K06
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C4 | C2 | sing | 1.54Å | 1.53Å | |
C4 | C5 | sing | 1.54Å | 1.56Å | |
C24 | C23 | sing | 1.53Å | 1.54Å | |
O17 | C18 | sing | 1.43Å | 1.43Å | |
O17 | C16 | sing | 1.36Å | 1.36Å | |
C9 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
C9 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
C10 | C11 | sing | 1.39Å | 1.40Å | Aromatic |
C18 | C19 | sing | 1.51Å | 1.52Å | |
O3 | C2 | sing | 1.43Å | 1.43Å | |
C1 | C2 | sing | 1.53Å | 1.53Å | |
C2 | C7 | sing | 1.54Å | 1.54Å | |
C16 | N15 | doub | 1.32Å | 1.33Å | Aromatic |
C16 | C25 | sing | 1.40Å | 1.42Å | Aromatic |
N15 | C14 | sing | 1.33Å | 1.34Å | Aromatic |
O20 | C19 | doub | 1.21Å | 1.22Å | |
C19 | N21 | sing | 1.35Å | 1.39Å | |
C5 | C8 | sing | 1.51Å | 1.53Å | |
C5 | N6 | sing | 1.47Å | 1.47Å | |
C5 | C7 | sing | 1.54Å | 1.56Å | |
C8 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
C11 | C14 | sing | 1.48Å | 1.48Å | |
C11 | C12 | doub | 1.40Å | 1.41Å | Aromatic |
C23 | C22 | sing | 1.53Å | 1.54Å | |
C14 | C27 | doub | 1.40Å | 1.42Å | Aromatic |
N21 | C25 | sing | 1.40Å | 1.44Å | |
N21 | C22 | sing | 1.47Å | 1.49Å | |
C25 | C26 | doub | 1.38Å | 1.41Å | Aromatic |
C27 | C26 | sing | 1.40Å | 1.41Å | Aromatic |
C27 | C28 | sing | 1.48Å | 1.47Å | |
C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
C29 | C28 | doub | 1.39Å | 1.40Å | Aromatic |
C29 | C30 | sing | 1.38Å | 1.38Å | Aromatic |
C28 | C33 | sing | 1.39Å | 1.41Å | Aromatic |
C30 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
C33 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
C31 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H2 | sing | 1.09Å | 1.10Å | |
C1 | H3 | sing | 1.09Å | 1.10Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C4 | H5 | sing | 1.09Å | 1.10Å | |
C7 | H6 | sing | 1.09Å | 1.10Å | |
C7 | H7 | sing | 1.09Å | 1.10Å | |
C12 | H8 | sing | 1.08Å | 1.08Å | |
C18 | H9 | sing | 1.09Å | 1.10Å | |
C18 | H10 | sing | 1.09Å | 1.10Å | |
C23 | H11 | sing | 1.09Å | 1.10Å | |
C23 | H12 | sing | 1.09Å | 1.10Å | |
C24 | H13 | sing | 1.09Å | 1.10Å | |
C24 | H14 | sing | 1.09Å | 1.10Å | |
C24 | H15 | sing | 1.09Å | 1.10Å | |
C30 | H16 | sing | 1.08Å | 1.08Å | |
C31 | H17 | sing | 1.08Å | 1.08Å | |
C32 | H18 | sing | 1.08Å | 1.08Å | |
