FY9
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N28 | C25 | sing | 1.47Å | 1.49Å | |
O30 | C27 | sing | 1.43Å | 1.44Å | |
C25 | C24 | sing | 1.51Å | 1.48Å | |
C25 | C27 | sing | 1.53Å | 1.55Å | |
O26 | C24 | doub | 1.21Å | 1.22Å | |
C24 | N19 | sing | 1.35Å | 1.32Å | |
C27 | C29 | sing | 1.53Å | 1.56Å | |
O33 | S31 | doub | 1.42Å | 1.45Å | |
N19 | C20 | sing | 1.47Å | 1.44Å | |
N19 | C18 | sing | 1.47Å | 1.47Å | |
C29 | S31 | sing | 1.81Å | 1.67Å | |
C20 | C21 | sing | 1.53Å | 1.53Å | |
C18 | C17 | sing | 1.53Å | 1.55Å | |
S31 | O34 | doub | 1.42Å | 1.44Å | |
S31 | C32 | sing | 1.81Å | 1.69Å | |
C21 | C16 | sing | 1.53Å | 1.52Å | |
C17 | C16 | sing | 1.53Å | 1.54Å | |
C16 | C15 | sing | 1.53Å | 1.53Å | |
C15 | C12 | sing | 1.51Å | 1.51Å | |
C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
C12 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
C13 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
C11 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
C14 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
C9 | C10 | sing | 1.40Å | 1.39Å | Aromatic |
C9 | C8 | sing | 1.43Å | 1.29Å | |
C8 | C7 | trip | 1.17Å | 1.18Å | |
C7 | C4 | sing | 1.43Å | 1.29Å | |
C3 | C4 | doub | 1.40Å | 1.39Å | Aromatic |
C3 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
C4 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
C2 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
C1 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
C1 | C22 | sing | 1.51Å | 1.51Å | |
C22 | O23 | sing | 1.43Å | 1.43Å | |
C2 | H1 | sing | 1.08Å | 1.08Å | |
C3 | H2 | sing | 1.08Å | 1.08Å | |
C5 | H3 | sing | 1.08Å | 1.08Å | |
C6 | H4 | sing | 1.08Å | 1.08Å | |
C10 | H5 | sing | 1.08Å | 1.08Å | |
C11 | H6 | sing | 1.08Å | 1.08Å | |
C13 | H7 | sing | 1.08Å | 1.08Å | |
C14 | H8 | sing | 1.08Å | 1.08Å | |
C15 | H9 | sing | 1.09Å | 1.10Å | |
C15 | H10 | sing | 1.09Å | 1.10Å | |
C16 | H11 | sing | 1.09Å | 1.10Å | |
C17 | H12 | sing | 1.09Å | 1.10Å | |
C17 | H13 | sing | 1.09Å | 1.10Å | |
C18 | H14 | sing | 1.09Å | 1.10Å | |
C18 | H15 | sing | 1.09Å | 1.10Å | |
C20 | H16 | sing | 1.09Å | 1.10Å | |
C20 | H17 | sing | 1.09Å | 1.10Å | |
C21 | H18 | sing | 1.09Å | 1.10Å | |
C21 | H19 | sing | 1.09Å | 1.10Å | |
C22 | H20 | sing | 1.09Å | 1.10Å | |
C22 | H21 | sing | 1.09Å | 1.10Å | |
O23 | H22 | sing | 0.97Å | 0.95Å | |
C25 | H23 | sing | 1.09Å | 1.10Å | |
