2QK
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C23 | N22 | sing | 1.47Å | 1.49Å | |
N22 | C24 | sing | 1.47Å | 1.49Å | |
N22 | C21 | sing | 1.47Å | 1.49Å | |
C24 | C25 | sing | 1.53Å | 1.50Å | |
C25 | C19 | sing | 1.53Å | 1.48Å | |
C21 | C20 | sing | 1.53Å | 1.51Å | |
C20 | C19 | sing | 1.53Å | 1.48Å | |
C19 | O18 | sing | 1.43Å | 1.39Å | |
O18 | C17 | sing | 1.36Å | 1.39Å | |
C17 | C26 | doub | 1.39Å | 1.38Å | Aromatic |
C17 | C16 | sing | 1.39Å | 1.41Å | Aromatic |
C26 | C27 | sing | 1.38Å | 1.41Å | Aromatic |
C16 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
C01 | C02 | sing | 1.53Å | 1.54Å | |
C27 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
C15 | C14 | sing | 1.39Å | 1.38Å | Aromatic |
C14 | C13 | sing | 1.48Å | 1.44Å | |
C02 | C03 | sing | 1.53Å | 1.49Å | |
C03 | N04 | sing | 1.46Å | 1.46Å | |
C03 | C30 | sing | 1.51Å | 1.54Å | |
C13 | C28 | sing | 1.47Å | 1.44Å | Aromatic |
C13 | N12 | doub | 1.31Å | 1.36Å | Aromatic |
N04 | C05 | sing | 1.35Å | 1.44Å | |
C29 | C28 | doub | 1.39Å | 1.43Å | Aromatic |
C29 | C07 | sing | 1.39Å | 1.41Å | Aromatic |
C28 | C10 | sing | 1.41Å | 1.40Å | Aromatic |
N12 | N11 | sing | 1.40Å | 1.39Å | Aromatic |
C30 | C31 | doub | 1.38Å | 1.41Å | Aromatic |
C30 | C35 | sing | 1.38Å | 1.42Å | Aromatic |
C05 | C07 | sing | 1.48Å | 1.53Å | |
C05 | O06 | doub | 1.22Å | 1.22Å | |
C31 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
C07 | C08 | doub | 1.40Å | 1.42Å | Aromatic |
CL | C35 | sing | 1.74Å | 1.74Å | |
C35 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
C10 | N11 | sing | 1.37Å | 1.40Å | Aromatic |
C10 | C09 | doub | 1.39Å | 1.44Å | Aromatic |
C32 | C33 | doub | 1.38Å | 1.39Å | Aromatic |
C08 | C09 | sing | 1.36Å | 1.41Å | Aromatic |
C34 | C33 | sing | 1.38Å | 1.40Å | Aromatic |
C01 | H1 | sing | 1.09Å | 1.10Å | |
C01 | H2 | sing | 1.09Å | 1.10Å | |
C01 | H3 | sing | 1.09Å | 1.10Å | |
C02 | H4 | sing | 1.09Å | 1.10Å | |
C02 | H5 | sing | 1.09Å | 1.10Å | |
C03 | H6 | sing | 1.09Å | 1.10Å | |
N04 | H7 | sing | 0.97Å | 1.00Å | |
C08 | H8 | sing | 1.08Å | 1.08Å | |
C09 | H9 | sing | 1.08Å | 1.08Å | |
N11 | H10 | sing | 0.97Å | 1.00Å | |
C15 | H11 | sing | 1.08Å | 1.08Å | |
C16 | H12 | sing | 1.08Å | 1.08Å | |
C19 | H13 | sing | 1.09Å | 1.10Å | |
C20 | H14 | sing | 1.09Å | 1.10Å | |
C20 | H15 | sing | 1.09Å | 1.10Å | |
C21 | H16 | sing | 1.09Å | 1.10Å | |
C21 | H17 | sing | 1.09Å | 1.10Å | |
C23 | H19 | sing | 1.09Å | 1.10Å | |
C23 | H20 | sing | 1.09Å | 1.10Å | |
