8XM
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C33 | C30 | sing | 1.53Å | 1.53Å | |
C3 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
C3 | C4 | sing | 1.39Å | 1.38Å | Aromatic |
C2 | C1 | sing | 1.40Å | 1.40Å | Aromatic |
C31 | C30 | sing | 1.53Å | 1.53Å | |
C30 | N28 | sing | 1.47Å | 1.47Å | |
C30 | C32 | sing | 1.51Å | 1.55Å | |
O7 | C4 | sing | 1.35Å | 1.38Å | Aromatic |
O7 | C8 | sing | 1.34Å | 1.38Å | Aromatic |
C16 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
C16 | C17 | sing | 1.39Å | 1.37Å | Aromatic |
C15 | C14 | sing | 1.40Å | 1.39Å | Aromatic |
C4 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
O35 | C32 | doub | 1.21Å | 1.23Å | |
N28 | C27 | sing | 1.35Å | 1.35Å | |
O29 | C27 | doub | 1.22Å | 1.23Å | |
C27 | C23 | sing | 1.48Å | 1.50Å | |
C32 | N34 | sing | 1.35Å | 1.38Å | |
C1 | C13 | sing | 1.48Å | 1.49Å | |
C1 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
C22 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
C22 | C23 | sing | 1.39Å | 1.39Å | Aromatic |
F20 | C17 | sing | 1.35Å | 1.36Å | |
C8 | C14 | sing | 1.47Å | 1.47Å | |
C8 | C9 | doub | 1.39Å | 1.36Å | Aromatic |
C17 | C18 | doub | 1.39Å | 1.37Å | Aromatic |
C14 | C19 | doub | 1.40Å | 1.39Å | Aromatic |
C13 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
C23 | C24 | doub | 1.40Å | 1.39Å | Aromatic |
C5 | C6 | sing | 1.39Å | 1.40Å | Aromatic |
C5 | C9 | sing | 1.48Å | 1.47Å | Aromatic |
C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
N34 | C36 | sing | 1.39Å | 1.38Å | |
C24 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
C9 | C10 | sing | 1.47Å | 1.45Å | |
C19 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
S37 | C36 | sing | 1.71Å | 1.73Å | Aromatic |
S37 | C38 | sing | 1.76Å | 1.72Å | Aromatic |
C36 | N40 | doub | 1.30Å | 1.30Å | Aromatic |
C10 | N11 | sing | 1.35Å | 1.33Å | |
C10 | O12 | doub | 1.22Å | 1.23Å | |
N11 | C21 | sing | 1.46Å | 1.45Å | |
N40 | N39 | sing | 1.26Å | 1.39Å | Aromatic |
C38 | N39 | doub | 1.30Å | 1.29Å | Aromatic |
C18 | H47 | sing | 1.08Å | 1.08Å | |
C16 | H46 | sing | 1.08Å | 1.08Å | |
C15 | H45 | sing | 1.08Å | 1.08Å | |
C19 | H48 | sing | 1.08Å | 1.08Å | |
C21 | H50 | sing | 1.09Å | 1.10Å | |
C21 | H49 | sing | 1.09Å | 1.10Å | |
C21 | H51 | sing | 1.09Å | 1.10Å | |
C22 | H52 | sing | 1.08Å | 1.08Å | |
C24 | H53 | sing | 1.08Å | 1.08Å | |
C33 | H62 | sing | 1.09Å | 1.10Å | |
C33 | H60 | sing | 1.09Å | 1.10Å | |
C33 | H61 | sing | 1.09Å | 1.10Å | |
C2 | H41 | sing | 1.08Å | 1.08Å | |