C27 | H24 | sing | 1.09Å | 1.10Å | |
N28 | H25 | sing | 1.01Å | 1.00Å | |
N28 | H26 | sing | 1.01Å | 1.00Å | |
C29 | H28 | sing | 1.09Å | 1.10Å | |
C29 | H29 | sing | 1.09Å | 1.10Å | |
O30 | H30 | sing | 0.97Å | 0.95Å | |
C32 | H31 | sing | 1.09Å | 1.10Å | |
C32 | H32 | sing | 1.09Å | 1.10Å | |
C32 | H33 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N28 | C25 | C24 | 102.9° | 109.5° |
N28 | C25 | C27 | 119.0° | 109.4° |
N28 | C25 | H23 | 112.1° | 109.4° |
C25 | N28 | H25 | 109.5° | 111.0° |
C25 | N28 | H26 | 109.4° | 111.0° |
O30 | C27 | C25 | 110.9° | 109.5° |
O30 | C27 | C29 | 115.2° | 109.5° |
O30 | C27 | H24 | 105.4° | 109.4° |
C27 | O30 | H30 | 109.5° | 114.0° |
C24 | C25 | C27 | 98.3° | 109.5° |
C25 | C24 | O26 | 117.4° | 120.0° |
C25 | C24 | N19 | 119.6° | 120.0° |
C24 | C25 | H23 | 112.2° | 109.5° |
C25 | C27 | C29 | 115.3° | 109.5° |
C27 | C25 | H23 | 111.2° | 109.5° |
C25 | C27 | H24 | 104.3° | 109.5° |
O26 | C24 | N19 | 122.6° | 120.0° |
C24 | N19 | C20 | 117.3° | 120.6° |
C24 | N19 | C18 | 127.6° | 120.6° |
C27 | C29 | S31 | 117.6° | 109.5° |
C29 | C27 | H24 | 104.2° | 109.5° |
C27 | C29 | H28 | 107.4° | 109.5° |
C27 | C29 | H29 | 107.4° | 109.5° |
O33 | S31 | C29 | 105.7° | 108.6° |
O33 | S31 | O34 | 109.1° | 119.2° |
O33 | S31 | C32 | 112.5° | 108.6° |
C20 | N19 | C18 | 115.1° | 118.7° |
N19 | C20 | C21 | 107.8° | 108.8° |
N19 | C20 | H16 | 109.9° | 109.6° |
N19 | C20 | H17 | 109.9° | 109.6° |
N19 | C18 | C17 | 111.4° | 108.8° |
N19 | C18 | H14 | 109.0° | 109.6° |
N19 | C18 | H15 | 109.0° | 109.7° |
C29 | S31 | O34 | 109.1° | 108.6° |
C29 | S31 | C32 | 111.5° | 101.9° |
S31 | C29 | H28 | 107.4° | 109.4° |
S31 | C29 | H29 | 107.4° | 109.5° |
C20 | C21 | C16 | 111.5° | 109.3° |
C21 | C20 | H16 | 109.9° | 109.6° |
C21 | C20 | H17 | 109.9° | 109.6° |
C20 | C21 | H18 | 108.9° | 109.5° |
C20 | C21 | H19 | 109.0° | 109.5° |
C18 | C17 | C16 | 115.9° | 109.3° |
C18 | C17 | H12 | 107.8° | 109.5° |
C18 | C17 | H13 | 107.8° | 109.5° |
C17 | C18 | H14 | 109.0° | 109.6° |
C17 | C18 | H15 | 109.0° | 109.6° |
O34 | S31 | C32 | 108.9° | 108.6° |
S31 | C32 | H31 | 109.5° | 109.5° |
S31 | C32 | H32 | 109.5° | 109.5° |
S31 | C32 | H33 | 109.5° | 109.5° |
C21 | C16 | C17 | 106.4° | 109.6° |
C21 | C16 | C15 | 109.8° | 109.5° |
C21 | C16 | H11 | 109.1° | 109.5° |
C16 | C21 | H18 | 109.0° | 109.5° |
C16 | C21 | H19 | 109.0° | 109.5° |
C17 | C16 | C15 | 113.5° | 109.4° |