C23 | H21 | sing | 1.09Å | 1.10Å | |
C24 | H22 | sing | 1.09Å | 1.10Å | |
C24 | H23 | sing | 1.09Å | 1.10Å | |
C25 | H24 | sing | 1.09Å | 1.10Å | |
C25 | H25 | sing | 1.09Å | 1.10Å | |
C26 | H26 | sing | 1.08Å | 1.08Å | |
C27 | H27 | sing | 1.08Å | 1.08Å | |
C29 | H28 | sing | 1.08Å | 1.08Å | |
C31 | H29 | sing | 1.08Å | 1.08Å | |
C32 | H30 | sing | 1.08Å | 1.08Å | |
C33 | H31 | sing | 1.08Å | 1.08Å | |
C34 | H32 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C23 | N22 | C24 | 123.8° | 111.0° |
C23 | N22 | C21 | 117.1° | 111.0° |
N22 | C23 | H19 | 109.5° | 109.5° |
N22 | C23 | H20 | 109.5° | 109.5° |
N22 | C23 | H21 | 109.5° | 109.5° |
C24 | N22 | C21 | 116.2° | 111.2° |
N22 | C24 | C25 | 110.7° | 109.5° |
N22 | C24 | H22 | 109.2° | 109.5° |
N22 | C24 | H23 | 109.2° | 109.4° |
N22 | C21 | C20 | 116.9° | 109.5° |
N22 | C21 | H16 | 107.5° | 109.5° |
N22 | C21 | H17 | 107.6° | 109.4° |
C24 | C25 | C19 | 109.6° | 109.2° |
C25 | C24 | H22 | 109.2° | 109.4° |
C25 | C24 | H23 | 109.2° | 109.5° |
C24 | C25 | H24 | 109.4° | 109.5° |
C24 | C25 | H25 | 109.5° | 109.5° |
C25 | C19 | C20 | 110.4° | 109.2° |
C25 | C19 | O18 | 108.5° | 109.5° |
C25 | C19 | H13 | 108.7° | 109.5° |
C19 | C25 | H24 | 109.5° | 109.5° |
C19 | C25 | H25 | 109.5° | 109.6° |
C21 | C20 | C19 | 113.1° | 109.3° |
C21 | C20 | H14 | 108.6° | 109.5° |
C21 | C20 | H15 | 108.6° | 109.6° |
C20 | C21 | H16 | 107.6° | 109.4° |
C20 | C21 | H17 | 107.6° | 109.5° |
C20 | C19 | O18 | 110.7° | 109.5° |
C20 | C19 | H13 | 108.6° | 109.6° |
C19 | C20 | H14 | 108.6° | 109.5° |
C19 | C20 | H15 | 108.5° | 109.5° |
C19 | O18 | C17 | 114.1° | 117.0° |
O18 | C19 | H13 | 110.0° | 109.6° |
O18 | C17 | C26 | 120.2° | 119.9° |
O18 | C17 | C16 | 119.4° | 119.9° |
C26 | C17 | C16 | 120.3° | 120.2° |
C17 | C26 | C27 | 119.8° | 120.1° |
C17 | C26 | H26 | 120.1° | 120.0° |
C17 | C16 | C15 | 119.5° | 120.1° |
C17 | C16 | H12 | 120.3° | 119.9° |
C26 | C27 | C14 | 119.9° | 119.9° |
C27 | C26 | H26 | 120.1° | 119.9° |
C26 | C27 | H27 | 120.0° | 120.0° |
C16 | C15 | C14 | 120.2° | 119.9° |
C16 | C15 | H11 | 120.0° | 120.0° |
C15 | C16 | H12 | 120.2° | 120.0° |
C01 | C02 | C03 | 112.1° | 109.5° |
C02 | C01 | H1 | 109.5° | 109.5° |
C02 | C01 | H2 | 109.5° | 109.4° |
C02 | C01 | H3 | 109.5° | 109.4° |
C01 | C02 | H4 | 108.8° | 109.5° |
C01 | C02 | H5 | 108.8° | 109.5° |
C27 | C14 | C15 | 120.2° | 119.8° |
C27 | C14 | C13 | 117.5° | 120.0° |
C14 | C27 | H27 | 120.1° | 120.1° |
C15 | C14 | C13 | 122.3° | 120.1° |
