W4M
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O32 | C31 | sing | 1.43Å | 1.18Å | |
O30 | N29 | sing | 1.46Å | 1.40Å | |
C31 | N29 | sing | 1.47Å | 1.42Å | |
N29 | C03 | sing | 1.47Å | 1.46Å | |
C01 | S02 | sing | 1.81Å | 1.83Å | |
C03 | S02 | sing | 1.81Å | 1.84Å | |
C03 | C04 | sing | 1.53Å | 1.55Å | |
C04 | N05 | sing | 1.47Å | 1.42Å | |
N05 | C13 | sing | 1.37Å | 1.35Å | Aromatic |
N05 | N06 | sing | 1.40Å | 1.34Å | Aromatic |
C12 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
C12 | C11 | sing | 1.36Å | 1.40Å | Aromatic |
C13 | C08 | sing | 1.41Å | 1.39Å | Aromatic |
N06 | N07 | doub | 1.29Å | 1.33Å | Aromatic |
C11 | C10 | doub | 1.40Å | 1.39Å | Aromatic |
N07 | C08 | sing | 1.36Å | 1.36Å | Aromatic |
C08 | C09 | doub | 1.40Å | 1.39Å | Aromatic |
C10 | C09 | sing | 1.39Å | 1.39Å | Aromatic |
C10 | C14 | sing | 1.43Å | 1.48Å | |
C14 | C15 | trip | 1.17Å | 1.15Å | |
C15 | C16 | sing | 1.43Å | 1.49Å | |
C28 | C16 | doub | 1.40Å | 1.37Å | Aromatic |
C28 | C27 | sing | 1.38Å | 1.40Å | Aromatic |
C16 | C17 | sing | 1.40Å | 1.40Å | Aromatic |
C27 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
C17 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
C19 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
C19 | C20 | sing | 1.51Å | 1.56Å | |
C20 | N21 | sing | 1.47Å | 1.31Å | |
C22 | C23 | sing | 1.53Å | 1.55Å | |
C22 | N21 | sing | 1.47Å | 1.41Å | |
C23 | O24 | sing | 1.43Å | 1.39Å | |
N21 | C26 | sing | 1.47Å | 1.41Å | |
C26 | C25 | sing | 1.53Å | 1.53Å | |
O24 | C25 | sing | 1.43Å | 1.39Å | |
C17 | H1 | sing | 1.08Å | 1.08Å | |
C20 | H2 | sing | 1.09Å | 1.10Å | |
C20 | H3 | sing | 1.09Å | 1.10Å | |
C22 | H4 | sing | 1.09Å | 1.10Å | |
C22 | H5 | sing | 1.09Å | 1.10Å | |
C26 | H6 | sing | 1.09Å | 1.10Å | |
C26 | H7 | sing | 1.09Å | 1.10Å | |
C28 | H8 | sing | 1.08Å | 1.08Å | |
C01 | H9 | sing | 1.09Å | 1.10Å | |
C01 | H10 | sing | 1.09Å | 1.10Å | |
C01 | H11 | sing | 1.09Å | 1.10Å | |
C03 | H12 | sing | 1.09Å | 1.10Å | |
C04 | H13 | sing | 1.09Å | 1.10Å | |
C04 | H14 | sing | 1.09Å | 1.10Å | |
C09 | H15 | sing | 1.08Å | 1.08Å | |
C11 | H16 | sing | 1.08Å | 1.08Å | |
C12 | H17 | sing | 1.08Å | 1.08Å | |
C18 | H18 | sing | 1.08Å | 1.08Å | |
C23 | H20 | sing | 1.09Å | 1.10Å | |
C23 | H21 | sing | 1.09Å | 1.10Å | |
C25 | H22 | sing | 1.09Å | 1.10Å | |
C25 | H23 | sing | 1.09Å | 1.10Å | |
C27 | H24 | sing | 1.08Å | 1.08Å | |
O30 | H25 | sing | 0.97Å | 0.95Å | |
