P8M
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O43 | S02 | doub | 1.42Å | 1.57Å | |
N01 | S02 | sing | 1.66Å | 1.69Å | |
F42 | C05 | sing | 1.35Å | 1.34Å | |
S02 | O03 | doub | 1.42Å | 1.56Å | |
S02 | C04 | sing | 1.76Å | 1.78Å | |
O19 | C17 | doub | 1.22Å | 1.25Å | |
C05 | C04 | doub | 1.38Å | 1.36Å | Aromatic |
C05 | C06 | sing | 1.38Å | 1.37Å | Aromatic |
O18 | C17 | sing | 1.35Å | 1.25Å | |
C17 | C16 | sing | 1.47Å | 1.52Å | |
C04 | C09 | sing | 1.38Å | 1.37Å | Aromatic |
C06 | C07 | doub | 1.38Å | 1.39Å | Aromatic |
C16 | N15 | sing | 1.33Å | 1.40Å | Aromatic |
C16 | C20 | doub | 1.35Å | 1.32Å | Aromatic |
N15 | C14 | doub | 1.30Å | 1.26Å | Aromatic |
C20 | S21 | sing | 1.71Å | 1.81Å | Aromatic |
C09 | C08 | doub | 1.38Å | 1.38Å | Aromatic |
C14 | N13 | sing | 1.39Å | 1.38Å | |
C14 | S21 | sing | 1.76Å | 1.79Å | Aromatic |
N13 | C12 | sing | 1.36Å | 1.36Å | Aromatic |
N13 | N22 | sing | 1.40Å | 1.38Å | Aromatic |
C07 | C08 | sing | 1.38Å | 1.39Å | Aromatic |
C07 | C10 | sing | 1.51Å | 1.51Å | |
C38 | C12 | sing | 1.51Å | 1.51Å | |
C38 | C39 | sing | 1.53Å | 1.52Å | |
C12 | C11 | doub | 1.35Å | 1.37Å | Aromatic |
N22 | C23 | doub | 1.32Å | 1.31Å | Aromatic |
C23 | C11 | sing | 1.41Å | 1.45Å | Aromatic |
C23 | C24 | sing | 1.48Å | 1.49Å | |
C11 | C10 | sing | 1.51Å | 1.51Å | |
C33 | C32 | sing | 1.54Å | 1.55Å | |
C33 | C29 | sing | 1.54Å | 1.54Å | |
C24 | C25 | doub | 1.39Å | 1.39Å | Aromatic |
C24 | C36 | sing | 1.39Å | 1.39Å | Aromatic |
C40 | C39 | sing | 1.53Å | 1.51Å | |
C40 | C41 | sing | 1.53Å | 1.52Å | |
C25 | C26 | sing | 1.39Å | 1.40Å | Aromatic |
C36 | C35 | doub | 1.38Å | 1.38Å | Aromatic |
C39 | C41 | sing | 1.53Å | 1.52Å | |
C32 | C31 | sing | 1.54Å | 1.56Å | |
C26 | C27 | sing | 1.43Å | 1.42Å | |
C26 | C34 | doub | 1.40Å | 1.38Å | Aromatic |
C35 | C34 | sing | 1.38Å | 1.37Å | Aromatic |
C27 | C28 | trip | 1.17Å | 1.19Å | |
C28 | C29 | sing | 1.47Å | 1.46Å | |
C34 | F37 | sing | 1.35Å | 1.36Å | |
C29 | C30 | sing | 1.55Å | 1.55Å | |
C31 | C30 | sing | 1.55Å | 1.55Å | |
C38 | H1 | sing | 1.09Å | 1.10Å | |
C38 | H2 | sing | 1.09Å | 1.10Å | |
C39 | H3 | sing | 1.09Å | 1.10Å | |
C40 | H4 | sing | 1.09Å | 1.10Å | |
C40 | H5 | sing | 1.09Å | 1.10Å | |
C41 | H6 | sing | 1.09Å | 1.10Å | |
C41 | H7 | sing | 1.09Å | 1.10Å | |