C14 | C15 | H11 | 119.9° | 120.0° |
C14 | C13 | C28 | 128.4° | 126.3° |
C14 | C13 | N12 | 123.2° | 126.2° |
C02 | C03 | N04 | 115.1° | 109.5° |
C02 | C03 | C30 | 121.4° | 109.5° |
C03 | C02 | H4 | 108.8° | 109.5° |
C03 | C02 | H5 | 108.8° | 109.4° |
C02 | C03 | H6 | 102.1° | 109.4° |
N04 | C03 | C30 | 110.8° | 109.5° |
C03 | N04 | C05 | 127.0° | 120.0° |
N04 | C03 | H6 | 102.3° | 109.5° |
C03 | N04 | H7 | 116.5° | 120.0° |
C03 | C30 | C31 | 110.6° | 120.0° |
C03 | C30 | C35 | 130.1° | 120.0° |
C30 | C03 | H6 | 101.7° | 109.5° |
C28 | C13 | N12 | 108.5° | 107.5° |
C13 | C28 | C29 | 133.9° | 133.9° |
C13 | C28 | C10 | 105.6° | 106.3° |
C13 | N12 | N11 | 109.3° | 110.0° |
N04 | C05 | C07 | 118.1° | 120.0° |
N04 | C05 | O06 | 122.9° | 120.0° |
C05 | N04 | H7 | 116.5° | 119.9° |
C28 | C29 | C07 | 118.9° | 119.4° |
C29 | C28 | C10 | 120.4° | 119.9° |
C28 | C29 | H28 | 120.5° | 120.2° |
C29 | C07 | C05 | 120.0° | 119.9° |
C29 | C07 | C08 | 120.8° | 120.2° |
C07 | C29 | H28 | 120.5° | 120.3° |
C28 | C10 | N11 | 109.1° | 106.9° |
C28 | C10 | C09 | 120.4° | 119.7° |
N12 | N11 | C10 | 107.5° | 109.4° |
N12 | N11 | H10 | 126.2° | 125.3° |
C31 | C30 | C35 | 119.3° | 120.0° |
C30 | C31 | C32 | 121.6° | 120.0° |
C30 | C31 | H29 | 119.2° | 120.0° |
C30 | C35 | CL | 126.5° | 120.0° |
C30 | C35 | C34 | 118.6° | 120.0° |
C07 | C05 | O06 | 119.0° | 120.0° |
C05 | C07 | C08 | 119.1° | 119.9° |
C31 | C32 | C33 | 118.7° | 120.0° |
C32 | C31 | H29 | 119.2° | 120.0° |
C31 | C32 | H30 | 120.6° | 120.0° |
C07 | C08 | C09 | 120.2° | 120.6° |
C07 | C08 | H8 | 119.9° | 119.7° |
CL | C35 | C34 | 114.8° | 120.0° |
C35 | C34 | C33 | 120.8° | 120.0° |
C35 | C34 | H32 | 119.6° | 120.0° |
N11 | C10 | C09 | 130.6° | 133.4° |
C10 | N11 | H10 | 126.3° | 125.3° |
C10 | C09 | C08 | 119.2° | 120.2° |
C10 | C09 | H9 | 120.4° | 119.9° |
C32 | C33 | C34 | 121.0° | 120.0° |
C33 | C32 | H30 | 120.6° | 119.9° |
C32 | C33 | H31 | 119.5° | 120.0° |
C09 | C08 | H8 | 119.9° | 119.7° |
C08 | C09 | H9 | 120.4° | 119.9° |
C34 | C33 | H31 | 119.5° | 120.0° |
C33 | C34 | H32 | 119.6° | 119.9° |
H1 | C01 | H2 | 109.5° | 109.5° |
H1 | C01 | H3 | 109.4° | 109.5° |
H2 | C01 | H3 | 109.5° | 109.5° |
H4 | C02 | H5 | 109.5° | 109.4° |
H14 | C20 | H15 | 109.5° | 109.4° |
H16 | C21 | H17 | 109.5° | 109.5° |
H19 | C23 | H20 | 109.5° | 109.5° |
H19 | C23 | H21 | 109.4° | 109.5° |
H20 | C23 | H21 | 109.5° | 109.5° |
H22 | C24 | H23 | 109.5° | 109.4° |