C33 | H19 | sing | 1.08Å | 1.08Å | |
O3 | H20 | sing | 0.97Å | 0.95Å | |
N6 | H21 | sing | 1.01Å | 1.00Å | |
N6 | H22 | sing | 1.01Å | 1.00Å | |
C9 | H24 | sing | 1.08Å | 1.08Å | |
C10 | H25 | sing | 1.08Å | 1.08Å | |
C13 | H26 | sing | 1.08Å | 1.08Å | |
C22 | H27 | sing | 1.09Å | 1.10Å | |
C22 | H28 | sing | 1.09Å | 1.10Å | |
C26 | H29 | sing | 1.08Å | 1.08Å | |
C29 | H30 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C4 | C5 | 90.6° | 87.1° |
C4 | C2 | O3 | 113.9° | 113.7° |
C4 | C2 | C1 | 112.7° | 113.6° |
C4 | C2 | C7 | 87.0° | 87.1° |
C2 | C4 | H4 | 113.9° | 113.6° |
C2 | C4 | H5 | 114.0° | 113.6° |
C4 | C5 | C8 | 117.5° | 113.6° |
C4 | C5 | N6 | 113.0° | 113.6° |
C4 | C5 | C7 | 85.6° | 87.0° |
C5 | C4 | H4 | 114.0° | 113.6° |
C5 | C4 | H5 | 114.0° | 113.6° |
C24 | C23 | C22 | 112.1° | 109.5° |
C24 | C23 | H11 | 108.8° | 109.5° |
C24 | C23 | H12 | 108.8° | 109.5° |
C23 | C24 | H13 | 109.5° | 109.5° |
C23 | C24 | H14 | 109.5° | 109.4° |
C23 | C24 | H15 | 109.4° | 109.4° |
C18 | O17 | C16 | 121.9° | 116.8° |
O17 | C18 | C19 | 113.0° | 109.7° |
O17 | C18 | H9 | 108.6° | 109.6° |
O17 | C18 | H10 | 108.6° | 109.2° |
O17 | C16 | N15 | 117.9° | 120.3° |
O17 | C16 | C25 | 121.1° | 119.1° |
C10 | C9 | C8 | 121.4° | 120.1° |
C9 | C10 | C11 | 121.1° | 119.9° |
C10 | C9 | H24 | 119.3° | 120.0° |
C9 | C10 | H25 | 119.5° | 120.0° |
C9 | C8 | C5 | 122.7° | 119.9° |
C9 | C8 | C13 | 117.6° | 120.3° |
C8 | C9 | H24 | 119.3° | 119.9° |
C10 | C11 | C14 | 122.1° | 120.2° |
C10 | C11 | C12 | 118.0° | 119.7° |
C11 | C10 | H25 | 119.5° | 120.1° |
C18 | C19 | O20 | 115.1° | 120.2° |
C18 | C19 | N21 | 121.6° | 119.6° |
C19 | C18 | H9 | 108.6° | 109.4° |
C19 | C18 | H10 | 108.6° | 109.4° |
O3 | C2 | C1 | 113.2° | 112.9° |
O3 | C2 | C7 | 113.3° | 113.6° |
C2 | O3 | H20 | 109.5° | 114.0° |
C1 | C2 | C7 | 114.3° | 113.6° |
C2 | C1 | H1 | 109.5° | 109.5° |
C2 | C1 | H2 | 109.4° | 109.5° |
C2 | C1 | H3 | 109.4° | 109.5° |
C2 | C7 | C5 | 90.5° | 87.1° |
C2 | C7 | H6 | 114.0° | 113.6° |
C2 | C7 | H7 | 114.0° | 113.6° |
N15 | C16 | C25 | 121.0° | 120.6° |
C16 | N15 | C14 | 124.2° | 121.7° |
C16 | C25 | N21 | 119.2° | 119.5° |
C16 | C25 | C26 | 116.5° | 119.7° |
N15 | C14 | C11 | 114.6° | 119.6° |
N15 | C14 | C27 | 118.6° | 120.8° |
O20 | C19 | N21 | 123.2° | 120.2° |