C36 | H8 | sing | 1.08Å | 1.08Å | |
C33 | H9 | sing | 1.09Å | 1.10Å | |
C33 | H10 | sing | 1.09Å | 1.10Å | |
C30 | H11 | sing | 1.09Å | 1.10Å | |
C30 | H12 | sing | 1.09Å | 1.10Å | |
C25 | H13 | sing | 1.08Å | 1.08Å | |
C10 | H14 | sing | 1.09Å | 1.10Å | |
C10 | H15 | sing | 1.09Å | 1.10Å | |
N01 | H16 | sing | 0.97Å | 1.00Å | |
N01 | H17 | sing | 0.97Å | 1.00Å | |
C06 | H18 | sing | 1.08Å | 1.08Å | |
C08 | H19 | sing | 1.08Å | 1.08Å | |
C09 | H20 | sing | 1.08Å | 1.08Å | |
O18 | H21 | sing | 0.97Å | 0.95Å | |
C20 | H22 | sing | 1.08Å | 1.08Å | |
C29 | H23 | sing | 1.09Å | 1.10Å | |
C31 | H24 | sing | 1.09Å | 1.10Å | |
C31 | H25 | sing | 1.09Å | 1.10Å | |
C32 | H26 | sing | 1.09Å | 1.10Å | |
C32 | H27 | sing | 1.09Å | 1.10Å | |
C35 | H28 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O43 | S02 | N01 | 106.0° | 106.4° |
O43 | S02 | O03 | 118.4° | 123.2° |
O43 | S02 | C04 | 112.5° | 106.4° |
N01 | S02 | O03 | 110.4° | 106.4° |
N01 | S02 | C04 | 105.1° | 107.2° |
S02 | N01 | H16 | 109.5° | 120.0° |
S02 | N01 | H17 | 109.5° | 120.1° |
F42 | C05 | C04 | 118.0° | 120.0° |
F42 | C05 | C06 | 120.7° | 120.0° |
O03 | S02 | C04 | 103.8° | 106.4° |
S02 | C04 | C05 | 119.9° | 120.0° |
S02 | C04 | C09 | 119.2° | 120.0° |
O19 | C17 | O18 | 131.8° | 119.9° |
O19 | C17 | C16 | 113.7° | 120.0° |
C04 | C05 | C06 | 121.3° | 120.0° |
C05 | C04 | C09 | 120.8° | 120.0° |
C05 | C06 | C07 | 119.0° | 120.0° |
C05 | C06 | H18 | 120.5° | 120.0° |
O18 | C17 | C16 | 114.5° | 120.0° |
C17 | O18 | H21 | 109.5° | 117.0° |
C17 | C16 | N15 | 121.7° | 122.5° |
C17 | C16 | C20 | 123.4° | 122.5° |
C04 | C09 | C08 | 119.0° | 120.0° |
C04 | C09 | H20 | 120.5° | 120.1° |
C06 | C07 | C08 | 119.8° | 120.1° |
C06 | C07 | C10 | 119.5° | 120.0° |
C07 | C06 | H18 | 120.5° | 120.0° |
N15 | C16 | C20 | 114.9° | 115.0° |
C16 | N15 | C14 | 113.6° | 115.7° |
C16 | C20 | S21 | 110.7° | 109.1° |
C16 | C20 | H22 | 124.6° | 125.4° |
N15 | C14 | N13 | 124.9° | 125.3° |
N15 | C14 | S21 | 114.5° | 109.5° |
C20 | S21 | C14 | 86.2° | 90.7° |
S21 | C20 | H22 | 124.6° | 125.5° |
C09 | C08 | C07 | 120.0° | 120.0° |
C09 | C08 | H19 | 120.0° | 120.0° |
C08 | C09 | H20 | 120.5° | 119.9° |
N13 | C14 | S21 | 120.2° | 125.3° |
C14 | N13 | C12 | 128.7° | 126.0° |
C14 | N13 | N22 | 119.2° | 126.0° |
C12 | N13 | N22 | 111.6° | 108.0° |