C31 | H26 | sing | 1.09Å | 1.10Å | |
C31 | H27 | sing | 1.09Å | 1.10Å | |
O32 | H28 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O32 | C31 | N29 | 114.5° | 109.5° |
O32 | C31 | H26 | 108.2° | 109.5° |
O32 | C31 | H27 | 108.2° | 109.5° |
C31 | O32 | H28 | 109.5° | 114.0° |
O30 | N29 | C31 | 114.0° | 111.0° |
O30 | N29 | C03 | 124.5° | 111.0° |
N29 | O30 | H25 | 109.5° | 114.1° |
C31 | N29 | C03 | 121.4° | 111.0° |
N29 | C31 | H26 | 108.2° | 109.5° |
N29 | C31 | H27 | 108.2° | 109.5° |
N29 | C03 | S02 | 106.1° | 109.5° |
N29 | C03 | C04 | 111.9° | 109.5° |
N29 | C03 | H12 | 108.8° | 109.5° |
C01 | S02 | C03 | 102.8° | 103.0° |
S02 | C01 | H9 | 109.5° | 109.5° |
S02 | C01 | H10 | 109.5° | 109.5° |
S02 | C01 | H11 | 109.5° | 109.5° |
S02 | C03 | C04 | 117.1° | 109.5° |
S02 | C03 | H12 | 104.8° | 109.5° |
C03 | C04 | N05 | 103.6° | 109.5° |
C04 | C03 | H12 | 107.6° | 109.5° |
C03 | C04 | H13 | 110.9° | 109.5° |
C03 | C04 | H14 | 110.9° | 109.5° |
C04 | N05 | C13 | 128.3° | 126.7° |
C04 | N05 | N06 | 122.8° | 126.6° |
N05 | C04 | H13 | 110.9° | 109.4° |
N05 | C04 | H14 | 110.9° | 109.5° |
C13 | N05 | N06 | 108.9° | 106.7° |
N05 | C13 | C12 | 133.3° | 133.7° |
N05 | C13 | C08 | 107.1° | 106.1° |
N05 | N06 | N07 | 108.5° | 109.5° |
C13 | C12 | C11 | 119.7° | 120.2° |
C12 | C13 | C08 | 119.4° | 120.2° |
C13 | C12 | H17 | 120.1° | 119.9° |
C12 | C11 | C10 | 119.6° | 120.4° |
C12 | C11 | H16 | 120.2° | 119.8° |
C11 | C12 | H17 | 120.1° | 119.9° |
C13 | C08 | N07 | 106.1° | 107.6° |
C13 | C08 | C09 | 120.9° | 119.4° |
N06 | N07 | C08 | 109.4° | 110.1° |
C11 | C10 | C09 | 120.9° | 120.2° |
C11 | C10 | C14 | 118.4° | 119.9° |
C10 | C11 | H16 | 120.2° | 119.8° |
N07 | C08 | C09 | 132.9° | 133.0° |
C08 | C09 | C10 | 119.3° | 119.5° |
C08 | C09 | H15 | 120.4° | 120.2° |
C09 | C10 | C14 | 120.6° | 119.9° |
C10 | C09 | H15 | 120.4° | 120.2° |
C10 | C14 | C15 | 175.1° | 180.0° |
C14 | C15 | C16 | 177.0° | 180.0° |
C15 | C16 | C28 | 121.1° | 120.2° |
C15 | C16 | C17 | 117.5° | 120.2° |
C16 | C28 | C27 | 118.6° | 119.9° |
C28 | C16 | C17 | 121.3° | 119.6° |
C16 | C28 | H8 | 120.7° | 120.0° |
C28 | C27 | C19 | 120.9° | 120.1° |
C27 | C28 | H8 | 120.7° | 120.1° |
C28 | C27 | H24 | 119.6° | 119.9° |
C16 | C17 | C18 | 119.3° | 119.9° |
C16 | C17 | H1 | 120.3° | 120.1° |
C27 | C19 | C18 | 119.4° | 120.4° |
C27 | C19 | C20 | 121.5° | 119.8° |
C19 | C27 | H24 | 119.6° | 120.0° |
