |
CL2 | C28 | C27 | H54 | 0.2° | 0.0° |
C8 | C7 | N6 | C14 | 3.0° | 0.0° |
C8 | C7 | N6 | H39 | 118.8° | 119.1° |
C8 | C7 | N6 | H40 | 118.8° | 119.2° |
C8 | C7 | N6 | C5 | 178.3° | 180.0° |
C8 | C7 | H39 | H40 | 123.3° | 121.6° |
C7 | C8 | C9 | H41 | 0.1° | 0.1° |
O15 | C14 | N6 | C7 | 178.8° | 180.0° |
O15 | C14 | N6 | C5 | 0.2° | 0.0° |
C14 | N6 | C7 | C5 | 178.7° | 180.0° |
C14 | N6 | C5 | C3 | 83.6° | 90.0° |
C14 | N6 | C5 | H37 | 155.9° | 149.9° |
C14 | N6 | C5 | H38 | 36.9° | 30.0° |
C14 | N6 | C7 | H39 | 121.9° | 119.1° |
C14 | N6 | C7 | H40 | 115.8° | 119.2° |
C7 | N6 | C5 | C3 | 97.9° | 90.0° |
C7 | N6 | C5 | H37 | 22.6° | 30.1° |
C7 | N6 | C5 | H38 | 141.7° | 150.0° |
N6 | C7 | H39 | H40 | 123.4° | 121.6° |
N6 | C5 | C3 | H37 | 120.5° | 120.1° |
N6 | C5 | C3 | H38 | 120.5° | 120.0° |
N6 | C5 | C3 | N2 | 169.6° | 180.0° |
N6 | C5 | C3 | O4 | 10.5° | 0.1° |
N6 | C5 | H37 | H38 | 118.6° | 119.9° |
C5 | N6 | C7 | H39 | 59.4° | 60.9° |
C5 | N6 | C7 | H40 | 62.9° | 60.8° |
C5 | C3 | N2 | C1 | 13.5° | 0.1° |
C5 | C3 | N2 | O4 | 179.8° | 179.9° |
C5 | C3 | N2 | C30 | 157.5° | 180.0° |
C3 | C5 | H37 | H38 | 118.6° | 120.0° |
C1 | N2 | C3 | C30 | 171.0° | 180.0° |
C1 | N2 | C3 | O4 | 166.7° | 180.0° |
C1 | N2 | C30 | C33 | 7.6° | 0.0° |
C1 | N2 | C30 | C31 | 127.7° | 120.0° |
C1 | N2 | C30 | C32 | 111.8° | 120.0° |
N2 | C1 | H36 | H35 | 120.0° | 120.0° |
N2 | C1 | H36 | H34 | 120.0° | 120.0° |
N2 | C1 | H35 | H34 | 120.0° | 119.9° |
C3 | N2 | C30 | C33 | 163.3° | 179.9° |
C3 | N2 | C30 | C31 | 43.3° | 60.0° |
C3 | N2 | C30 | C32 | 77.2° | 60.0° |
C3 | N2 | C1 | H36 | 180.0° | 90.0° |
C3 | N2 | C1 | H35 | 60.0° | 149.9° |
C3 | N2 | C1 | H34 | 60.0° | 30.0° |
N2 | C3 | C5 | H37 | 49.2° | 59.9° |
N2 | C3 | C5 | H38 | 69.9° | 60.1° |
O4 | C3 | N2 | C30 | 22.3° | 0.1° |
O4 | C3 | C5 | H37 | 131.0° | 120.0° |
O4 | C3 | C5 | H38 | 109.9° | 120.0° |
N2 | C30 | C33 | C31 | 122.7° | 120.0° |
N2 | C30 | C33 | C32 | 120.5° | 120.0° |
N2 | C30 | C31 | C32 | 120.7° | 120.0° |
C30 | N2 | C1 | H36 | 9.0° | 90.0° |
C30 | N2 | C1 | H35 | 129.0° | 30.0° |
C30 | N2 | C1 | H34 | 111.0° | 150.0° |
N2 | C30 | C31 | H57 | 180.0° | 60.0° |
N2 | C30 | C31 | H56 | 60.0° | 180.0° |