N13 | C12 | C38 | 126.1° | 126.1° |
N13 | C12 | C11 | 106.7° | 107.8° |
N13 | N22 | C23 | 105.6° | 108.1° |
C08 | C07 | C10 | 120.7° | 119.9° |
C07 | C08 | H19 | 120.0° | 120.0° |
C07 | C10 | C11 | 114.0° | 109.4° |
C07 | C10 | H14 | 108.3° | 109.5° |
C07 | C10 | H15 | 108.3° | 109.5° |
C12 | C38 | C39 | 114.3° | 109.5° |
C38 | C12 | C11 | 127.1° | 126.1° |
C12 | C38 | H1 | 108.2° | 109.5° |
C12 | C38 | H2 | 108.2° | 109.5° |
C38 | C39 | C40 | 119.9° | 117.5° |
C38 | C39 | C41 | 118.0° | 117.5° |
C39 | C38 | H1 | 108.2° | 109.5° |
C39 | C38 | H2 | 108.2° | 109.5° |
C38 | C39 | H3 | 115.7° | 115.6° |
C12 | C11 | C23 | 105.4° | 107.9° |
C12 | C11 | C10 | 125.2° | 126.0° |
N22 | C23 | C11 | 110.6° | 108.1° |
N22 | C23 | C24 | 117.8° | 125.9° |
C11 | C23 | C24 | 131.6° | 125.9° |
C23 | C11 | C10 | 129.4° | 126.1° |
C23 | C24 | C25 | 121.4° | 120.0° |
C23 | C24 | C36 | 120.3° | 120.1° |
C11 | C10 | H14 | 108.3° | 109.5° |
C11 | C10 | H15 | 108.3° | 109.4° |
C32 | C33 | C29 | 104.8° | 106.6° |
C33 | C32 | C31 | 106.0° | 106.6° |
C32 | C33 | H9 | 110.6° | 110.1° |
C32 | C33 | H10 | 110.6° | 110.1° |
C33 | C32 | H26 | 110.3° | 110.0° |
C33 | C32 | H27 | 110.3° | 110.0° |
C33 | C29 | C28 | 113.0° | 110.5° |
C33 | C29 | C30 | 103.5° | 104.2° |
C29 | C33 | H9 | 110.6° | 110.0° |
C29 | C33 | H10 | 110.6° | 110.0° |
C33 | C29 | H23 | 108.4° | 110.5° |
C25 | C24 | C36 | 118.3° | 119.9° |
C24 | C25 | C26 | 121.1° | 119.8° |
C24 | C25 | H13 | 119.4° | 120.1° |
C24 | C36 | C35 | 121.1° | 120.2° |
C24 | C36 | H8 | 119.5° | 119.8° |
C39 | C40 | C41 | 60.1° | 60.0° |
C40 | C39 | C41 | 60.1° | 60.0° |
C40 | C39 | H3 | 115.9° | 117.6° |
C39 | C40 | H4 | 120.0° | 117.5° |
C39 | C40 | H5 | 120.0° | 117.5° |
C40 | C41 | C39 | 59.8° | 60.0° |
C41 | C40 | H4 | 120.0° | 117.5° |
C41 | C40 | H5 | 120.0° | 117.5° |
C40 | C41 | H6 | 120.0° | 117.5° |
C40 | C41 | H7 | 120.0° | 117.5° |
C25 | C26 | C27 | 121.0° | 120.1° |
C25 | C26 | C34 | 118.4° | 119.8° |
C26 | C25 | H13 | 119.5° | 120.1° |
C36 | C35 | C34 | 119.6° | 120.2° |
C35 | C36 | H8 | 119.4° | 119.9° |
C36 | C35 | H28 | 120.2° | 119.9° |
C41 | C39 | H3 | 115.8° | 117.5° |
C39 | C41 | H6 | 120.0° | 117.5° |
C39 | C41 | H7 | 120.0° | 117.5° |
C32 | C31 | C30 | 106.4° | 104.2° |
C32 | C31 | H24 | 110.3° | 110.5° |
