NR7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C31 | C32 | sing | 1.53Å | 1.53Å | |
C31 | C30 | sing | 1.53Å | 1.52Å | |
C32 | N5 | sing | 1.46Å | 1.48Å | |
N7 | C8 | sing | 1.36Å | 1.36Å | Aromatic |
N7 | C6 | sing | 1.35Å | 1.35Å | Aromatic |
C3 | C4 | sing | 1.51Å | 1.50Å | |
C3 | C2 | sing | 1.53Å | 1.55Å | |
C34 | C35 | doub | 1.38Å | 1.39Å | Aromatic |
C34 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
C35 | C36 | sing | 1.38Å | 1.38Å | Aromatic |
C4 | C23 | doub | 1.31Å | 1.33Å | |
C8 | C9 | doub | 1.36Å | 1.37Å | Aromatic |
C33 | C30 | sing | 1.51Å | 1.52Å | |
C33 | C38 | doub | 1.38Å | 1.39Å | Aromatic |
C30 | C28 | sing | 1.53Å | 1.52Å | |
C36 | C37 | doub | 1.38Å | 1.38Å | Aromatic |
N5 | C2 | sing | 1.46Å | 1.47Å | |
N5 | C29 | sing | 1.33Å | 1.36Å | |
C2 | C6 | sing | 1.51Å | 1.49Å | |
C6 | N10 | doub | 1.30Å | 1.32Å | Aromatic |
O27 | C26 | doub | 1.21Å | 1.23Å | |
C38 | C37 | sing | 1.38Å | 1.38Å | Aromatic |
C23 | C24 | sing | 1.49Å | 1.48Å | |
C37 | CL1 | sing | 1.74Å | 1.75Å | |
C24 | C25 | sing | 1.53Å | 1.54Å | |
C9 | N10 | sing | 1.35Å | 1.39Å | Aromatic |
C9 | C11 | sing | 1.48Å | 1.47Å | |
C28 | C29 | sing | 1.50Å | 1.51Å | |
C29 | O39 | doub | 1.21Å | 1.22Å | |
C26 | C25 | sing | 1.51Å | 1.51Å | |
C26 | N22 | sing | 1.36Å | 1.35Å | |
C11 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
C11 | C16 | sing | 1.40Å | 1.41Å | Aromatic |
C12 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
N22 | C16 | sing | 1.39Å | 1.42Å | |
C13 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
C16 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
C15 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
C14 | N17 | sing | 1.40Å | 1.42Å | |
O19 | C18 | doub | 1.22Å | 1.21Å | |
N17 | C18 | sing | 1.35Å | 1.36Å | |
C18 | O20 | sing | 1.35Å | 1.34Å | |
O20 | C21 | sing | 1.45Å | 1.45Å | |
C13 | H47 | sing | 1.08Å | 1.08Å | |
C15 | H48 | sing | 1.08Å | 1.08Å | |
C21 | H50 | sing | 1.09Å | 1.10Å | |
C21 | H51 | sing | 1.09Å | 1.10Å | |
C21 | H52 | sing | 1.09Å | 1.10Å | |
C23 | H54 | sing | 1.08Å | 1.08Å | |
C24 | H56 | sing | 1.09Å | 1.10Å | |
C24 | H55 | sing | 1.09Å | 1.10Å | |
C12 | H46 | sing | 1.08Å | 1.08Å | |
C34 | H66 | sing | 1.08Å | 1.08Å | |
C2 | H40 | sing | 1.09Å | 1.10Å | |
C3 | H41 | sing | 1.09Å | 1.10Å | |
C3 | H42 | sing | 1.09Å | 1.10Å | |
C4 | H43 | sing | 1.08Å | 1.08Å | |
N7 | H44 | sing | 0.97Å | 1.00Å | |
C8 | H45 | sing | 1.08Å | 1.08Å | |
N17 | H49 | sing | 0.97Å | 1.00Å | |
N22 | H53 | sing | 0.97Å | 1.00Å | |
C25 | H58 | sing | 1.09Å | 1.10Å | |
C25 | H57 | sing | 1.09Å | 1.10Å | |
C28 | H59 | sing | 1.09Å | 1.10Å | |
C28 | H60 | sing | 1.09Å | 1.10Å | |
C30 | H61 | sing | 1.09Å | 1.10Å | |
C31 | H62 | sing | 1.09Å | 1.10Å | |
C31 | H63 | sing | 1.09Å | 1.10Å | |
C32 | H65 | sing | 1.09Å | 1.10Å | |
C32 | H64 | sing | 1.09Å | 1.10Å | |
C35 | H67 | sing | 1.08Å | 1.08Å | |