C19 | N21 | C25 | 119.1° | 119.0° |
C19 | N21 | C22 | 120.4° | 120.5° |
C8 | C5 | N6 | 112.0° | 112.9° |
C8 | C5 | C7 | 114.3° | 113.6° |
C5 | C8 | C13 | 119.7° | 119.9° |
N6 | C5 | C7 | 111.9° | 113.7° |
C5 | N6 | H21 | 109.5° | 111.0° |
C5 | N6 | H22 | 109.5° | 111.0° |
C5 | C7 | H6 | 114.0° | 113.6° |
C5 | C7 | H7 | 114.0° | 113.6° |
C8 | C13 | C12 | 121.3° | 120.2° |
C8 | C13 | H26 | 119.3° | 120.0° |
C14 | C11 | C12 | 119.8° | 120.1° |
C11 | C14 | C27 | 126.7° | 119.6° |
C11 | C12 | C13 | 120.6° | 119.8° |
C11 | C12 | H8 | 119.7° | 120.1° |
C23 | C22 | N21 | 112.3° | 109.5° |
C22 | C23 | H11 | 108.8° | 109.4° |
C22 | C23 | H12 | 108.8° | 109.5° |
C23 | C22 | H27 | 108.7° | 109.4° |
C23 | C22 | H28 | 108.7° | 109.4° |
C14 | C27 | C26 | 118.8° | 118.9° |
C14 | C27 | C28 | 123.7° | 120.6° |
C25 | N21 | C22 | 120.6° | 120.5° |
N21 | C25 | C26 | 124.3° | 120.8° |
N21 | C22 | H27 | 108.8° | 109.5° |
N21 | C22 | H28 | 108.7° | 109.5° |
C25 | C26 | C27 | 120.9° | 118.3° |
C25 | C26 | H29 | 119.5° | 120.9° |
C26 | C27 | C28 | 117.5° | 120.5° |
C27 | C26 | H29 | 119.6° | 120.9° |
C27 | C28 | C29 | 118.1° | 120.1° |
C27 | C28 | C33 | 121.7° | 120.1° |
C13 | C12 | H8 | 119.7° | 120.1° |
C12 | C13 | H26 | 119.3° | 119.9° |
C28 | C29 | C30 | 120.0° | 119.9° |
C29 | C28 | C33 | 120.2° | 119.7° |
C28 | C29 | H30 | 120.0° | 120.0° |
C29 | C30 | C31 | 119.8° | 120.1° |
C29 | C30 | H16 | 120.1° | 119.9° |
C30 | C29 | H30 | 120.0° | 120.1° |
C28 | C33 | C32 | 118.9° | 119.9° |
C28 | C33 | H19 | 120.6° | 120.1° |
C30 | C31 | C32 | 120.6° | 120.3° |
C31 | C30 | H16 | 120.1° | 119.9° |
C30 | C31 | H17 | 119.7° | 119.8° |
C33 | C32 | C31 | 120.4° | 120.1° |
C33 | C32 | H18 | 119.8° | 119.9° |
C32 | C33 | H19 | 120.6° | 120.1° |
C32 | C31 | H17 | 119.7° | 119.9° |
C31 | C32 | H18 | 119.8° | 119.9° |
H1 | C1 | H2 | 109.5° | 109.4° |
H1 | C1 | H3 | 109.5° | 109.5° |
H2 | C1 | H3 | 109.5° | 109.4° |
H4 | C4 | H5 | 109.5° | 112.9° |
H6 | C7 | H7 | 109.5° | 112.9° |
H9 | C18 | H10 | 109.4° | 109.4° |
H11 | C23 | H12 | 109.5° | 109.4° |
H13 | C24 | H14 | 109.5° | 109.5° |
H13 | C24 | H15 | 109.5° | 109.5° |
H14 | C24 | H15 | 109.5° | 109.5° |
H21 | N6 | H22 | 109.5° | 111.0° |
H27 | C22 | H28 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C4 | C5 | H4 | 116.7° | 114.6° |