C17 | C16 | H11 | 108.9° | 109.5° |
C16 | C17 | H12 | 107.8° | 109.5° |
C16 | C17 | H13 | 107.9° | 109.5° |
C16 | C15 | C12 | 116.4° | 109.5° |
C16 | C15 | H9 | 107.7° | 109.5° |
C16 | C15 | H10 | 107.7° | 109.5° |
C15 | C16 | H11 | 109.0° | 109.5° |
C15 | C12 | C13 | 119.7° | 119.8° |
C15 | C12 | C11 | 120.4° | 119.8° |
C12 | C15 | H9 | 107.7° | 109.5° |
C12 | C15 | H10 | 107.7° | 109.4° |
C13 | C12 | C11 | 119.9° | 120.4° |
C12 | C13 | C14 | 120.1° | 120.1° |
C12 | C13 | H7 | 119.9° | 120.0° |
C12 | C11 | C10 | 120.0° | 120.1° |
C12 | C11 | H6 | 120.0° | 119.9° |
C13 | C14 | C9 | 120.0° | 119.9° |
C14 | C13 | H7 | 120.0° | 119.9° |
C13 | C14 | H8 | 120.0° | 120.0° |
C11 | C10 | C9 | 120.1° | 119.8° |
C11 | C10 | H5 | 119.9° | 120.1° |
C10 | C11 | H6 | 120.0° | 119.9° |
C14 | C9 | C10 | 119.9° | 119.7° |
C14 | C9 | C8 | 120.0° | 120.2° |
C9 | C14 | H8 | 120.0° | 120.1° |
C10 | C9 | C8 | 120.1° | 120.2° |
C9 | C10 | H5 | 120.0° | 120.1° |
C9 | C8 | C7 | 176.5° | 180.0° |
C8 | C7 | C4 | 177.0° | 180.0° |
C7 | C4 | C3 | 120.6° | 120.2° |
C7 | C4 | C5 | 119.6° | 120.2° |
C4 | C3 | C2 | 120.0° | 119.8° |
C3 | C4 | C5 | 119.8° | 119.7° |
C4 | C3 | H2 | 120.0° | 120.1° |
C3 | C2 | C1 | 120.1° | 120.2° |
C3 | C2 | H1 | 119.9° | 119.9° |
C2 | C3 | H2 | 120.0° | 120.1° |
C4 | C5 | C6 | 120.2° | 119.8° |
C4 | C5 | H3 | 119.9° | 120.1° |
C2 | C1 | C6 | 119.8° | 120.4° |
C2 | C1 | C22 | 120.3° | 119.8° |
C1 | C2 | H1 | 119.9° | 120.0° |
C5 | C6 | C1 | 120.0° | 120.1° |
C6 | C5 | H3 | 119.9° | 120.1° |
C5 | C6 | H4 | 120.0° | 119.9° |
C6 | C1 | C22 | 119.9° | 119.8° |
C1 | C6 | H4 | 120.0° | 119.9° |
C1 | C22 | O23 | 109.4° | 109.5° |
C1 | C22 | H20 | 109.5° | 109.5° |
C1 | C22 | H21 | 109.5° | 109.5° |
O23 | C22 | H20 | 109.5° | 109.5° |
O23 | C22 | H21 | 109.5° | 109.5° |
C22 | O23 | H22 | 109.5° | 114.0° |
H9 | C15 | H10 | 109.5° | 109.5° |
H12 | C17 | H13 | 109.5° | 109.5° |
H14 | C18 | H15 | 109.5° | 109.6° |
H16 | C20 | H17 | 109.4° | 109.7° |
H18 | C21 | H19 | 109.5° | 109.5° |
H20 | C22 | H21 | 109.5° | 109.4° |
H25 | N28 | H26 | 109.4° | 111.1° |
H28 | C29 | H29 | 109.5° | 109.5° |
H31 | C32 | H32 | 109.4° | 109.5° |
H31 | C32 | H33 | 109.5° | 109.5° |
H32 | C32 | H33 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N28 | C25 | C27 | O30 | 1.4° | 60.1° |
N28 | C25 | C24 | C27 | 122.4° | 120.0° |
N28 | C25 | C24 | H23 | 120.6° | 119.9° |
N28 | C25 | C27 | H23 | 132.5° | 119.9° |