H24 | C25 | H25 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C23 | N22 | C24 | C21 | 160.2° | 124.1° |
C23 | N22 | C24 | C25 | 156.7° | 174.2° |
C23 | N22 | C21 | C20 | 167.0° | 174.2° |
C23 | N22 | C21 | H16 | 45.9° | 65.8° |
C23 | N22 | C21 | H17 | 71.9° | 54.2° |
N22 | C23 | H19 | H20 | 120.0° | 120.0° |
N22 | C23 | H19 | H21 | 120.0° | 120.0° |
N22 | C23 | H20 | H21 | 120.0° | 120.0° |
C23 | N22 | C24 | H22 | 83.2° | 65.8° |
C23 | N22 | C24 | H23 | 36.5° | 54.1° |
N22 | C24 | C25 | H22 | 120.2° | 120.0° |
N22 | C24 | C25 | H23 | 120.2° | 120.0° |
N22 | C24 | C25 | C19 | 60.0° | 59.1° |
C24 | N22 | C21 | C20 | 31.4° | 61.7° |
C24 | N22 | C21 | H16 | 152.5° | 58.3° |
C24 | N22 | C21 | H17 | 89.7° | 178.3° |
C24 | N22 | C23 | H19 | 180.0° | 60.0° |
C24 | N22 | C23 | H20 | 60.0° | 180.0° |
C24 | N22 | C23 | H21 | 60.0° | 60.0° |
N22 | C24 | H22 | H23 | 119.4° | 120.0° |
N22 | C24 | C25 | H24 | 179.9° | 60.8° |
N22 | C24 | C25 | H25 | 60.0° | 179.2° |
C21 | N22 | C24 | C25 | 43.1° | 61.7° |
N22 | C21 | C20 | H16 | 121.1° | 120.0° |
N22 | C21 | C20 | H17 | 121.1° | 120.0° |
N22 | C21 | C20 | C19 | 35.2° | 59.2° |
N22 | C21 | C20 | H14 | 85.4° | 179.1° |
N22 | C21 | C20 | H15 | 155.7° | 60.8° |
N22 | C21 | H16 | H17 | 116.6° | 120.0° |
C21 | N22 | C23 | H19 | 19.9° | 64.2° |
C21 | N22 | C23 | H20 | 139.9° | 55.8° |
C21 | N22 | C23 | H21 | 100.1° | 175.8° |
C21 | N22 | C24 | H22 | 77.1° | 58.3° |
C21 | N22 | C24 | H23 | 163.3° | 178.2° |
C24 | C25 | C19 | H24 | 120.0° | 119.9° |
C24 | C25 | C19 | H25 | 120.0° | 119.9° |
C24 | C25 | C19 | C20 | 65.4° | 57.6° |
C24 | C25 | C19 | O18 | 56.1° | 62.3° |
C24 | C25 | C19 | H13 | 175.6° | 177.6° |
C25 | C24 | H22 | H23 | 119.5° | 120.0° |
C24 | C25 | H24 | H25 | 120.0° | 120.0° |
C25 | C19 | C20 | C21 | 52.0° | 57.7° |
C25 | C19 | C20 | O18 | 120.1° | 119.9° |
C25 | C19 | C20 | H13 | 119.0° | 119.9° |
C25 | C19 | O18 | H13 | 118.7° | 120.1° |
C25 | C19 | O18 | C17 | 170.4° | 84.9° |
C25 | C19 | C20 | H14 | 68.6° | 177.6° |
C25 | C19 | C20 | H15 | 172.5° | 62.4° |
C19 | C25 | C24 | H22 | 60.1° | 60.9° |
C19 | C25 | C24 | H23 | 179.8° | 179.2° |
C19 | C25 | H24 | H25 | 119.9° | 120.2° |
C21 | C20 | C19 | H14 | 120.6° | 120.0° |
C21 | C20 | C19 | H15 | 120.6° | 120.0° |
C21 | C20 | C19 | O18 | 68.2° | 62.2° |
C21 | C20 | C19 | H13 | 171.0° | 177.6° |
C21 | C20 | H14 | H15 | 118.3° | 120.1° |
C20 | C21 | H16 | H17 | 116.6° | 120.0° |
C20 | C19 | O18 | H13 | 120.0° | 120.2° |
C20 | C19 | O18 | C17 | 68.3° | 155.4° |