C3 | H42 | sing | 1.08Å | 1.08Å | |
C6 | H43 | sing | 1.08Å | 1.08Å | |
N11 | H44 | sing | 0.97Å | 1.00Å | |
C25 | H54 | sing | 1.08Å | 1.08Å | |
C26 | H55 | sing | 1.08Å | 1.08Å | |
N28 | H56 | sing | 0.97Å | 1.00Å | |
C31 | H58 | sing | 1.09Å | 1.10Å | |
C31 | H57 | sing | 1.09Å | 1.10Å | |
C31 | H59 | sing | 1.09Å | 1.10Å | |
N34 | H63 | sing | 0.97Å | 1.00Å | |
C38 | H64 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C33 | C30 | C31 | 110.6° | 109.5° |
C33 | C30 | N28 | 108.9° | 109.5° |
C33 | C30 | C32 | 110.9° | 109.5° |
C30 | C33 | H62 | 109.5° | 109.5° |
C30 | C33 | H60 | 109.5° | 109.5° |
C30 | C33 | H61 | 109.5° | 109.5° |
C2 | C3 | C4 | 117.4° | 120.2° |
C3 | C2 | C1 | 122.1° | 120.5° |
C3 | C2 | H41 | 119.0° | 119.7° |
C2 | C3 | H42 | 121.3° | 119.9° |
C3 | C4 | O7 | 126.4° | 132.5° |
C3 | C4 | C5 | 122.9° | 119.4° |
C4 | C3 | H42 | 121.3° | 119.9° |
C2 | C1 | C13 | 120.3° | 120.1° |
C2 | C1 | C6 | 118.8° | 119.9° |
C1 | C2 | H41 | 118.9° | 119.7° |
C31 | C30 | N28 | 107.9° | 109.5° |
C31 | C30 | C32 | 106.4° | 109.5° |
C30 | C31 | H58 | 109.5° | 109.5° |
C30 | C31 | H57 | 109.5° | 109.5° |
C30 | C31 | H59 | 109.5° | 109.5° |
N28 | C30 | C32 | 112.1° | 109.5° |
C30 | N28 | C27 | 123.4° | 119.9° |
C30 | N28 | H56 | 118.3° | 120.0° |
C30 | C32 | O35 | 121.2° | 120.0° |
C30 | C32 | N34 | 115.3° | 120.0° |
C4 | O7 | C8 | 106.6° | 111.5° |
O7 | C4 | C5 | 110.6° | 108.1° |
O7 | C8 | C14 | 114.1° | 125.3° |
O7 | C8 | C9 | 111.0° | 109.3° |
C15 | C16 | C17 | 118.2° | 120.1° |
C16 | C15 | C14 | 121.0° | 119.9° |
C15 | C16 | H46 | 120.9° | 119.9° |
C16 | C15 | H45 | 119.5° | 120.1° |
C16 | C17 | F20 | 118.5° | 119.9° |
C16 | C17 | C18 | 123.1° | 120.3° |
C17 | C16 | H46 | 120.9° | 119.9° |
C15 | C14 | C8 | 120.4° | 120.1° |
C15 | C14 | C19 | 118.5° | 119.8° |
C14 | C15 | H45 | 119.5° | 120.0° |
C4 | C5 | C6 | 119.0° | 120.4° |
C4 | C5 | C9 | 105.3° | 105.7° |
O35 | C32 | N34 | 123.4° | 120.0° |
N28 | C27 | O29 | 122.9° | 120.1° |
N28 | C27 | C23 | 116.5° | 119.9° |
C27 | N28 | H56 | 118.3° | 120.1° |
O29 | C27 | C23 | 120.6° | 120.0° |
C27 | C23 | C22 | 116.1° | 120.1° |
C27 | C23 | C24 | 124.1° | 120.1° |
C32 | N34 | C36 | 125.4° | 120.0° |
C32 | N34 | H63 | 117.4° | 120.0° |
C13 | C1 | C6 | 120.4° | 120.0° |
C1 | C13 | C22 | 119.5° | 120.0° |
C1 | C13 | C26 | 122.0° | 120.1° |
C1 | C6 | C5 | 119.7° | 119.5° |
C1 | C6 | H43 | 120.1° | 120.2° |
C13 | C22 | C23 | 121.0° | 119.7° |
C22 | C13 | C26 | 118.5° | 119.9° |
C13 | C22 | H52 | 119.5° | 120.1° |
C22 | C23 | C24 | 119.3° | 119.8° |