N28 | C25 | C24 | O26 | 41.2° | 20.1° |
N28 | C25 | C24 | N19 | 146.3° | 160.0° |
N28 | C25 | C27 | C29 | 131.8° | 60.0° |
N28 | C25 | C27 | H24 | 114.5° | 180.0° |
C25 | N28 | H25 | H26 | 120.0° | 124.0° |
O30 | C27 | C25 | C24 | 108.3° | 59.9° |
O30 | C27 | C25 | C29 | 133.3° | 120.0° |
O30 | C27 | C25 | H24 | 113.0° | 119.9° |
O30 | C27 | C29 | H24 | 115.1° | 119.9° |
O30 | C27 | C29 | S31 | 42.1° | 60.0° |
O30 | C27 | C25 | H23 | 133.9° | 180.0° |
O30 | C27 | C29 | H28 | 79.0° | 60.0° |
O30 | C27 | C29 | H29 | 163.3° | 179.9° |
C24 | C25 | C27 | H23 | 117.8° | 120.1° |
C25 | C24 | O26 | N19 | 172.2° | 179.9° |
C24 | C25 | C27 | C29 | 118.4° | 180.0° |
C25 | C24 | N19 | C20 | 174.3° | 180.0° |
C25 | C24 | N19 | C18 | 3.9° | 0.0° |
C24 | C25 | C27 | H24 | 4.7° | 60.0° |
C24 | C25 | N28 | H25 | 180.0° | 60.0° |
C24 | C25 | N28 | H26 | 60.0° | 64.0° |
C27 | C25 | C24 | O26 | 81.2° | 99.9° |
C27 | C25 | C24 | N19 | 91.3° | 80.0° |
C25 | C27 | C29 | H24 | 113.7° | 120.0° |
C25 | C27 | C29 | S31 | 173.3° | 180.0° |
C27 | C25 | N28 | H25 | 72.8° | 60.0° |
C27 | C25 | N28 | H26 | 47.1° | 176.0° |
C25 | C27 | C29 | H28 | 52.2° | 60.0° |
C25 | C27 | C29 | H29 | 65.5° | 60.0° |
C25 | C27 | O30 | H30 | 179.7° | 60.1° |
O26 | C24 | N19 | C20 | 2.3° | 0.0° |
O26 | C24 | N19 | C18 | 176.0° | 180.0° |
O26 | C24 | C25 | H23 | 161.9° | 140.0° |
C24 | N19 | C20 | C18 | 178.4° | 180.0° |
C24 | N19 | C20 | C21 | 118.2° | 126.4° |
C24 | N19 | C18 | C17 | 128.2° | 126.4° |
C24 | N19 | C18 | H14 | 8.0° | 113.8° |
C24 | N19 | C18 | H15 | 111.4° | 6.6° |
C24 | N19 | C20 | H16 | 122.0° | 113.8° |
C24 | N19 | C20 | H17 | 1.5° | 6.6° |
N19 | C24 | C25 | H23 | 25.7° | 40.1° |
C27 | C29 | S31 | O33 | 92.7° | 65.5° |
C27 | C29 | S31 | H28 | 121.2° | 120.0° |
C27 | C29 | S31 | H29 | 121.2° | 120.0° |
C27 | C29 | S31 | O34 | 24.5° | 65.5° |
C27 | C29 | S31 | C32 | 144.8° | 180.0° |
C29 | C27 | C25 | H23 | 0.6° | 59.9° |
C27 | C29 | H28 | H29 | 116.3° | 120.0° |
C29 | C27 | O30 | H30 | 47.0° | 60.0° |
O33 | S31 | C29 | O34 | 117.2° | 131.0° |
O33 | S31 | C29 | C32 | 122.5° | 114.5° |
O33 | S31 | O34 | C32 | 123.2° | 125.0° |
O33 | S31 | C29 | H28 | 28.5° | 174.5° |
O33 | S31 | C29 | H29 | 146.2° | 54.5° |
O33 | S31 | C32 | H31 | 180.0° | 54.5° |
O33 | S31 | C32 | H32 | 60.0° | 65.5° |
O33 | S31 | C32 | H33 | 60.0° | 174.5° |
N19 | C20 | C21 | H16 | 119.7° | 119.8° |