C19 | C20 | H14 | H15 | 118.3° | 120.0° |
C19 | C20 | C21 | H16 | 156.2° | 60.9° |
C19 | C20 | C21 | H17 | 85.9° | 179.2° |
C20 | C19 | C25 | H24 | 174.6° | 62.3° |
C20 | C19 | C25 | H25 | 54.7° | 177.5° |
C19 | O18 | C17 | C26 | 46.6° | 5.4° |
C19 | O18 | C17 | C16 | 134.7° | 174.9° |
O18 | C19 | C20 | H14 | 171.3° | 57.7° |
O18 | C19 | C20 | H15 | 52.4° | 177.7° |
O18 | C19 | C25 | H24 | 63.9° | 177.8° |
O18 | C19 | C25 | H25 | 176.1° | 57.7° |
O18 | C17 | C26 | C16 | 178.7° | 179.7° |
O18 | C17 | C26 | C27 | 179.9° | 180.0° |
O18 | C17 | C16 | C15 | 179.5° | 179.8° |
O18 | C17 | C16 | H12 | 0.5° | 0.3° |
C17 | O18 | C19 | H13 | 51.7° | 35.3° |
O18 | C17 | C26 | H26 | 0.1° | 0.2° |
C17 | C26 | C27 | H26 | 180.0° | 179.8° |
C26 | C17 | C16 | C15 | 0.8° | 0.0° |
C17 | C26 | C27 | C14 | 0.8° | 0.5° |
C26 | C17 | C16 | H12 | 179.2° | 180.0° |
C17 | C26 | C27 | H27 | 179.2° | 180.0° |
C16 | C17 | C26 | C27 | 1.4° | 0.3° |
C17 | C16 | C15 | H12 | 180.0° | 179.9° |
C17 | C16 | C15 | C14 | 0.5° | 0.0° |
C17 | C16 | C15 | H11 | 179.5° | 179.9° |
C16 | C17 | C26 | H26 | 178.5° | 179.9° |
C26 | C27 | C14 | H27 | 180.0° | 179.5° |
C26 | C27 | C14 | C15 | 0.5° | 0.5° |
C26 | C27 | C14 | C13 | 178.2° | 179.7° |
C16 | C15 | C14 | C27 | 1.1° | 0.3° |
C16 | C15 | C14 | H11 | 180.0° | 179.9° |
C16 | C15 | C14 | C13 | 178.7° | 180.0° |
C01 | C02 | C03 | H4 | 120.4° | 120.0° |
C01 | C02 | C03 | H5 | 120.4° | 120.0° |
C01 | C02 | C03 | N04 | 86.0° | 65.0° |
C01 | C02 | C03 | C30 | 135.9° | 175.0° |
C02 | C01 | H1 | H2 | 120.0° | 120.0° |
C02 | C01 | H1 | H3 | 120.0° | 120.0° |
C02 | C01 | H2 | H3 | 120.0° | 120.0° |
C01 | C02 | H4 | H5 | 118.8° | 120.0° |
C01 | C02 | C03 | H6 | 24.0° | 55.0° |
C27 | C14 | C15 | C13 | 177.6° | 179.7° |
C27 | C14 | C13 | C28 | 153.7° | 35.2° |
C27 | C14 | C13 | N12 | 26.7° | 144.7° |
C27 | C14 | C15 | H11 | 178.9° | 179.8° |
C14 | C27 | C26 | H26 | 179.2° | 179.7° |
C15 | C14 | C13 | C28 | 28.6° | 145.0° |
C15 | C14 | C13 | N12 | 151.0° | 35.0° |
C14 | C15 | C16 | H12 | 179.5° | 180.0° |
C15 | C14 | C27 | H27 | 179.5° | 180.0° |
C14 | C13 | C28 | N12 | 179.7° | 180.0° |
C14 | C13 | C28 | C29 | 0.4° | 0.3° |
C14 | C13 | C28 | C10 | 179.7° | 180.0° |
C14 | C13 | N12 | N11 | 179.7° | 180.0° |
C13 | C14 | C15 | H11 | 1.3° | 0.1° |
C13 | C14 | C27 | H27 | 1.8° | 0.3° |
C02 | C03 | N04 | C30 | 142.5° | 120.0° |
C02 | C03 | N04 | H6 | 109.8° | 120.0° |
C02 | C03 | C30 | H6 | 112.1° | 120.0° |
C02 | C03 | N04 | C05 | 83.4° | 85.0° |