C32 | C31 | H25 | 110.2° | 110.6° |
C31 | C32 | H26 | 110.3° | 110.0° |
C31 | C32 | H27 | 110.4° | 110.0° |
C27 | C26 | C34 | 120.6° | 120.1° |
C26 | C27 | C28 | 179.2° | 180.0° |
C26 | C34 | C35 | 121.6° | 120.1° |
C26 | C34 | F37 | 119.4° | 120.0° |
C35 | C34 | F37 | 119.0° | 119.9° |
C34 | C35 | H28 | 120.2° | 119.9° |
C27 | C28 | C29 | 178.8° | 180.0° |
C28 | C29 | C30 | 113.8° | 110.4° |
C28 | C29 | H23 | 109.5° | 110.4° |
C29 | C30 | C31 | 105.4° | 102.8° |
C29 | C30 | H11 | 110.5° | 110.8° |
C29 | C30 | H12 | 110.5° | 110.8° |
C30 | C29 | H23 | 108.4° | 110.6° |
C31 | C30 | H11 | 110.5° | 110.8° |
C31 | C30 | H12 | 110.5° | 110.9° |
C30 | C31 | H24 | 110.2° | 110.4° |
C30 | C31 | H25 | 110.2° | 110.5° |
H1 | C38 | H2 | 109.5° | 109.4° |
H4 | C40 | H5 | 109.5° | 115.6° |
H6 | C41 | H7 | 109.5° | 115.6° |
H9 | C33 | H10 | 109.5° | 110.1° |
H11 | C30 | H12 | 109.5° | 110.6° |
H14 | C10 | H15 | 109.5° | 109.5° |
H16 | N01 | H17 | 109.4° | 119.9° |
H24 | C31 | H25 | 109.5° | 110.4° |
H26 | C32 | H27 | 109.5° | 110.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O43 | S02 | N01 | O03 | 129.3° | 133.0° |
O43 | S02 | N01 | C04 | 119.3° | 113.5° |
O43 | S02 | O03 | C04 | 125.5° | 123.0° |
O43 | S02 | C04 | C05 | 44.3° | 178.3° |
O43 | S02 | C04 | C09 | 133.1° | 1.5° |
O43 | S02 | N01 | H16 | 180.0° | 23.5° |
O43 | S02 | N01 | H17 | 60.0° | 156.5° |
N01 | S02 | O03 | C04 | 112.2° | 114.1° |
N01 | S02 | C04 | C05 | 70.6° | 64.7° |
N01 | S02 | C04 | C09 | 112.1° | 115.0° |
S02 | N01 | H16 | H17 | 120.0° | 180.0° |
F42 | C05 | C04 | S02 | 2.7° | 0.0° |
F42 | C05 | C04 | C06 | 177.9° | 180.0° |
F42 | C05 | C04 | C09 | 180.0° | 179.7° |
F42 | C05 | C06 | C07 | 179.2° | 180.0° |
F42 | C05 | C06 | H18 | 0.8° | 0.1° |
O03 | S02 | C04 | C05 | 173.4° | 48.8° |
O03 | S02 | C04 | C09 | 3.9° | 131.5° |
O03 | S02 | N01 | H16 | 50.7° | 156.5° |
O03 | S02 | N01 | H17 | 69.3° | 23.5° |
S02 | C04 | C05 | C09 | 177.3° | 179.7° |
S02 | C04 | C05 | C06 | 179.4° | 180.0° |
S02 | C04 | C09 | C08 | 179.0° | 179.7° |
C04 | S02 | N01 | H16 | 60.7° | 90.0° |
C04 | S02 | N01 | H17 | 179.3° | 90.0° |
S02 | C04 | C09 | H20 | 1.0° | 0.0° |
O19 | C17 | O18 | C16 | 178.8° | 179.9° |
O19 | C17 | C16 | N15 | 1.6° | 180.0° |
O19 | C17 | C16 | C20 | 178.6° | 0.1° |
O19 | C17 | O18 | H21 | 0.0° | 0.1° |