C23 | C22 | H52 | 119.5° | 120.1° |
F20 | C17 | C18 | 118.4° | 119.8° |
C14 | C8 | C9 | 134.9° | 125.3° |
C8 | C14 | C19 | 121.0° | 120.1° |
C8 | C9 | C5 | 106.4° | 105.5° |
C8 | C9 | C10 | 128.8° | 127.3° |
C17 | C18 | C19 | 118.2° | 120.1° |
C17 | C18 | H47 | 120.9° | 120.0° |
C14 | C19 | C18 | 120.9° | 119.9° |
C14 | C19 | H48 | 119.5° | 120.1° |
C13 | C26 | C25 | 120.6° | 120.2° |
C13 | C26 | H55 | 119.7° | 119.9° |
C23 | C24 | C25 | 120.1° | 120.1° |
C23 | C24 | H53 | 120.0° | 120.0° |
C6 | C5 | C9 | 135.5° | 133.9° |
C5 | C6 | H43 | 120.1° | 120.3° |
C5 | C9 | C10 | 124.8° | 127.3° |
C26 | C25 | C24 | 120.3° | 120.2° |
C26 | C25 | H54 | 119.9° | 119.9° |
C25 | C26 | H55 | 119.7° | 119.9° |
N34 | C36 | S37 | 124.6° | 125.7° |
N34 | C36 | N40 | 120.8° | 125.7° |
C36 | N34 | H63 | 117.3° | 120.0° |
C25 | C24 | H53 | 120.0° | 119.9° |
C24 | C25 | H54 | 119.8° | 119.8° |
C9 | C10 | N11 | 114.7° | 120.0° |
C9 | C10 | O12 | 121.0° | 120.0° |
C19 | C18 | H47 | 120.9° | 119.9° |
C18 | C19 | H48 | 119.6° | 120.0° |
C36 | S37 | C38 | 86.0° | 89.4° |
S37 | C36 | N40 | 114.6° | 108.7° |
S37 | C38 | N39 | 115.4° | 107.7° |
S37 | C38 | H64 | 122.3° | 126.2° |
C36 | N40 | N39 | 111.7° | 117.7° |
N11 | C10 | O12 | 124.3° | 120.0° |
C10 | N11 | C21 | 122.2° | 120.0° |
C10 | N11 | H44 | 118.9° | 120.0° |
N11 | C21 | H50 | 109.5° | 109.5° |
N11 | C21 | H49 | 109.4° | 109.5° |
N11 | C21 | H51 | 109.5° | 109.5° |
C21 | N11 | H44 | 118.9° | 120.0° |
N40 | N39 | C38 | 112.2° | 116.6° |
N39 | C38 | H64 | 122.3° | 126.1° |
H50 | C21 | H49 | 109.4° | 109.5° |
H50 | C21 | H51 | 109.4° | 109.4° |
H49 | C21 | H51 | 109.5° | 109.5° |
H62 | C33 | H60 | 109.5° | 109.5° |
H62 | C33 | H61 | 109.5° | 109.5° |
H60 | C33 | H61 | 109.5° | 109.4° |
H58 | C31 | H57 | 109.5° | 109.4° |
H58 | C31 | H59 | 109.4° | 109.5° |
H57 | C31 | H59 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C33 | C30 | C31 | N28 | 119.0° | 120.0° |
C33 | C30 | C31 | C32 | 120.5° | 120.0° |
C33 | C30 | N28 | C32 | 123.1° | 120.0° |
C33 | C30 | C32 | O35 | 19.2° | 95.0° |
C33 | C30 | N28 | C27 | 71.9° | 60.0° |
C33 | C30 | C32 | N34 | 164.0° | 85.0° |
C30 | C33 | H62 | H60 | 120.0° | 120.0° |
C30 | C33 | H62 | H61 | 120.0° | 120.0° |
C30 | C33 | H60 | H61 | 120.0° | 120.0° |
C33 | C30 | N28 | H56 | 108.1° | 120.0° |
C33 | C30 | C31 | H58 | 180.0° | 60.0° |
C33 | C30 | C31 | H57 | 60.0° | 180.0° |
C33 | C30 | C31 | H59 | 60.0° | 60.0° |
C2 | C3 | C4 | H42 | 180.0° | 180.0° |
C3 | C2 | C1 | H41 | 180.0° | 180.0° |