C2 | C4 | C5 | H5 | 116.7° | 114.5° |
C4 | C2 | O3 | C1 | 130.4° | 131.3° |
C4 | C2 | O3 | C7 | 97.4° | 97.5° |
C4 | C2 | C1 | C7 | 97.3° | 97.4° |
C2 | C4 | C5 | C8 | 96.5° | 140.0° |
C2 | C4 | C5 | N6 | 130.6° | 89.2° |
C2 | C4 | C5 | C7 | 18.7° | 25.4° |
C4 | C2 | C1 | H1 | 180.0° | 37.4° |
C4 | C2 | C1 | H2 | 60.0° | 82.6° |
C4 | C2 | C1 | H3 | 60.0° | 157.5° |
C2 | C4 | H4 | H5 | 128.9° | 131.2° |
C4 | C2 | C7 | H6 | 97.8° | 139.9° |
C4 | C2 | C7 | H7 | 135.6° | 89.1° |
C4 | C2 | O3 | H20 | 180.0° | 81.0° |
C4 | C5 | C8 | C9 | 29.3° | 29.7° |
C5 | C4 | C2 | O3 | 95.4° | 140.0° |
C5 | C4 | C2 | C1 | 133.9° | 89.1° |
C4 | C5 | C8 | N6 | 133.3° | 131.2° |
C4 | C5 | C8 | C7 | 98.0° | 97.5° |
C4 | C5 | N6 | C7 | 94.6° | 97.5° |
C4 | C5 | C8 | C13 | 150.0° | 150.0° |
C5 | C4 | H4 | H5 | 129.0° | 131.2° |
C4 | C5 | C7 | H6 | 98.0° | 140.0° |
C4 | C5 | C7 | H7 | 135.3° | 89.1° |
C4 | C5 | N6 | H21 | 180.0° | 180.0° |
C4 | C5 | N6 | H22 | 60.0° | 56.1° |
C24 | C23 | C22 | H11 | 120.4° | 120.0° |
C24 | C23 | C22 | H12 | 120.4° | 120.0° |
C24 | C23 | C22 | N21 | 43.8° | 180.0° |
C24 | C23 | H11 | H12 | 118.9° | 120.0° |
C23 | C24 | H13 | H14 | 120.0° | 120.0° |
C23 | C24 | H13 | H15 | 120.0° | 120.0° |
C23 | C24 | H14 | H15 | 120.0° | 120.0° |
C24 | C23 | C22 | H27 | 76.7° | 60.0° |
C24 | C23 | C22 | H28 | 164.2° | 60.0° |
O17 | C18 | C19 | H9 | 120.5° | 120.3° |
O17 | C18 | C19 | H10 | 120.5° | 119.8° |
C18 | O17 | C16 | N15 | 162.6° | 146.9° |
C18 | O17 | C16 | C25 | 18.3° | 32.9° |
O17 | C18 | C19 | O20 | 164.9° | 148.3° |
O17 | C18 | C19 | N21 | 15.3° | 31.7° |
O17 | C18 | H9 | H10 | 118.4° | 119.8° |
C16 | O17 | C18 | C19 | 24.2° | 46.8° |
O17 | C16 | N15 | C25 | 179.1° | 179.8° |
O17 | C16 | N15 | C14 | 178.3° | 179.7° |
O17 | C16 | C25 | N21 | 1.3° | 0.3° |
O17 | C16 | C25 | C26 | 179.7° | 179.7° |
C16 | O17 | C18 | H9 | 96.3° | 73.3° |
C16 | O17 | C18 | H10 | 144.7° | 166.8° |
C10 | C9 | C8 | H24 | 180.0° | 180.0° |
C9 | C10 | C11 | H25 | 180.0° | 180.0° |
C10 | C9 | C8 | C5 | 179.0° | 180.0° |
C10 | C9 | C8 | C13 | 0.2° | 0.3° |
C9 | C10 | C11 | C14 | 177.6° | 180.0° |
C9 | C10 | C11 | C12 | 2.3° | 0.2° |
C8 | C9 | C10 | C11 | 1.2° | 0.0° |
C9 | C8 | C5 | C13 | 179.2° | 179.7° |
C9 | C8 | C5 | N6 | 104.1° | 160.9° |