C04 | C05 | C06 | C07 | 1.4° | 0.0° |
C05 | C04 | C09 | C08 | 1.7° | 0.5° |
C04 | C05 | C06 | H18 | 178.6° | 179.9° |
C05 | C04 | C09 | H20 | 178.3° | 179.8° |
C06 | C05 | C04 | C09 | 2.1° | 0.3° |
C05 | C06 | C07 | H18 | 180.0° | 179.9° |
C05 | C06 | C07 | C08 | 0.4° | 0.0° |
C05 | C06 | C07 | C10 | 179.7° | 180.0° |
O18 | C17 | C16 | N15 | 179.3° | 0.1° |
O18 | C17 | C16 | C20 | 0.5° | 179.9° |
C17 | C16 | N15 | C20 | 179.8° | 179.9° |
C17 | C16 | N15 | C14 | 178.5° | 180.0° |
C17 | C16 | C20 | S21 | 179.7° | 179.6° |
C16 | C17 | O18 | H21 | 178.8° | 180.0° |
C17 | C16 | C20 | H22 | 0.4° | 0.0° |
C04 | C09 | C08 | H20 | 180.0° | 179.7° |
C04 | C09 | C08 | C07 | 0.7° | 0.5° |
C04 | C09 | C08 | H19 | 179.3° | 179.7° |
C06 | C07 | C08 | C09 | 0.1° | 0.2° |
C06 | C07 | C08 | C10 | 179.9° | 180.0° |
C06 | C07 | C10 | C11 | 37.2° | 80.8° |
C06 | C07 | C10 | H14 | 157.8° | 159.2° |
C06 | C07 | C10 | H15 | 83.5° | 39.1° |
C06 | C07 | C08 | H19 | 179.9° | 180.0° |
N15 | C16 | C20 | S21 | 0.5° | 0.3° |
C16 | N15 | C14 | N13 | 174.9° | 180.0° |
C16 | N15 | C14 | S21 | 2.5° | 0.3° |
N15 | C16 | C20 | H22 | 179.4° | 180.0° |
C20 | C16 | N15 | C14 | 1.3° | 0.0° |
C16 | C20 | S21 | H22 | 180.0° | 179.7° |
C16 | C20 | S21 | C14 | 1.5° | 0.4° |
N15 | C14 | S21 | C20 | 2.3° | 0.4° |
N15 | C14 | N13 | S21 | 172.0° | 179.7° |
N15 | C14 | N13 | C12 | 28.4° | 179.7° |
N15 | C14 | N13 | N22 | 160.2° | 0.3° |
C20 | S21 | C14 | N13 | 175.1° | 179.9° |
C09 | C08 | C07 | H19 | 180.0° | 179.8° |
C09 | C08 | C07 | C10 | 180.0° | 179.8° |
C14 | N13 | C12 | N22 | 171.9° | 180.0° |
C14 | N13 | C12 | C38 | 7.2° | 0.0° |
C14 | N13 | C12 | C11 | 175.4° | 180.0° |
C14 | N13 | N22 | C23 | 176.2° | 179.8° |
S21 | C14 | N13 | C12 | 143.6° | 0.0° |
S21 | C14 | N13 | N22 | 27.8° | 180.0° |
C14 | S21 | C20 | H22 | 178.5° | 179.9° |
N13 | C12 | C38 | C11 | 176.9° | 179.9° |
N13 | C12 | C38 | C39 | 91.0° | 82.3° |
C12 | N13 | N22 | C23 | 3.4° | 0.2° |
N13 | C12 | C11 | C23 | 2.1° | 0.2° |
N13 | C12 | C11 | C10 | 179.7° | 179.9° |
N13 | C12 | C38 | H1 | 148.3° | 37.7° |
N13 | C12 | C38 | H2 | 29.7° | 157.7° |
N22 | N13 | C12 | C38 | 179.1° | 180.0° |
N22 | N13 | C12 | C11 | 3.5° | 0.0° |
N13 | N22 | C23 | C11 | 1.9° | 0.4° |
N13 | N22 | C23 | C24 | 178.4° | 180.0° |
C08 | C07 | C10 | C11 | 142.9° | 99.2° |