C17 | C18 | C19 | 120.5° | 120.2° |
C18 | C17 | H1 | 120.3° | 120.1° |
C17 | C18 | H18 | 119.8° | 119.9° |
C18 | C19 | C20 | 119.1° | 119.9° |
C19 | C18 | H18 | 119.8° | 119.9° |
C19 | C20 | N21 | 115.0° | 109.5° |
C19 | C20 | H2 | 108.1° | 109.5° |
C19 | C20 | H3 | 108.1° | 109.5° |
C20 | N21 | C22 | 115.3° | 111.0° |
C20 | N21 | C26 | 110.9° | 111.0° |
N21 | C20 | H2 | 108.1° | 109.4° |
N21 | C20 | H3 | 108.1° | 109.5° |
C23 | C22 | N21 | 114.9° | 109.3° |
C22 | C23 | O24 | 112.8° | 109.2° |
C23 | C22 | H4 | 108.1° | 109.5° |
C23 | C22 | H5 | 108.1° | 109.5° |
C22 | C23 | H20 | 108.6° | 109.5° |
C22 | C23 | H21 | 108.6° | 109.5° |
C22 | N21 | C26 | 111.0° | 110.7° |
N21 | C22 | H4 | 108.1° | 109.5° |
N21 | C22 | H5 | 108.1° | 109.5° |
C23 | O24 | C25 | 113.8° | 113.7° |
O24 | C23 | H20 | 108.6° | 109.5° |
O24 | C23 | H21 | 108.6° | 109.5° |
N21 | C26 | C25 | 114.0° | 109.3° |
N21 | C26 | H6 | 108.3° | 109.5° |
N21 | C26 | H7 | 108.3° | 109.5° |
C26 | C25 | O24 | 113.7° | 109.3° |
C25 | C26 | H6 | 108.3° | 109.5° |
C25 | C26 | H7 | 108.4° | 109.5° |
C26 | C25 | H22 | 108.4° | 109.5° |
C26 | C25 | H23 | 108.4° | 109.5° |
O24 | C25 | H22 | 108.4° | 109.5° |
O24 | C25 | H23 | 108.4° | 109.5° |
H2 | C20 | H3 | 109.5° | 109.5° |
H4 | C22 | H5 | 109.5° | 109.5° |
H6 | C26 | H7 | 109.5° | 109.5° |
H9 | C01 | H10 | 109.4° | 109.5° |
H9 | C01 | H11 | 109.5° | 109.4° |
H10 | C01 | H11 | 109.5° | 109.5° |
H13 | C04 | H14 | 109.5° | 109.5° |
H20 | C23 | H21 | 109.5° | 109.5° |
H22 | C25 | H23 | 109.5° | 109.5° |
H26 | C31 | H27 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O32 | C31 | N29 | O30 | 1.0° | 151.0° |
O32 | C31 | N29 | H26 | 120.7° | 120.0° |
O32 | C31 | N29 | H27 | 120.8° | 120.0° |
O32 | C31 | N29 | C03 | 179.0° | 85.0° |
O32 | C31 | H26 | H27 | 117.7° | 120.0° |
O30 | N29 | C31 | C03 | 178.0° | 124.0° |
O30 | N29 | C03 | S02 | 70.2° | 53.5° |
O30 | N29 | C03 | C04 | 58.7° | 66.4° |
O30 | N29 | C03 | H12 | 177.5° | 173.6° |
O30 | N29 | C31 | H26 | 119.7° | 31.0° |
O30 | N29 | C31 | H27 | 121.8° | 89.0° |
C31 | N29 | C03 | S02 | 112.1° | 70.4° |
C31 | N29 | C03 | C04 | 119.0° | 169.6° |
C31 | N29 | C03 | H12 | 0.3° | 49.6° |
C31 | N29 | O30 | H25 | 180.0° | 56.0° |
N29 | C31 | H26 | H27 | 117.7° | 120.0° |
N29 | C31 | O32 | H28 | 180.0° | 179.9° |
N29 | C03 | S02 | C01 | 65.3° | 106.5° |
N29 | C03 | S02 | C04 | 125.8° | 120.0° |
N29 | C03 | S02 | H12 | 115.1° | 120.0° |