N19 | C20 | C21 | H17 | 119.7° | 119.8° |
C20 | N19 | C18 | C17 | 50.0° | 53.6° |
N19 | C20 | C21 | C16 | 65.2° | 54.6° |
C20 | N19 | C18 | H14 | 170.3° | 66.2° |
C20 | N19 | C18 | H15 | 70.3° | 173.5° |
N19 | C20 | H16 | H17 | 120.7° | 120.4° |
N19 | C20 | C21 | H18 | 174.5° | 65.3° |
N19 | C20 | C21 | H19 | 55.1° | 174.6° |
C18 | N19 | C20 | C21 | 60.2° | 53.6° |
N19 | C18 | C17 | H14 | 120.3° | 119.8° |
N19 | C18 | C17 | H15 | 120.3° | 120.0° |
N19 | C18 | C17 | C16 | 44.0° | 54.6° |
N19 | C18 | C17 | H12 | 76.9° | 174.6° |
N19 | C18 | C17 | H13 | 165.0° | 65.3° |
N19 | C18 | H14 | H15 | 119.1° | 120.4° |
C18 | N19 | C20 | H16 | 59.6° | 66.2° |
C18 | N19 | C20 | H17 | 180.0° | 173.4° |
C29 | S31 | O34 | C32 | 121.8° | 110.1° |
S31 | C29 | C27 | H24 | 72.9° | 60.0° |
S31 | C29 | H28 | H29 | 116.3° | 120.0° |
C29 | S31 | C32 | H31 | 61.5° | 60.0° |
C29 | S31 | C32 | H32 | 178.5° | 180.0° |
C29 | S31 | C32 | H33 | 58.5° | 60.0° |
C20 | C21 | C16 | H18 | 120.3° | 119.9° |
C20 | C21 | C16 | H19 | 120.3° | 120.0° |
C20 | C21 | C16 | C17 | 58.1° | 61.4° |
C20 | C21 | C16 | C15 | 178.6° | 178.6° |
C20 | C21 | C16 | H11 | 59.2° | 58.7° |
C21 | C20 | H16 | H17 | 120.8° | 120.3° |
C20 | C21 | H18 | H19 | 119.1° | 120.1° |
C18 | C17 | C16 | C21 | 48.0° | 61.3° |
C18 | C17 | C16 | H12 | 120.9° | 120.0° |
C18 | C17 | C16 | H13 | 120.9° | 119.9° |
C18 | C17 | C16 | C15 | 168.9° | 178.6° |
C18 | C17 | C16 | H11 | 69.5° | 58.7° |
C18 | C17 | H12 | H13 | 117.0° | 120.1° |
C17 | C18 | H14 | H15 | 119.2° | 120.3° |
O34 | S31 | C29 | H28 | 145.7° | 54.5° |
O34 | S31 | C29 | H29 | 96.7° | 174.5° |
O34 | S31 | C32 | H31 | 58.9° | 174.5° |
O34 | S31 | C32 | H32 | 61.1° | 65.5° |
O34 | S31 | C32 | H33 | 178.9° | 54.5° |
C32 | S31 | C29 | H28 | 94.0° | 60.0° |
C32 | S31 | C29 | H29 | 23.6° | 60.0° |
S31 | C32 | H31 | H32 | 120.0° | 120.0° |
S31 | C32 | H31 | H33 | 120.0° | 120.0° |
S31 | C32 | H32 | H33 | 120.0° | 120.0° |
C21 | C16 | C17 | C15 | 120.9° | 120.0° |
C21 | C16 | C17 | H11 | 117.5° | 120.0° |
C21 | C16 | C15 | H11 | 119.5° | 120.0° |
C21 | C16 | C15 | C12 | 60.9° | 65.0° |
C21 | C16 | C15 | H9 | 60.1° | 175.0° |
C21 | C16 | C15 | H10 | 178.1° | 55.0° |
C21 | C16 | C17 | H12 | 72.9° | 178.7° |
C21 | C16 | C17 | H13 | 169.0° | 58.6° |
C16 | C21 | C20 | H16 | 54.6° | 65.1° |
C16 | C21 | C20 | H17 | 175.1° | 174.4° |
C16 | C21 | H18 | H19 | 119.1° | 120.1° |