C2 | C3 | C4 | O7 | 174.0° | 180.0° |
C2 | C3 | C4 | C5 | 2.0° | 0.0° |
C3 | C2 | C1 | C13 | 170.3° | 180.0° |
C3 | C2 | C1 | C6 | 2.4° | 0.3° |
C4 | C3 | C2 | C1 | 0.2° | 0.0° |
C3 | C4 | O7 | C5 | 176.5° | 180.0° |
C3 | C4 | O7 | C8 | 176.9° | 180.0° |
C3 | C4 | C5 | C6 | 1.2° | 0.2° |
C3 | C4 | C5 | C9 | 177.5° | 180.0° |
C4 | C3 | C2 | H41 | 179.8° | 180.0° |
C2 | C1 | C13 | C6 | 172.5° | 179.7° |
C2 | C1 | C13 | C22 | 53.4° | 0.1° |
C2 | C1 | C13 | C26 | 125.9° | 179.8° |
C2 | C1 | C6 | C5 | 3.2° | 0.5° |
C1 | C2 | C3 | H42 | 179.8° | 179.9° |
C2 | C1 | C6 | H43 | 176.9° | 179.7° |
C31 | C30 | N28 | C32 | 116.8° | 120.0° |
C31 | C30 | C32 | O35 | 101.2° | 25.0° |
C31 | C30 | N28 | C27 | 168.0° | 60.0° |
C31 | C30 | C32 | N34 | 75.7° | 155.0° |
C31 | C30 | C33 | H62 | 180.0° | 180.0° |
C31 | C30 | C33 | H60 | 60.0° | 60.0° |
C31 | C30 | C33 | H61 | 60.0° | 60.0° |
C31 | C30 | N28 | H56 | 12.0° | 120.0° |
C30 | C31 | H58 | H57 | 120.0° | 120.0° |
C30 | C31 | H58 | H59 | 120.0° | 120.0° |
C30 | C31 | H57 | H59 | 120.0° | 120.0° |
N28 | C30 | C32 | O35 | 141.1° | 145.0° |
C30 | N28 | C27 | H56 | 180.0° | 179.9° |
C30 | N28 | C27 | O29 | 6.0° | 0.0° |
C30 | N28 | C27 | C23 | 175.1° | 180.0° |
N28 | C30 | C32 | N34 | 42.0° | 35.0° |
N28 | C30 | C33 | H62 | 61.6° | 60.0° |
N28 | C30 | C33 | H60 | 58.4° | 180.0° |
N28 | C30 | C33 | H61 | 178.4° | 60.1° |
N28 | C30 | C31 | H58 | 60.9° | 179.9° |
N28 | C30 | C31 | H57 | 179.0° | 60.0° |
N28 | C30 | C31 | H59 | 59.0° | 60.0° |
C30 | C32 | O35 | N34 | 176.6° | 180.0° |
C32 | C30 | N28 | C27 | 51.2° | 180.0° |
C30 | C32 | N34 | C36 | 168.7° | 180.0° |
C32 | C30 | C33 | H62 | 62.2° | 60.0° |
C32 | C30 | C33 | H60 | 177.8° | 60.0° |
C32 | C30 | C33 | H61 | 57.8° | 180.0° |
C32 | C30 | N28 | H56 | 128.8° | 0.0° |
C32 | C30 | C31 | H58 | 59.5° | 59.9° |
C32 | C30 | C31 | H57 | 60.6° | 60.0° |
C32 | C30 | C31 | H59 | 179.5° | 180.0° |
C30 | C32 | N34 | H63 | 11.3° | 0.1° |
C4 | O7 | C8 | C14 | 177.3° | 180.0° |
C4 | O7 | C8 | C9 | 0.2° | 0.0° |
O7 | C4 | C5 | C6 | 175.4° | 179.8° |
O7 | C4 | C5 | C9 | 0.9° | 0.0° |
O7 | C4 | C3 | H42 | 6.0° | 0.0° |
O7 | C8 | C14 | C15 | 20.1° | 0.1° |
C8 | O7 | C4 | C5 | 0.4° | 0.0° |
O7 | C8 | C14 | C9 | 176.8° | 180.0° |
O7 | C8 | C14 | C19 | 156.1° | 179.7° |
O7 | C8 | C9 | C5 | 0.8° | 0.0° |
O7 | C8 | C9 | C10 | 179.3° | 180.0° |
C15 | C16 | C17 | H46 | 180.0° | 179.9° |
C16 | C15 | C14 | H45 | 180.0° | 179.9° |
C15 | C16 | C17 | F20 | 177.7° | 180.0° |
C16 | C15 | C14 | C8 | 174.7° | 180.0° |