C9 | C8 | C5 | C7 | 127.3° | 67.8° |
C9 | C8 | C13 | C12 | 0.4° | 0.3° |
C8 | C9 | C10 | H25 | 178.8° | 180.0° |
C9 | C8 | C13 | H26 | 179.6° | 179.8° |
C10 | C11 | C14 | N15 | 52.6° | 144.7° |
C10 | C11 | C14 | C12 | 175.2° | 179.7° |
C10 | C11 | C14 | C27 | 131.6° | 35.3° |
C10 | C11 | C12 | C13 | 2.5° | 0.2° |
C10 | C11 | C12 | H8 | 177.6° | 179.8° |
C11 | C10 | C9 | H24 | 178.8° | 180.0° |
C18 | C19 | O20 | N21 | 179.8° | 180.0° |
C18 | C19 | N21 | C25 | 0.5° | 1.8° |
C18 | C19 | N21 | C22 | 179.8° | 178.4° |
C19 | C18 | H9 | H10 | 118.4° | 119.9° |
O3 | C2 | C1 | C7 | 131.7° | 131.2° |
O3 | C2 | C7 | C5 | 95.9° | 140.1° |
O3 | C2 | C1 | H1 | 49.0° | 168.8° |
O3 | C2 | C1 | H2 | 169.0° | 48.8° |
O3 | C2 | C1 | H3 | 71.0° | 71.2° |
O3 | C2 | C4 | H4 | 21.3° | 25.4° |
O3 | C2 | C4 | H5 | 147.9° | 105.5° |
O3 | C2 | C7 | H6 | 147.4° | 105.4° |
O3 | C2 | C7 | H7 | 20.8° | 25.5° |
C1 | C2 | C7 | C5 | 132.5° | 89.1° |
C2 | C1 | H1 | H2 | 120.0° | 120.0° |
C2 | C1 | H1 | H3 | 120.0° | 120.1° |
C2 | C1 | H2 | H3 | 120.0° | 120.0° |
C1 | C2 | C4 | H4 | 109.4° | 156.3° |
C1 | C2 | C4 | H5 | 17.3° | 25.5° |
C1 | C2 | C7 | H6 | 15.8° | 25.4° |
C1 | C2 | C7 | H7 | 110.8° | 156.4° |
C1 | C2 | O3 | H20 | 49.6° | 50.3° |
C2 | C7 | C5 | C8 | 99.7° | 140.0° |
C2 | C7 | C5 | N6 | 131.6° | 89.1° |
C2 | C7 | C5 | H6 | 116.6° | 114.6° |
C2 | C7 | C5 | H7 | 116.7° | 114.6° |
C7 | C2 | C1 | H1 | 82.7° | 60.0° |
C7 | C2 | C1 | H2 | 37.3° | 180.0° |
C7 | C2 | C1 | H3 | 157.3° | 60.0° |
C7 | C2 | C4 | H4 | 135.5° | 89.2° |
C7 | C2 | C4 | H5 | 97.8° | 140.0° |
C2 | C7 | H6 | H7 | 128.9° | 131.3° |
C7 | C2 | O3 | H20 | 82.6° | 178.5° |
C16 | N15 | C14 | C11 | 178.3° | 180.0° |
C16 | N15 | C14 | C27 | 2.2° | 0.0° |
N15 | C16 | C25 | N21 | 179.5° | 179.9° |
N15 | C16 | C25 | C26 | 0.6° | 0.1° |
C25 | C16 | N15 | C14 | 0.9° | 0.1° |
C16 | C25 | N21 | C19 | 7.1° | 15.6° |
C16 | C25 | N21 | C26 | 178.9° | 180.0° |
C16 | C25 | N21 | C22 | 172.6° | 164.2° |
C16 | C25 | C26 | C27 | 0.6° | 0.0° |
C16 | C25 | C26 | H29 | 179.4° | 180.0° |
N15 | C14 | C11 | C27 | 175.7° | 180.0° |
N15 | C14 | C11 | C12 | 122.5° | 35.1° |
N15 | C14 | C27 | C26 | 2.0° | 0.0° |
N15 | C14 | C27 | C28 | 179.9° | 180.0° |
O20 | C19 | N21 | C25 | 179.7° | 178.1° |
O20 | C19 | N21 | C22 | 0.0° | 1.6° |