N29 | C03 | C04 | H12 | 119.5° | 120.0° |
N29 | C03 | C04 | N05 | 175.0° | 180.0° |
N29 | C03 | C04 | H13 | 56.0° | 60.0° |
N29 | C03 | C04 | H14 | 65.9° | 60.0° |
C03 | N29 | O30 | H25 | 2.1° | 180.0° |
C03 | N29 | C31 | H26 | 58.3° | 155.0° |
C03 | N29 | C31 | H27 | 60.3° | 35.0° |
C01 | S02 | C03 | C04 | 168.9° | 133.5° |
S02 | C01 | H9 | H10 | 120.0° | 120.0° |
S02 | C01 | H9 | H11 | 120.0° | 119.9° |
S02 | C01 | H10 | H11 | 120.0° | 120.0° |
C01 | S02 | C03 | H12 | 49.8° | 13.5° |
S02 | C03 | C04 | H12 | 117.6° | 120.0° |
S02 | C03 | C04 | N05 | 52.2° | 60.0° |
C03 | S02 | C01 | H9 | 180.0° | 175.0° |
C03 | S02 | C01 | H10 | 60.0° | 65.0° |
C03 | S02 | C01 | H11 | 60.0° | 55.1° |
S02 | C03 | C04 | H13 | 66.9° | 60.0° |
S02 | C03 | C04 | H14 | 171.2° | 180.0° |
C03 | C04 | N05 | H13 | 119.1° | 120.0° |
C03 | C04 | N05 | H14 | 119.0° | 120.0° |
C03 | C04 | N05 | C13 | 108.7° | 90.0° |
C03 | C04 | N05 | N06 | 70.9° | 90.0° |
C03 | C04 | H13 | H14 | 122.7° | 120.0° |
C04 | N05 | C13 | N06 | 179.6° | 180.0° |
C04 | N05 | C13 | C12 | 1.9° | 0.6° |
C04 | N05 | C13 | C08 | 177.3° | 180.0° |
C04 | N05 | N06 | N07 | 178.9° | 180.0° |
N05 | C04 | C03 | H12 | 65.5° | 60.0° |
N05 | C04 | H13 | H14 | 122.7° | 120.0° |
N05 | C13 | C12 | C08 | 175.0° | 179.4° |
N05 | C13 | C12 | C11 | 177.5° | 179.7° |
C13 | N05 | N06 | N07 | 0.7° | 0.0° |
N05 | C13 | C08 | N07 | 2.9° | 0.0° |
N05 | C13 | C08 | C09 | 179.8° | 180.0° |
C13 | N05 | C04 | H13 | 10.3° | 30.0° |
C13 | N05 | C04 | H14 | 132.2° | 150.0° |
N05 | C13 | C12 | H17 | 2.5° | 0.6° |
N06 | N05 | C13 | C12 | 177.7° | 179.4° |
N06 | N05 | C13 | C08 | 2.3° | 0.0° |
N05 | N06 | N07 | C08 | 1.2° | 0.0° |
N06 | N05 | C04 | H13 | 170.1° | 150.0° |
N06 | N05 | C04 | H14 | 48.2° | 30.0° |
C13 | C12 | C11 | H17 | 180.0° | 179.7° |
C13 | C12 | C11 | C10 | 1.5° | 0.1° |
C12 | C13 | C08 | N07 | 179.1° | 179.5° |
C12 | C13 | C08 | C09 | 4.0° | 0.5° |
C13 | C12 | C11 | H16 | 178.5° | 180.0° |
C11 | C12 | C13 | C08 | 2.5° | 0.3° |
C12 | C11 | C10 | H16 | 180.0° | 179.9° |
C12 | C11 | C10 | C09 | 2.0° | 0.1° |
C12 | C11 | C10 | C14 | 179.0° | 179.8° |
C13 | C08 | N07 | N06 | 2.5° | 0.0° |
C13 | C08 | N07 | C09 | 176.3° | 180.0° |
C13 | C08 | C09 | C10 | 4.4° | 0.5° |
C13 | C08 | C09 | H15 | 175.6° | 179.5° |
C08 | C13 | C12 | H17 | 177.5° | 180.0° |
N06 | N07 | C08 | C09 | 178.9° | 180.0° |
C11 | C10 | C09 | C08 | 3.4° | 0.2° |