N2 | C30 | C31 | H55 | 60.0° | 60.0° |
N2 | C30 | C32 | H59 | 180.0° | 60.0° |
N2 | C30 | C32 | H58 | 60.0° | 180.0° |
N2 | C30 | C32 | H60 | 60.0° | 60.0° |
N2 | C30 | C33 | H61 | 180.0° | 60.1° |
N2 | C30 | C33 | H63 | 60.0° | 180.0° |
N2 | C30 | C33 | H62 | 60.0° | 60.0° |
C33 | C30 | C31 | C32 | 115.8° | 120.0° |
C33 | C30 | C31 | H57 | 56.5° | 60.0° |
C33 | C30 | C31 | H56 | 63.5° | 60.0° |
C33 | C30 | C31 | H55 | 176.5° | 180.0° |
C33 | C30 | C32 | H59 | 57.4° | 180.0° |
C33 | C30 | C32 | H58 | 177.4° | 60.0° |
C33 | C30 | C32 | H60 | 62.6° | 60.0° |
C30 | C33 | H61 | H63 | 120.0° | 120.0° |
C30 | C33 | H61 | H62 | 120.0° | 120.0° |
C30 | C33 | H63 | H62 | 120.0° | 120.0° |
C30 | C31 | H57 | H56 | 120.0° | 120.0° |
C30 | C31 | H57 | H55 | 120.0° | 120.0° |
C30 | C31 | H56 | H55 | 120.0° | 120.0° |
C31 | C30 | C32 | H59 | 58.0° | 60.0° |
C31 | C30 | C32 | H58 | 62.0° | 60.0° |
C31 | C30 | C32 | H60 | 178.0° | 180.0° |
C31 | C30 | C33 | H61 | 57.3° | 180.0° |
C31 | C30 | C33 | H63 | 177.3° | 60.0° |
C31 | C30 | C33 | H62 | 62.7° | 60.0° |
C32 | C30 | C31 | H57 | 59.3° | 180.0° |
C32 | C30 | C31 | H56 | 179.3° | 60.0° |
C32 | C30 | C31 | H55 | 60.7° | 60.0° |
C30 | C32 | H59 | H58 | 120.0° | 120.0° |
C30 | C32 | H59 | H60 | 120.0° | 120.0° |
C30 | C32 | H58 | H60 | 120.0° | 120.0° |
C32 | C30 | C33 | H61 | 59.5° | 60.0° |
C32 | C30 | C33 | H63 | 60.5° | 60.0° |
C32 | C30 | C33 | H62 | 179.5° | 180.0° |
H36 | C1 | H35 | H34 | 120.0° | 120.0° |
H42 | C10 | C9 | H41 | 1.8° | 0.0° |
H46 | C21 | C22 | H48 | 58.0° | 177.7° |
H46 | C21 | C22 | H49 | 177.4° | 57.6° |
H46 | C21 | C20 | H45 | 172.0° | 177.2° |
H47 | C21 | C22 | H48 | 61.8° | 57.6° |
H47 | C21 | C22 | H49 | 57.6° | 62.5° |
H47 | C21 | C20 | H45 | 52.1° | 57.1° |
H51 | C24 | C25 | H52 | 56.5° | 62.5° |
H51 | C24 | C25 | H53 | 176.2° | 57.7° |
H50 | C24 | C25 | H52 | 63.0° | 57.5° |
H50 | C24 | C25 | H53 | 56.7° | 177.7° |
H52 | C25 | C20 | H45 | 52.0° | 57.1° |
H53 | C25 | C20 | H45 | 171.7° | 177.2° |
H57 | C31 | H56 | H55 | 120.0° | 120.0° |
H44 | N19 | C20 | H45 | 153.7° | 145.2° |
H59 | C32 | H58 | H60 | 120.0° | 120.0° |
H61 | C33 | H63 | H62 | 120.0° | 120.0° |