O20 | C19 | C18 | H9 | 74.6° | 91.5° |
O20 | C19 | C18 | H10 | 44.3° | 28.5° |
C19 | N21 | C22 | C23 | 108.6° | 90.0° |
C19 | N21 | C25 | C22 | 179.7° | 179.8° |
C19 | N21 | C25 | C26 | 171.8° | 164.4° |
N21 | C19 | C18 | H9 | 105.2° | 88.5° |
N21 | C19 | C18 | H10 | 135.8° | 151.5° |
C19 | N21 | C22 | H27 | 11.8° | 30.0° |
C19 | N21 | C22 | H28 | 131.0° | 150.0° |
C8 | C5 | N6 | C7 | 129.9° | 131.3° |
C5 | C8 | C13 | C12 | 178.9° | 180.0° |
C8 | C5 | C4 | H4 | 20.2° | 25.4° |
C8 | C5 | C4 | H5 | 146.9° | 105.5° |
C8 | C5 | C7 | H6 | 143.7° | 105.4° |
C8 | C5 | C7 | H7 | 17.0° | 25.4° |
C8 | C5 | N6 | H21 | 44.5° | 48.8° |
C8 | C5 | N6 | H22 | 75.5° | 75.1° |
C5 | C8 | C9 | H24 | 1.0° | 0.0° |
C5 | C8 | C13 | H26 | 1.1° | 0.1° |
N6 | C5 | C8 | C13 | 76.7° | 18.8° |
N6 | C5 | C4 | H4 | 112.7° | 156.2° |
N6 | C5 | C4 | H5 | 14.0° | 25.4° |
N6 | C5 | C7 | H6 | 15.0° | 25.5° |
N6 | C5 | C7 | H7 | 111.7° | 156.3° |
C5 | N6 | H21 | H22 | 120.0° | 123.9° |
C7 | C5 | C8 | C13 | 51.9° | 112.5° |
C7 | C5 | C4 | H4 | 135.3° | 89.2° |
C7 | C5 | C4 | H5 | 98.0° | 140.0° |
C5 | C7 | H6 | H7 | 129.0° | 131.2° |
C7 | C5 | N6 | H21 | 85.4° | 82.5° |
C7 | C5 | N6 | H22 | 154.6° | 153.6° |
C8 | C13 | C12 | C11 | 1.5° | 0.0° |
C8 | C13 | C12 | H26 | 180.0° | 179.9° |
C8 | C13 | C12 | H8 | 178.5° | 180.0° |
C13 | C8 | C9 | H24 | 179.8° | 179.7° |
C11 | C14 | C27 | C26 | 177.6° | 179.9° |
C11 | C14 | C27 | C28 | 4.4° | 0.0° |
C14 | C11 | C12 | C13 | 177.8° | 179.9° |
C14 | C11 | C12 | H8 | 2.2° | 0.0° |
C14 | C11 | C10 | H25 | 2.4° | 0.0° |
C12 | C11 | C14 | C27 | 53.2° | 145.0° |
C11 | C12 | C13 | H8 | 180.0° | 180.0° |
C12 | C11 | C10 | H25 | 177.7° | 179.7° |
C11 | C12 | C13 | H26 | 178.5° | 180.0° |
C23 | C22 | N21 | C25 | 71.1° | 90.2° |
C23 | C22 | N21 | H27 | 120.4° | 120.0° |
C23 | C22 | N21 | H28 | 120.4° | 120.0° |
C22 | C23 | H11 | H12 | 118.8° | 120.0° |
C22 | C23 | C24 | H13 | 180.0° | 60.0° |
C22 | C23 | C24 | H14 | 60.0° | 60.0° |
C22 | C23 | C24 | H15 | 60.0° | 180.0° |
C23 | C22 | H27 | H28 | 118.7° | 119.9° |
C14 | C27 | C26 | C25 | 0.6° | 0.1° |
C14 | C27 | C26 | C28 | 178.2° | 179.9° |
C14 | C27 | C28 | C29 | 55.8° | 49.8° |
C14 | C27 | C28 | C33 | 125.5° | 130.0° |
C14 | C27 | C26 | H29 | 179.4° | 180.0° |
N21 | C25 | C26 | C27 | 179.5° | 180.0° |