C11 | C10 | C09 | C14 | 179.0° | 179.7° |
C11 | C10 | C14 | C15 | 13.5° | 150.2° |
C11 | C10 | C09 | H15 | 176.6° | 179.7° |
C10 | C11 | C12 | H17 | 178.5° | 179.8° |
N07 | C08 | C09 | C10 | 179.7° | 179.5° |
N07 | C08 | C09 | H15 | 0.3° | 0.5° |
C08 | C09 | C10 | H15 | 180.0° | 179.9° |
C08 | C09 | C10 | C14 | 177.7° | 180.0° |
C09 | C10 | C14 | C15 | 167.5° | 29.5° |
C09 | C10 | C11 | H16 | 178.1° | 180.0° |
C10 | C14 | C15 | C16 | 72.2° | 178.4° |
C14 | C10 | C09 | H15 | 2.3° | 0.0° |
C14 | C10 | C11 | H16 | 0.9° | 0.3° |
C14 | C15 | C16 | C28 | 84.9° | 28.0° |
C14 | C15 | C16 | C17 | 97.6° | 152.1° |
C15 | C16 | C28 | C17 | 177.4° | 179.9° |
C15 | C16 | C28 | C27 | 177.3° | 179.4° |
C15 | C16 | C17 | C18 | 177.2° | 180.0° |
C15 | C16 | C17 | H1 | 2.8° | 0.2° |
C15 | C16 | C28 | H8 | 2.7° | 0.1° |
C16 | C28 | C27 | H8 | 180.0° | 179.4° |
C16 | C28 | C27 | C19 | 0.5° | 0.9° |
C28 | C16 | C17 | C18 | 0.3° | 0.1° |
C28 | C16 | C17 | H1 | 179.8° | 179.7° |
C16 | C28 | C27 | H24 | 179.5° | 180.0° |
C27 | C28 | C16 | C17 | 0.1° | 0.6° |
C28 | C27 | C19 | H24 | 180.0° | 179.1° |
C28 | C27 | C19 | C18 | 0.9° | 0.6° |
C28 | C27 | C19 | C20 | 179.4° | 179.4° |
C16 | C17 | C18 | H1 | 180.0° | 179.8° |
C16 | C17 | C18 | C19 | 0.1° | 0.2° |
C17 | C16 | C28 | H8 | 179.9° | 180.0° |
C16 | C17 | C18 | H18 | 179.9° | 179.8° |
C27 | C19 | C18 | C17 | 0.7° | 0.1° |
C27 | C19 | C18 | C20 | 178.5° | 180.0° |
C27 | C19 | C20 | N21 | 97.9° | 90.0° |
C27 | C19 | C20 | H2 | 141.2° | 30.0° |
C27 | C19 | C20 | H3 | 22.9° | 150.0° |
C19 | C27 | C28 | H8 | 179.5° | 179.7° |
C27 | C19 | C18 | H18 | 179.3° | 179.9° |
C17 | C18 | C19 | H18 | 180.0° | 180.0° |
C17 | C18 | C19 | C20 | 179.2° | 180.0° |
C18 | C19 | C20 | N21 | 83.6° | 90.0° |
C19 | C18 | C17 | H1 | 179.9° | 180.0° |
C18 | C19 | C20 | H2 | 37.3° | 150.0° |
C18 | C19 | C20 | H3 | 155.6° | 30.0° |
C18 | C19 | C27 | H24 | 179.1° | 179.8° |
C19 | C20 | N21 | H2 | 120.8° | 120.0° |
C19 | C20 | N21 | H3 | 120.8° | 120.0° |
C19 | C20 | N21 | C22 | 54.3° | 170.0° |
C19 | C20 | N21 | C26 | 178.5° | 66.4° |
C19 | C20 | H2 | H3 | 117.5° | 120.0° |
C20 | C19 | C18 | H18 | 0.8° | 0.0° |
C20 | C19 | C27 | H24 | 0.6° | 0.3° |
C20 | N21 | C22 | C23 | 146.0° | 177.6° |
C20 | N21 | C22 | C26 | 127.2° | 123.8° |
C20 | N21 | C26 | C25 | 174.6° | 177.6° |
N21 | C20 | H2 | H3 | 117.4° | 120.0° |
C20 | N21 | C22 | H4 | 93.2° | 62.5° |
C20 | N21 | C22 | H5 | 25.2° | 57.6° |