C02 | C03 | C30 | C31 | 150.2° | 95.0° |
C02 | C03 | C30 | C35 | 29.3° | 84.7° |
C03 | C02 | C01 | H1 | 180.0° | 180.0° |
C03 | C02 | C01 | H2 | 60.0° | 60.0° |
C03 | C02 | C01 | H3 | 60.0° | 60.0° |
C03 | C02 | H4 | H5 | 118.8° | 119.9° |
C02 | C03 | N04 | H7 | 96.6° | 95.0° |
N04 | C03 | C30 | H6 | 108.2° | 120.0° |
C03 | N04 | C05 | H7 | 180.0° | 180.0° |
N04 | C03 | C30 | C31 | 70.0° | 25.0° |
N04 | C03 | C30 | C35 | 110.5° | 155.3° |
C03 | N04 | C05 | C07 | 177.0° | 180.0° |
C03 | N04 | C05 | O06 | 2.7° | 0.0° |
N04 | C03 | C02 | H4 | 34.4° | 55.0° |
N04 | C03 | C02 | H5 | 153.6° | 175.0° |
C30 | C03 | N04 | C05 | 59.0° | 155.0° |
C03 | C30 | C31 | C35 | 179.6° | 179.7° |
C03 | C30 | C31 | C32 | 179.2° | 179.9° |
C03 | C30 | C35 | CL | 0.7° | 0.0° |
C03 | C30 | C35 | C34 | 179.5° | 179.6° |
C30 | C03 | C02 | H4 | 103.7° | 65.0° |
C30 | C03 | C02 | H5 | 15.5° | 54.9° |
C30 | C03 | N04 | H7 | 121.0° | 25.0° |
C03 | C30 | C31 | H29 | 0.8° | 0.0° |
C13 | C28 | C29 | C10 | 179.3° | 179.7° |
C13 | C28 | C29 | C07 | 178.6° | 179.8° |
C28 | C13 | N12 | N11 | 0.0° | 0.0° |
C13 | C28 | C10 | N11 | 0.0° | 0.0° |
C13 | C28 | C10 | C09 | 179.9° | 180.0° |
C13 | C28 | C29 | H28 | 1.3° | 0.0° |
N12 | C13 | C28 | C29 | 179.3° | 179.7° |
N12 | C13 | C28 | C10 | 0.1° | 0.0° |
C13 | N12 | N11 | C10 | 0.0° | 0.0° |
C13 | N12 | N11 | H10 | 180.0° | 180.0° |
N04 | C05 | C07 | C29 | 12.2° | 179.7° |
N04 | C05 | C07 | O06 | 179.7° | 180.0° |
N04 | C05 | C07 | C08 | 165.3° | 0.0° |
C05 | N04 | C03 | H6 | 166.8° | 35.0° |
C28 | C29 | C07 | H28 | 180.0° | 179.7° |
C28 | C29 | C07 | C05 | 179.9° | 179.7° |
C28 | C29 | C07 | C08 | 2.6° | 0.6° |
C29 | C28 | C10 | N11 | 179.4° | 179.8° |
C29 | C28 | C10 | C09 | 0.4° | 0.2° |
C07 | C29 | C28 | C10 | 2.1° | 0.5° |
C29 | C07 | C05 | C08 | 177.5° | 179.7° |
C29 | C07 | C05 | O06 | 168.0° | 0.3° |
C29 | C07 | C08 | C09 | 1.5° | 0.3° |
C29 | C07 | C08 | H8 | 178.5° | 179.7° |
C28 | C10 | N11 | N12 | 0.0° | 0.0° |
C28 | C10 | N11 | C09 | 179.8° | 180.0° |
C28 | C10 | C09 | C08 | 0.7° | 0.1° |
C28 | C10 | C09 | H9 | 179.3° | 179.9° |
C28 | C10 | N11 | H10 | 180.0° | 180.0° |
C10 | C28 | C29 | H28 | 177.9° | 179.7° |
N12 | N11 | C10 | H10 | 180.0° | 180.0° |
N12 | N11 | C10 | C09 | 179.8° | 180.0° |
C30 | C31 | C32 | H29 | 180.0° | 179.9° |
C31 | C30 | C35 | CL | 179.8° | 179.7° |
C31 | C30 | C35 | C34 | 0.0° | 0.6° |
C30 | C31 | C32 | C33 | 0.5° | 0.1° |
C31 | C30 | C03 | H6 | 38.2° | 145.0° |
C30 | C31 | C32 | H30 | 179.5° | 180.0° |