C15 | C16 | C17 | C18 | 0.8° | 0.1° |
C16 | C15 | C14 | C19 | 1.6° | 0.2° |
C17 | C16 | C15 | C14 | 1.2° | 0.1° |
C16 | C17 | F20 | C18 | 178.6° | 179.9° |
C16 | C17 | C18 | C19 | 2.3° | 0.2° |
C16 | C17 | C18 | H47 | 177.7° | 180.0° |
C17 | C16 | C15 | H45 | 178.8° | 180.0° |
C15 | C14 | C8 | C19 | 176.2° | 179.8° |
C15 | C14 | C8 | C9 | 163.1° | 180.0° |
C15 | C14 | C19 | C18 | 0.0° | 0.5° |
C14 | C15 | C16 | H46 | 178.8° | 180.0° |
C15 | C14 | C19 | H48 | 180.0° | 179.8° |
C4 | C5 | C6 | C1 | 1.4° | 0.4° |
C4 | C5 | C9 | C8 | 1.0° | 0.0° |
C4 | C5 | C6 | C9 | 174.8° | 179.7° |
C4 | C5 | C9 | C10 | 179.0° | 180.0° |
C5 | C4 | C3 | H42 | 178.0° | 180.0° |
C4 | C5 | C6 | H43 | 178.6° | 179.7° |
O35 | C32 | N34 | C36 | 8.1° | 0.0° |
O35 | C32 | N34 | H63 | 171.9° | 180.0° |
N28 | C27 | O29 | C23 | 178.8° | 180.0° |
N28 | C27 | C23 | C22 | 139.5° | 180.0° |
N28 | C27 | C23 | C24 | 33.0° | 0.0° |
O29 | C27 | C23 | C22 | 39.4° | 0.0° |
O29 | C27 | C23 | C24 | 148.1° | 180.0° |
O29 | C27 | N28 | H56 | 174.0° | 180.0° |
C27 | C23 | C22 | C13 | 170.1° | 180.0° |
C27 | C23 | C22 | C24 | 173.0° | 180.0° |
C27 | C23 | C24 | C25 | 168.0° | 180.0° |
C27 | C23 | C22 | H52 | 9.9° | 0.0° |
C27 | C23 | C24 | H53 | 12.0° | 0.1° |
C23 | C27 | N28 | H56 | 4.9° | 0.0° |
C32 | N34 | C36 | H63 | 180.0° | 179.9° |
C32 | N34 | C36 | S37 | 4.1° | 179.7° |
C32 | N34 | C36 | N40 | 177.4° | 0.0° |
C1 | C13 | C22 | C26 | 179.3° | 179.8° |
C1 | C13 | C22 | C23 | 179.9° | 179.7° |
C13 | C1 | C6 | C5 | 169.5° | 179.8° |
C1 | C13 | C26 | C25 | 177.8° | 179.7° |
C1 | C13 | C22 | H52 | 0.1° | 0.2° |
C13 | C1 | C2 | H41 | 9.8° | 0.1° |
C13 | C1 | C6 | H43 | 10.5° | 0.0° |
C1 | C13 | C26 | H55 | 2.2° | 0.2° |
C6 | C1 | C13 | C22 | 119.1° | 179.8° |
C6 | C1 | C13 | C26 | 61.6° | 0.0° |
C1 | C6 | C5 | H43 | 180.0° | 179.8° |
C1 | C6 | C5 | C9 | 173.4° | 179.8° |
C6 | C1 | C2 | H41 | 177.6° | 179.8° |
C13 | C22 | C23 | H52 | 180.0° | 179.9° |
C13 | C22 | C23 | C24 | 2.9° | 0.1° |
C22 | C13 | C26 | C25 | 2.9° | 0.1° |
C22 | C13 | C26 | H55 | 177.1° | 180.0° |
C23 | C22 | C13 | C26 | 0.8° | 0.1° |
C22 | C23 | C24 | C25 | 4.4° | 0.1° |
C22 | C23 | C24 | H53 | 175.6° | 180.0° |
F20 | C17 | C18 | C19 | 176.2° | 179.8° |
F20 | C17 | C18 | H47 | 3.8° | 0.0° |
F20 | C17 | C16 | H46 | 2.3° | 0.0° |
C14 | C8 | C9 | C5 | 176.1° | 180.0° |
C14 | C8 | C9 | C10 | 3.9° | 0.0° |
C8 | C14 | C19 | C18 | 176.3° | 179.8° |
C8 | C14 | C15 | H45 | 5.3° | 0.1° |
C8 | C14 | C19 | H48 | 3.7° | 0.0° |
C9 | C8 | C14 | C19 | 20.7° | 0.2° |