C20 | N21 | C26 | H6 | 53.9° | 57.7° |
C20 | N21 | C26 | H7 | 64.7° | 62.4° |
C23 | C22 | N21 | H4 | 120.8° | 120.0° |
C23 | C22 | N21 | H5 | 120.8° | 119.9° |
C22 | C23 | O24 | H20 | 120.5° | 119.9° |
C22 | C23 | O24 | H21 | 120.5° | 120.0° |
C23 | C22 | N21 | C26 | 18.8° | 58.6° |
C22 | C23 | O24 | C25 | 53.9° | 58.7° |
C23 | C22 | H4 | H5 | 117.5° | 120.1° |
C22 | C23 | H20 | H21 | 118.5° | 120.1° |
N21 | C22 | C23 | O24 | 36.0° | 56.9° |
C22 | N21 | C26 | C25 | 55.9° | 58.6° |
C22 | N21 | C20 | H2 | 175.1° | 70.0° |
C22 | N21 | C20 | H3 | 66.6° | 50.0° |
N21 | C22 | H4 | H5 | 117.5° | 120.1° |
C22 | N21 | C26 | H6 | 176.5° | 178.5° |
C22 | N21 | C26 | H7 | 64.8° | 61.4° |
N21 | C22 | C23 | H20 | 84.5° | 176.8° |
N21 | C22 | C23 | H21 | 156.4° | 63.1° |
C23 | O24 | C25 | C26 | 17.7° | 58.7° |
O24 | C23 | C22 | H4 | 84.8° | 63.1° |
O24 | C23 | C22 | H5 | 156.7° | 176.8° |
O24 | C23 | H20 | H21 | 118.5° | 120.1° |
C23 | O24 | C25 | H22 | 138.3° | 61.2° |
C23 | O24 | C25 | H23 | 102.9° | 178.6° |
N21 | C26 | C25 | H6 | 120.7° | 119.9° |
N21 | C26 | C25 | H7 | 120.7° | 120.0° |
N21 | C26 | C25 | O24 | 38.9° | 56.8° |
C26 | N21 | C20 | H2 | 57.7° | 53.6° |
C26 | N21 | C20 | H3 | 60.7° | 173.6° |
C26 | N21 | C22 | H4 | 139.6° | 61.4° |
C26 | N21 | C22 | H5 | 102.0° | 178.5° |
N21 | C26 | H6 | H7 | 117.9° | 120.1° |
N21 | C26 | C25 | H22 | 81.7° | 63.1° |
N21 | C26 | C25 | H23 | 159.5° | 176.8° |
C26 | C25 | O24 | H22 | 120.6° | 119.9° |
C26 | C25 | O24 | H23 | 120.6° | 119.9° |
C25 | C26 | H6 | H7 | 118.0° | 120.1° |
C26 | C25 | H22 | H23 | 118.0° | 120.1° |
O24 | C25 | C26 | H6 | 159.6° | 176.7° |
O24 | C25 | C26 | H7 | 81.7° | 63.1° |
C25 | O24 | C23 | H20 | 66.6° | 178.6° |
C25 | O24 | C23 | H21 | 174.4° | 61.3° |
O24 | C25 | H22 | H23 | 118.1° | 120.1° |
H1 | C17 | C18 | H18 | 0.1° | 0.0° |
H4 | C22 | C23 | H20 | 154.7° | 56.8° |
H4 | C22 | C23 | H21 | 35.7° | 176.9° |
H5 | C22 | C23 | H20 | 36.3° | 63.3° |
H5 | C22 | C23 | H21 | 82.8° | 56.8° |
H6 | C26 | C25 | H22 | 39.0° | 56.8° |
H6 | C26 | C25 | H23 | 79.8° | 63.3° |
H7 | C26 | C25 | H22 | 157.6° | 176.9° |
H7 | C26 | C25 | H23 | 38.9° | 56.8° |
H8 | C28 | C27 | H24 | 0.5° | 0.6° |
H9 | C01 | H10 | H11 | 120.0° | 120.0° |
H12 | C03 | C04 | H13 | 175.4° | 180.0° |
H12 | C03 | C04 | H14 | 53.6° | 60.0° |
H16 | C11 | C12 | H17 | 1.5° | 0.3° |
H26 | C31 | O32 | H28 | 59.3° | 60.1° |
H27 | C31 | O32 | H28 | 59.3° | 59.9° |