C08 | C07 | C10 | H14 | 22.2° | 20.8° |
C08 | C07 | C10 | H15 | 96.4° | 140.9° |
C08 | C07 | C06 | H18 | 179.6° | 179.9° |
C07 | C08 | C09 | H20 | 179.3° | 179.8° |
C07 | C10 | C11 | C12 | 104.9° | 97.8° |
C07 | C10 | C11 | C23 | 77.4° | 82.5° |
C07 | C10 | C11 | H14 | 120.6° | 120.0° |
C07 | C10 | C11 | H15 | 120.7° | 120.0° |
C07 | C10 | H14 | H15 | 117.9° | 120.0° |
C10 | C07 | C06 | H18 | 0.3° | 0.0° |
C10 | C07 | C08 | H19 | 0.0° | 0.0° |
C12 | C38 | C39 | H1 | 120.7° | 120.0° |
C12 | C38 | C39 | H2 | 120.7° | 120.0° |
C38 | C12 | C11 | C23 | 179.5° | 179.8° |
C38 | C12 | C11 | C10 | 2.3° | 0.0° |
C12 | C38 | C39 | C40 | 150.2° | 120.1° |
C12 | C38 | C39 | C41 | 80.5° | 171.4° |
C12 | C38 | H1 | H2 | 117.8° | 120.0° |
C12 | C38 | C39 | H3 | 63.0° | 25.7° |
C39 | C38 | C12 | C11 | 92.1° | 97.7° |
C38 | C39 | C40 | C41 | 107.1° | 107.5° |
C38 | C39 | C40 | H3 | 146.7° | 145.0° |
C38 | C39 | C41 | H3 | 143.4° | 145.0° |
C39 | C38 | H1 | H2 | 117.8° | 120.0° |
C38 | C39 | C40 | H4 | 143.4° | 145.1° |
C38 | C39 | C40 | H5 | 2.4° | 0.0° |
C38 | C39 | C41 | H6 | 140.3° | 0.0° |
C38 | C39 | C41 | H7 | 0.8° | 145.1° |
C12 | C11 | C23 | N22 | 0.1° | 0.3° |
C12 | C11 | C23 | C10 | 178.1° | 179.7° |
C12 | C11 | C23 | C24 | 179.5° | 180.0° |
C11 | C12 | C38 | H1 | 28.6° | 142.3° |
C11 | C12 | C38 | H2 | 147.2° | 22.3° |
C12 | C11 | C10 | H14 | 134.4° | 22.2° |
C12 | C11 | C10 | H15 | 15.8° | 142.2° |
N22 | C23 | C11 | C24 | 179.6° | 179.7° |
N22 | C23 | C11 | C10 | 178.2° | 179.9° |
N22 | C23 | C24 | C25 | 163.9° | 45.9° |
N22 | C23 | C24 | C36 | 15.3° | 134.1° |
C11 | C23 | C24 | C25 | 16.5° | 133.7° |
C11 | C23 | C24 | C36 | 164.2° | 46.3° |
C23 | C11 | C10 | H14 | 43.3° | 157.5° |
C23 | C11 | C10 | H15 | 161.9° | 37.5° |
C24 | C23 | C11 | C10 | 1.4° | 0.3° |
C23 | C24 | C25 | C36 | 179.3° | 180.0° |
C23 | C24 | C25 | C26 | 180.0° | 180.0° |
C23 | C24 | C36 | C35 | 180.0° | 179.9° |
C23 | C24 | C36 | H8 | 0.0° | 0.3° |
C23 | C24 | C25 | H13 | 0.0° | 0.3° |
C11 | C10 | H14 | H15 | 117.9° | 120.0° |
C32 | C33 | C29 | H9 | 119.3° | 119.3° |
C32 | C33 | C29 | H10 | 119.2° | 119.3° |
C33 | C32 | C31 | H26 | 119.4° | 119.3° |
C33 | C32 | C31 | H27 | 119.4° | 119.3° |
C32 | C33 | C29 | C28 | 86.2° | 95.1° |
C32 | C33 | C29 | C30 | 37.3° | 23.6° |