C17 | C16 | C15 | H11 | 121.5° | 119.9° |
C17 | C16 | C15 | C12 | 179.9° | 175.0° |
C17 | C16 | C15 | H9 | 58.9° | 55.0° |
C17 | C16 | C15 | H10 | 59.1° | 65.1° |
C16 | C17 | H12 | H13 | 117.1° | 120.0° |
C16 | C17 | C18 | H14 | 164.3° | 65.2° |
C16 | C17 | C18 | H15 | 76.3° | 174.6° |
C17 | C16 | C21 | H18 | 178.4° | 58.6° |
C17 | C16 | C21 | H19 | 62.2° | 178.6° |
C16 | C15 | C12 | H9 | 121.0° | 120.0° |
C16 | C15 | C12 | H10 | 121.0° | 120.0° |
C16 | C15 | C12 | C13 | 98.1° | 90.0° |
C16 | C15 | C12 | C11 | 84.0° | 89.7° |
C16 | C15 | H9 | H10 | 116.8° | 120.0° |
C15 | C16 | C17 | H12 | 48.0° | 58.6° |
C15 | C16 | C17 | H13 | 70.1° | 61.5° |
C15 | C16 | C21 | H18 | 58.4° | 61.4° |
C15 | C16 | C21 | H19 | 61.1° | 58.6° |
C15 | C12 | C13 | C11 | 178.0° | 179.7° |
C15 | C12 | C13 | C14 | 179.1° | 180.0° |
C15 | C12 | C11 | C10 | 179.0° | 179.7° |
C15 | C12 | C11 | H6 | 0.9° | 0.3° |
C15 | C12 | C13 | H7 | 0.9° | 0.3° |
C12 | C15 | H9 | H10 | 116.9° | 120.0° |
C12 | C15 | C16 | H11 | 58.5° | 55.0° |
C12 | C13 | C14 | H7 | 180.0° | 179.7° |
C13 | C12 | C11 | C10 | 1.1° | 0.1° |
C12 | C13 | C14 | C9 | 0.2° | 0.6° |
C13 | C12 | C11 | H6 | 178.9° | 180.0° |
C12 | C13 | C14 | H8 | 179.8° | 180.0° |
C13 | C12 | C15 | H9 | 23.0° | 150.0° |
C13 | C12 | C15 | H10 | 141.0° | 30.0° |
C11 | C12 | C13 | C14 | 1.1° | 0.3° |
C12 | C11 | C10 | H6 | 180.0° | 179.9° |
C12 | C11 | C10 | C9 | 0.2° | 0.0° |
C12 | C11 | C10 | H5 | 179.8° | 180.0° |
C11 | C12 | C13 | H7 | 178.9° | 180.0° |
C11 | C12 | C15 | H9 | 155.0° | 30.3° |
C11 | C12 | C15 | H10 | 37.0° | 150.3° |
C13 | C14 | C9 | H8 | 180.0° | 179.4° |
C13 | C14 | C9 | C10 | 0.7° | 0.6° |
C13 | C14 | C9 | C8 | 179.2° | 179.7° |
C11 | C10 | C9 | C14 | 0.7° | 0.3° |
C11 | C10 | C9 | H5 | 180.0° | 180.0° |
C11 | C10 | C9 | C8 | 179.2° | 180.0° |
C14 | C9 | C10 | C8 | 178.6° | 179.7° |
C14 | C9 | C8 | C7 | 88.8° | 83.0° |
C14 | C9 | C10 | H5 | 179.3° | 179.7° |
C9 | C14 | C13 | H7 | 179.8° | 179.7° |
C10 | C9 | C8 | C7 | 89.7° | 96.8° |
C9 | C10 | C11 | H6 | 179.8° | 180.0° |
C10 | C9 | C14 | H8 | 179.3° | 180.0° |
C9 | C8 | C7 | C4 | 2.1° | 180.0° |
C8 | C9 | C10 | H5 | 0.8° | 0.0° |
C8 | C9 | C14 | H8 | 0.8° | 0.3° |
C8 | C7 | C4 | C3 | 118.2° | 96.8° |
C8 | C7 | C4 | C5 | 60.9° | 83.3° |
C7 | C4 | C3 | C5 | 179.1° | 180.0° |
C7 | C4 | C3 | C2 | 179.5° | 180.0° |
C7 | C4 | C5 | C6 | 179.6° | 180.0° |
C7 | C4 | C3 | H2 | 0.5° | 0.0° |