C35 | C30 | C31 | C32 | 0.4° | 0.3° |
C30 | C35 | CL | C34 | 179.8° | 179.7° |
C30 | C35 | C34 | C33 | 0.3° | 0.7° |
C35 | C30 | C03 | H6 | 141.4° | 35.2° |
C35 | C30 | C31 | H29 | 179.6° | 179.8° |
C30 | C35 | C34 | H32 | 179.7° | 179.6° |
C05 | C07 | C08 | C09 | 179.0° | 180.0° |
C07 | C05 | N04 | H7 | 3.0° | 0.0° |
C05 | C07 | C08 | H8 | 1.1° | 0.0° |
C05 | C07 | C29 | H28 | 0.1° | 0.0° |
O06 | C05 | C07 | C08 | 14.5° | 180.0° |
O06 | C05 | N04 | H7 | 177.3° | 180.0° |
C31 | C32 | C33 | H30 | 180.0° | 179.9° |
C31 | C32 | C33 | C34 | 0.2° | 0.1° |
C31 | C32 | C33 | H31 | 179.8° | 180.0° |
C07 | C08 | C09 | C10 | 0.2° | 0.0° |
C07 | C08 | C09 | H8 | 180.0° | 180.0° |
C07 | C08 | C09 | H9 | 179.8° | 180.0° |
C08 | C07 | C29 | H28 | 177.4° | 179.7° |
CL | C35 | C34 | C33 | 179.9° | 179.6° |
CL | C35 | C34 | H32 | 0.1° | 0.0° |
C35 | C34 | C33 | C32 | 0.2° | 0.4° |
C35 | C34 | C33 | H32 | 180.0° | 179.7° |
C35 | C34 | C33 | H31 | 179.8° | 179.7° |
N11 | C10 | C09 | C08 | 179.5° | 180.0° |
N11 | C10 | C09 | H9 | 0.5° | 0.0° |
C10 | C09 | C08 | H9 | 180.0° | 180.0° |
C10 | C09 | C08 | H8 | 179.8° | 180.0° |
C09 | C10 | N11 | H10 | 0.1° | 0.0° |
C32 | C33 | C34 | H31 | 180.0° | 179.9° |
C33 | C32 | C31 | H29 | 179.5° | 180.0° |
C32 | C33 | C34 | H32 | 179.8° | 179.9° |
C34 | C33 | C32 | H30 | 179.8° | 180.0° |
H1 | C01 | H2 | H3 | 120.0° | 120.0° |
H1 | C01 | C02 | H4 | 59.6° | 60.0° |
H1 | C01 | C02 | H5 | 59.6° | 60.0° |
H2 | C01 | C02 | H4 | 60.4° | 60.0° |
H2 | C01 | C02 | H5 | 179.6° | 180.0° |
H3 | C01 | C02 | H4 | 179.6° | 180.0° |
H3 | C01 | C02 | H5 | 60.4° | 60.0° |
H4 | C02 | C03 | H6 | 144.4° | 175.0° |
H5 | C02 | C03 | H6 | 96.4° | 65.0° |
H6 | C03 | N04 | H7 | 13.2° | 145.0° |
H8 | C08 | C09 | H9 | 0.2° | 0.0° |
H11 | C15 | C16 | H12 | 0.5° | 0.1° |
H13 | C19 | C20 | H14 | 50.5° | 62.4° |
H13 | C19 | C20 | H15 | 68.4° | 57.6° |
H13 | C19 | C25 | H24 | 55.6° | 57.7° |
H13 | C19 | C25 | H25 | 64.3° | 62.5° |
H14 | C20 | C21 | H16 | 35.7° | 59.1° |
H14 | C20 | C21 | H17 | 153.5° | 60.9° |
H15 | C20 | C21 | H16 | 83.2° | 179.2° |
H15 | C20 | C21 | H17 | 34.6° | 59.2° |
H19 | C23 | H20 | H21 | 120.0° | 120.0° |
H22 | C24 | C25 | H24 | 59.9° | 179.2° |
H22 | C24 | C25 | H25 | 179.8° | 59.1° |
H23 | C24 | C25 | H24 | 59.7° | 59.2° |
H23 | C24 | C25 | H25 | 60.2° | 60.8° |
H26 | C26 | C27 | H27 | 0.8° | 0.2° |
H29 | C31 | C32 | H30 | 0.5° | 0.1° |
H30 | C32 | C33 | H31 | 0.2° | 0.1° |
H31 | C33 | C34 | H32 | 0.2° | 0.0° |