C33 | C32 | C31 | C30 | 4.6° | 23.6° |
C32 | C33 | H9 | H10 | 122.1° | 121.5° |
C32 | C33 | C29 | H23 | 152.2° | 142.4° |
C33 | C32 | C31 | H24 | 114.9° | 95.1° |
C33 | C32 | C31 | H25 | 124.1° | 142.4° |
C33 | C32 | H26 | H27 | 121.6° | 121.4° |
C29 | C33 | C32 | C31 | 26.0° | 0.0° |
C33 | C29 | C28 | C27 | 85.7° | 19.9° |
C33 | C29 | C28 | C30 | 117.6° | 114.8° |
C33 | C29 | C28 | H23 | 121.0° | 122.6° |
C33 | C29 | C30 | H23 | 114.9° | 118.8° |
C33 | C29 | C30 | C31 | 34.4° | 37.9° |
C29 | C33 | H9 | H10 | 122.2° | 121.4° |
C33 | C29 | C30 | H11 | 153.7° | 156.3° |
C33 | C29 | C30 | H12 | 85.0° | 80.5° |
C29 | C33 | C32 | H26 | 145.4° | 119.3° |
C29 | C33 | C32 | H27 | 93.5° | 119.3° |
C24 | C25 | C26 | H13 | 180.0° | 179.7° |
C25 | C24 | C36 | C35 | 0.7° | 0.0° |
C24 | C25 | C26 | C27 | 179.6° | 179.7° |
C24 | C25 | C26 | C34 | 0.4° | 0.3° |
C25 | C24 | C36 | H8 | 179.3° | 179.7° |
C36 | C24 | C25 | C26 | 0.7° | 0.0° |
C24 | C36 | C35 | H8 | 180.0° | 179.7° |
C24 | C36 | C35 | C34 | 0.4° | 0.3° |
C36 | C24 | C25 | H13 | 179.3° | 179.7° |
C24 | C36 | C35 | H28 | 179.6° | 179.7° |
C39 | C40 | C41 | H4 | 109.5° | 107.5° |
C39 | C40 | C41 | H5 | 109.5° | 107.5° |
C40 | C39 | C41 | H3 | 106.3° | 107.5° |
C40 | C39 | C38 | H1 | 89.0° | 119.9° |
C40 | C39 | C38 | H2 | 29.5° | 0.0° |
C39 | C40 | H4 | H5 | 144.7° | 145.7° |
C39 | C40 | C41 | H6 | 109.4° | 107.5° |
C39 | C40 | C41 | H7 | 109.4° | 107.5° |
C41 | C40 | H4 | H5 | 144.7° | 145.6° |
C40 | C41 | H6 | H7 | 144.9° | 145.7° |
C25 | C26 | C27 | C34 | 180.0° | 180.0° |
C25 | C26 | C34 | C35 | 0.0° | 0.6° |
C25 | C26 | C27 | C28 | 160.7° | 53.8° |
C25 | C26 | C34 | F37 | 179.7° | 180.0° |
C36 | C35 | C34 | C26 | 0.1° | 0.6° |
C36 | C35 | C34 | H28 | 180.0° | 180.0° |
C36 | C35 | C34 | F37 | 179.7° | 180.0° |
C41 | C39 | C38 | H1 | 158.8° | 51.4° |
C41 | C39 | C38 | H2 | 40.3° | 68.6° |
C39 | C41 | H6 | H7 | 144.8° | 145.7° |
C32 | C31 | C30 | C29 | 18.4° | 37.9° |
C32 | C31 | C30 | H24 | 119.5° | 118.7° |
C32 | C31 | C30 | H25 | 119.5° | 118.8° |
C31 | C32 | C33 | H9 | 145.3° | 119.3° |
C31 | C32 | C33 | H10 | 93.3° | 119.3° |
C32 | C31 | C30 | H11 | 137.8° | 156.3° |
C32 | C31 | C30 | H12 | 101.0° | 80.5° |
C32 | C31 | H24 | H25 | 121.5° | 122.7° |
C31 | C32 | H26 | H27 | 121.6° | 121.4° |
C27 | C26 | C34 | C35 | 180.0° | 179.4° |