C25 | N21 | C22 | H27 | 168.5° | 149.8° |
C25 | N21 | C22 | H28 | 49.3° | 29.8° |
N21 | C25 | C26 | H29 | 0.4° | 0.0° |
C22 | N21 | C25 | C26 | 8.5° | 15.8° |
N21 | C22 | C23 | H11 | 164.2° | 60.0° |
N21 | C22 | C23 | H12 | 76.6° | 60.0° |
N21 | C22 | H27 | H28 | 118.7° | 120.1° |
C25 | C26 | C27 | H29 | 180.0° | 180.0° |
C25 | C26 | C27 | C28 | 178.8° | 180.0° |
C26 | C27 | C28 | C29 | 122.3° | 130.3° |
C26 | C27 | C28 | C33 | 56.3° | 50.0° |
C27 | C28 | C29 | C33 | 178.7° | 179.8° |
C27 | C28 | C29 | C30 | 179.2° | 179.7° |
C27 | C28 | C33 | C32 | 179.9° | 180.0° |
C27 | C28 | C33 | H19 | 0.1° | 0.0° |
C28 | C27 | C26 | H29 | 1.2° | 0.0° |
C27 | C28 | C29 | H30 | 0.8° | 0.0° |
C28 | C29 | C30 | H30 | 180.0° | 179.7° |
C28 | C29 | C30 | C31 | 1.7° | 0.5° |
C29 | C28 | C33 | C32 | 1.2° | 0.3° |
C28 | C29 | C30 | H16 | 178.3° | 179.7° |
C29 | C28 | C33 | H19 | 178.8° | 179.8° |
C30 | C29 | C28 | C33 | 2.1° | 0.5° |
C29 | C30 | C31 | H16 | 180.0° | 179.7° |
C29 | C30 | C31 | C32 | 0.6° | 0.3° |
C29 | C30 | C31 | H17 | 179.4° | 179.8° |
C28 | C33 | C32 | H19 | 180.0° | 180.0° |
C28 | C33 | C32 | C31 | 0.1° | 0.0° |
C28 | C33 | C32 | H18 | 179.9° | 180.0° |
C33 | C28 | C29 | H30 | 177.9° | 179.7° |
C30 | C31 | C32 | C33 | 0.3° | 0.0° |
C30 | C31 | C32 | H17 | 180.0° | 179.9° |
C30 | C31 | C32 | H18 | 179.8° | 180.0° |
C31 | C30 | C29 | H30 | 178.3° | 179.7° |
C33 | C32 | C31 | H18 | 180.0° | 180.0° |
C33 | C32 | C31 | H17 | 179.7° | 179.9° |
C32 | C31 | C30 | H16 | 179.4° | 180.0° |
C31 | C32 | C33 | H19 | 179.9° | 180.0° |
H1 | C1 | H2 | H3 | 120.0° | 120.0° |
H8 | C12 | C13 | H26 | 1.5° | 0.0° |
H11 | C23 | C24 | H13 | 59.6° | 60.0° |
H11 | C23 | C24 | H14 | 60.4° | 180.0° |
H11 | C23 | C24 | H15 | 179.6° | 60.0° |
H11 | C23 | C22 | H27 | 43.7° | 180.0° |
H11 | C23 | C22 | H28 | 75.4° | 60.0° |
H12 | C23 | C24 | H13 | 59.6° | 180.0° |
H12 | C23 | C24 | H14 | 179.6° | 60.0° |
H12 | C23 | C24 | H15 | 60.4° | 59.9° |
H12 | C23 | C22 | H27 | 163.0° | 60.1° |
H12 | C23 | C22 | H28 | 43.8° | 180.0° |
H13 | C24 | H14 | H15 | 120.0° | 120.1° |
H16 | C30 | C31 | H17 | 0.6° | 0.1° |
H16 | C30 | C29 | H30 | 1.7° | 0.0° |
H17 | C31 | C32 | H18 | 0.2° | 0.0° |
H18 | C32 | C33 | H19 | 0.1° | 0.0° |
H24 | C9 | C10 | H25 | 1.2° | 0.0° |