C8 | C9 | C5 | C6 | 174.3° | 179.7° |
C8 | C9 | C5 | C10 | 180.0° | 180.0° |
C8 | C9 | C10 | N11 | 65.3° | 90.0° |
C8 | C9 | C10 | O12 | 115.0° | 90.0° |
C17 | C18 | C19 | C14 | 1.9° | 0.5° |
C17 | C18 | C19 | H47 | 180.0° | 179.8° |
C18 | C17 | C16 | H46 | 179.2° | 180.0° |
C17 | C18 | C19 | H48 | 178.1° | 179.8° |
C14 | C19 | C18 | H48 | 180.0° | 179.8° |
C14 | C19 | C18 | H47 | 178.1° | 179.7° |
C19 | C14 | C15 | H45 | 178.4° | 179.7° |
C13 | C26 | C25 | H55 | 180.0° | 179.9° |
C13 | C26 | C25 | C24 | 1.4° | 0.1° |
C26 | C13 | C22 | H52 | 179.3° | 180.0° |
C13 | C26 | C25 | H54 | 178.6° | 179.9° |
C23 | C24 | C25 | C26 | 2.3° | 0.1° |
C23 | C24 | C25 | H53 | 180.0° | 179.9° |
C24 | C23 | C22 | H52 | 177.1° | 180.0° |
C23 | C24 | C25 | H54 | 177.7° | 179.9° |
C6 | C5 | C9 | C10 | 5.7° | 0.2° |
C5 | C9 | C10 | N11 | 114.7° | 90.0° |
C5 | C9 | C10 | O12 | 65.0° | 90.0° |
C9 | C5 | C6 | H43 | 6.6° | 0.0° |
C26 | C25 | C24 | H54 | 180.0° | 180.0° |
C26 | C25 | C24 | H53 | 177.7° | 180.0° |
N34 | C36 | S37 | N40 | 178.5° | 179.7° |
N34 | C36 | S37 | C38 | 177.2° | 180.0° |
N34 | C36 | N40 | N39 | 177.5° | 179.8° |
C24 | C25 | C26 | H55 | 178.6° | 180.0° |
C9 | C10 | N11 | O12 | 179.7° | 180.0° |
C9 | C10 | N11 | C21 | 166.7° | 180.0° |
C9 | C10 | N11 | H44 | 13.3° | 0.0° |
S37 | C36 | N40 | N39 | 1.1° | 0.5° |
C36 | S37 | C38 | N39 | 1.2° | 0.0° |
S37 | C36 | N34 | H63 | 175.9° | 0.3° |
C36 | S37 | C38 | H64 | 178.8° | 180.0° |
C38 | S37 | C36 | N40 | 1.3° | 0.2° |
S37 | C38 | N39 | N40 | 0.8° | 0.3° |
S37 | C38 | N39 | H64 | 180.0° | 180.0° |
C36 | N40 | N39 | C38 | 0.2° | 0.5° |
N40 | C36 | N34 | H63 | 2.6° | 180.0° |
C10 | N11 | C21 | H44 | 180.0° | 180.0° |
C10 | N11 | C21 | H50 | 180.0° | 180.0° |
C10 | N11 | C21 | H49 | 60.0° | 60.0° |
C10 | N11 | C21 | H51 | 60.0° | 60.0° |
O12 | C10 | N11 | C21 | 13.6° | 0.0° |
O12 | C10 | N11 | H44 | 166.4° | 180.0° |
N11 | C21 | H50 | H49 | 120.0° | 120.0° |
N11 | C21 | H50 | H51 | 120.0° | 120.0° |
N11 | C21 | H49 | H51 | 120.0° | 120.0° |
N40 | N39 | C38 | H64 | 179.1° | 179.8° |
H47 | C18 | C19 | H48 | 1.9° | 0.0° |
H46 | C16 | C15 | H45 | 1.2° | 0.1° |
H50 | C21 | H49 | H51 | 120.0° | 120.0° |
H50 | C21 | N11 | H44 | 0.0° | 0.0° |
H49 | C21 | N11 | H44 | 120.0° | 120.0° |
H51 | C21 | N11 | H44 | 120.0° | 120.0° |
H53 | C24 | C25 | H54 | 2.3° | 0.0° |
H62 | C33 | H60 | H61 | 120.0° | 120.0° |
H41 | C2 | C3 | H42 | 0.2° | 0.0° |
H54 | C25 | C26 | H55 | 1.4° | 0.0° |
H58 | C31 | H57 | H59 | 120.0° | 120.1° |