C7 | C4 | C5 | H3 | 0.4° | 0.0° |
C4 | C3 | C2 | H2 | 180.0° | 180.0° |
C4 | C3 | C2 | C1 | 0.2° | 0.0° |
C3 | C4 | C5 | C6 | 0.5° | 0.0° |
C4 | C3 | C2 | H1 | 179.8° | 180.0° |
C3 | C4 | C5 | H3 | 179.5° | 180.0° |
C2 | C3 | C4 | C5 | 0.4° | 0.0° |
C3 | C2 | C1 | H1 | 180.0° | 180.0° |
C3 | C2 | C1 | C6 | 0.0° | 0.0° |
C3 | C2 | C1 | C22 | 180.0° | 179.7° |
C4 | C5 | C6 | H3 | 180.0° | 180.0° |
C4 | C5 | C6 | C1 | 0.3° | 0.0° |
C5 | C4 | C3 | H2 | 179.6° | 180.0° |
C4 | C5 | C6 | H4 | 179.7° | 179.7° |
C2 | C1 | C6 | C5 | 0.0° | 0.0° |
C2 | C1 | C6 | C22 | 179.9° | 179.7° |
C2 | C1 | C22 | O23 | 148.7° | 89.7° |
C1 | C2 | C3 | H2 | 179.8° | 180.0° |
C2 | C1 | C6 | H4 | 180.0° | 179.7° |
C2 | C1 | C22 | H20 | 28.7° | 30.3° |
C2 | C1 | C22 | H21 | 91.3° | 150.2° |
C5 | C6 | C1 | H4 | 180.0° | 179.7° |
C5 | C6 | C1 | C22 | 179.9° | 179.7° |
C6 | C1 | C22 | O23 | 31.4° | 90.0° |
C6 | C1 | C2 | H1 | 180.0° | 180.0° |
C1 | C6 | C5 | H3 | 179.7° | 180.0° |
C6 | C1 | C22 | H20 | 151.4° | 150.0° |
C6 | C1 | C22 | H21 | 88.6° | 30.0° |
C1 | C22 | O23 | H20 | 120.0° | 120.0° |
C1 | C22 | O23 | H21 | 120.0° | 120.0° |
C22 | C1 | C2 | H1 | 0.1° | 0.3° |
C22 | C1 | C6 | H4 | 0.1° | 0.0° |
C1 | C22 | H20 | H21 | 120.0° | 120.0° |
C1 | C22 | O23 | H22 | 180.0° | 180.0° |
O23 | C22 | H20 | H21 | 120.0° | 120.0° |
H1 | C2 | C3 | H2 | 0.2° | 0.0° |
H3 | C5 | C6 | H4 | 0.3° | 0.3° |
H5 | C10 | C11 | H6 | 0.2° | 0.0° |
H7 | C13 | C14 | H8 | 0.2° | 0.3° |
H9 | C15 | C16 | H11 | 179.5° | 65.0° |
H10 | C15 | C16 | H11 | 62.4° | 175.0° |
H11 | C16 | C17 | H12 | 169.6° | 61.3° |
H11 | C16 | C17 | H13 | 51.5° | 178.6° |
H11 | C16 | C21 | H18 | 61.0° | 178.6° |
H11 | C16 | C21 | H19 | 179.5° | 61.4° |
H12 | C17 | C18 | H14 | 43.3° | 54.8° |
H12 | C17 | C18 | H15 | 162.8° | 65.5° |
H13 | C17 | C18 | H14 | 74.8° | 174.9° |
H13 | C17 | C18 | H15 | 44.7° | 54.7° |
H16 | C20 | C21 | H18 | 65.7° | 174.9° |
H16 | C20 | C21 | H19 | 174.9° | 54.8° |
H17 | C20 | C21 | H18 | 54.8° | 54.5° |
H17 | C20 | C21 | H19 | 64.6° | 65.6° |
H20 | C22 | O23 | H22 | 60.0° | 60.0° |
H21 | C22 | O23 | H22 | 60.0° | 60.0° |
H23 | C25 | C27 | H24 | 113.1° | 60.1° |
H23 | C25 | N28 | H25 | 59.2° | 180.0° |
H23 | C25 | N28 | H26 | 179.2° | 56.0° |
H24 | C27 | C29 | H28 | 165.9° | 179.9° |
H24 | C27 | C29 | H29 | 48.2° | 60.0° |
H24 | C27 | O30 | H30 | 67.4° | 180.0° |
H31 | C32 | H32 | H33 | 120.0° | 120.0° |