C26 | C27 | C28 | C29 | 39.4° | 146.1° |
C27 | C26 | C34 | F37 | 0.3° | 0.0° |
C27 | C26 | C25 | H13 | 0.4° | 0.0° |
C26 | C34 | C35 | F37 | 179.8° | 179.4° |
C34 | C26 | C27 | C28 | 19.3° | 126.2° |
C34 | C26 | C25 | H13 | 179.6° | 180.0° |
C26 | C34 | C35 | H28 | 179.9° | 179.4° |
C34 | C35 | C36 | H8 | 179.6° | 180.0° |
C27 | C28 | C29 | C30 | 156.7° | 134.7° |
C27 | C28 | C29 | H23 | 35.3° | 102.7° |
C28 | C29 | C30 | H23 | 122.1° | 122.5° |
C28 | C29 | C30 | C31 | 88.6° | 80.8° |
C28 | C29 | C33 | H9 | 33.1° | 145.6° |
C28 | C29 | C33 | H10 | 154.6° | 24.2° |
C28 | C29 | C30 | H11 | 30.7° | 37.6° |
C28 | C29 | C30 | H12 | 152.0° | 160.8° |
F37 | C34 | C35 | H28 | 0.3° | 0.0° |
C29 | C30 | C31 | H11 | 119.4° | 118.4° |
C29 | C30 | C31 | H12 | 119.4° | 118.4° |
C30 | C29 | C33 | H9 | 156.6° | 95.7° |
C30 | C29 | C33 | H10 | 81.9° | 142.9° |
C29 | C30 | H11 | H12 | 121.9° | 123.3° |
C29 | C30 | C31 | H24 | 137.9° | 80.8° |
C29 | C30 | C31 | H25 | 101.1° | 156.7° |
C31 | C30 | H11 | H12 | 121.9° | 123.4° |
C31 | C30 | C29 | H23 | 149.3° | 156.7° |
C30 | C31 | H24 | H25 | 121.4° | 122.6° |
C30 | C31 | C32 | H26 | 124.1° | 95.7° |
C30 | C31 | C32 | H27 | 114.8° | 142.9° |
H1 | C38 | C39 | H3 | 57.7° | 94.3° |
H2 | C38 | C39 | H3 | 176.3° | 145.7° |
H3 | C39 | C40 | H4 | 3.3° | 0.0° |
H3 | C39 | C40 | H5 | 144.3° | 145.0° |
H3 | C39 | C41 | H6 | 3.1° | 145.0° |
H3 | C39 | C41 | H7 | 144.3° | 0.0° |
H4 | C40 | C41 | H6 | 0.1° | 145.0° |
H4 | C40 | C41 | H7 | 141.1° | 0.1° |
H5 | C40 | C41 | H6 | 141.2° | 0.0° |
H5 | C40 | C41 | H7 | 0.0° | 145.0° |
H8 | C36 | C35 | H28 | 0.4° | 0.0° |
H9 | C33 | C29 | H23 | 88.5° | 23.1° |
H9 | C33 | C32 | H26 | 95.3° | 0.0° |
H9 | C33 | C32 | H27 | 25.8° | 121.5° |
H10 | C33 | C29 | H23 | 33.0° | 98.3° |
H10 | C33 | C32 | H26 | 26.2° | 121.4° |
H10 | C33 | C32 | H27 | 147.3° | 0.0° |
H11 | C30 | C29 | H23 | 91.3° | 84.9° |
H11 | C30 | C31 | H24 | 102.7° | 37.6° |
H11 | C30 | C31 | H25 | 18.2° | 84.9° |
H12 | C30 | C29 | H23 | 29.9° | 38.3° |
H12 | C30 | C31 | H24 | 18.5° | 160.9° |
H12 | C30 | C31 | H25 | 139.5° | 38.4° |
H19 | C08 | C09 | H20 | 0.7° | 0.0° |
H24 | C31 | C32 | H26 | 4.6° | 145.7° |
H24 | C31 | C32 | H27 | 125.7° | 24.2° |
H25 | C31 | C32 | H26 | 116.4° | 23.1° |
H25 | C31 | C32 | H27 | 4.7° | 98.3° |