C36 | H68 | sing | 1.08Å | 1.08Å | |
C38 | H69 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C32 | C31 | C30 | 111.0° | 108.7° |
C31 | C32 | N5 | 110.8° | 110.5° |
C32 | C31 | H62 | 109.1° | 109.6° |
C32 | C31 | H63 | 109.1° | 109.6° |
C31 | C32 | H65 | 109.1° | 109.3° |
C31 | C32 | H64 | 109.1° | 109.3° |
C31 | C30 | C33 | 114.8° | 109.7° |
C31 | C30 | C28 | 107.6° | 108.3° |
C31 | C30 | H61 | 107.6° | 109.9° |
C30 | C31 | H62 | 109.1° | 109.7° |
C30 | C31 | H63 | 109.1° | 109.5° |
C32 | N5 | C2 | 116.0° | 117.9° |
C32 | N5 | C29 | 126.1° | 124.1° |
N5 | C32 | H65 | 109.1° | 109.3° |
N5 | C32 | H64 | 109.1° | 109.3° |
C8 | N7 | C6 | 107.5° | 107.4° |
N7 | C8 | C9 | 106.7° | 106.8° |
C8 | N7 | H44 | 126.2° | 126.3° |
N7 | C8 | H45 | 126.7° | 126.6° |
N7 | C6 | C2 | 123.3° | 124.0° |
N7 | C6 | N10 | 111.6° | 108.8° |
C6 | N7 | H44 | 126.3° | 126.3° |
C4 | C3 | C2 | 113.0° | 109.0° |
C3 | C4 | C23 | 126.7° | 119.9° |
C4 | C3 | H41 | 108.6° | 109.6° |
C4 | C3 | H42 | 108.5° | 109.6° |
C3 | C4 | H43 | 116.7° | 120.0° |
C3 | C2 | N5 | 115.5° | 109.2° |
C3 | C2 | C6 | 109.4° | 110.3° |
C3 | C2 | H40 | 105.2° | 109.3° |
C2 | C3 | H41 | 108.6° | 109.6° |
C2 | C3 | H42 | 108.6° | 109.5° |
C35 | C34 | C33 | 120.6° | 120.1° |
C34 | C35 | C36 | 120.5° | 120.0° |
C35 | C34 | H66 | 119.7° | 120.0° |
C34 | C35 | H67 | 119.7° | 120.0° |
C34 | C33 | C30 | 121.3° | 120.0° |
C34 | C33 | C38 | 118.8° | 120.0° |
C33 | C34 | H66 | 119.7° | 120.0° |
C35 | C36 | C37 | 118.7° | 120.0° |
C36 | C35 | H67 | 119.8° | 120.0° |
C35 | C36 | H68 | 120.6° | 119.9° |
C4 | C23 | C24 | 126.1° | 120.2° |
C4 | C23 | H54 | 116.9° | 119.4° |
C23 | C4 | H43 | 116.7° | 120.1° |
C8 | C9 | N10 | 109.0° | 107.4° |
C8 | C9 | C11 | 131.1° | 124.4° |
C9 | C8 | H45 | 126.7° | 126.6° |
C30 | C33 | C38 | 119.7° | 119.9° |
C33 | C30 | C28 | 111.4° | 109.7° |
C33 | C30 | H61 | 107.6° | 109.6° |
C33 | C38 | C37 | 119.8° | 120.0° |
C33 | C38 | H69 | 120.1° | 120.0° |
C30 | C28 | C29 | 115.5° | 109.9° |
C30 | C28 | H59 | 107.9° | 109.4° |
C30 | C28 | H60 | 107.9° | 109.3° |
C28 | C30 | H61 | 107.7° | 109.7° |
C36 | C37 | C38 | 121.6° | 120.0° |
C36 | C37 | CL1 | 119.2° | 120.0° |
C37 | C36 | H68 | 120.7° | 120.0° |
C2 | N5 | C29 | 117.9° | 118.0° |
N5 | C2 | C6 | 113.9° | 109.3° |
N5 | C2 | H40 | 106.1° | 109.3° |
N5 | C29 | C28 | 117.9° | 123.5° |
N5 | C29 | O39 | 121.7° | 118.2° |
C2 | C6 | N10 | 125.0° | 127.2° |
C6 | C2 | H40 | 105.8° | 109.3° |
C6 | N10 | C9 | 105.3° | 109.2° |
O27 | C26 | C25 | 121.7° | 121.4° |
O27 | C26 | N22 | 123.4° | 121.4° |
C38 | C37 | CL1 | 119.1° | 120.0° |
C37 | C38 | H69 | 120.1° | 120.0° |
C23 | C24 | C25 | 113.4° | 109.7° |
C24 | C23 | H54 | 116.9° | 120.4° |
C23 | C24 | H56 | 108.5° | 109.6° |
C23 | C24 | H55 | 108.5° | 109.6° |
C24 | C25 | C26 | 112.3° | 109.9° |
C25 | C24 | H56 | 108.5° | 109.1° |
C25 | C24 | H55 | 108.5° | 109.1° |
C24 | C25 | H58 | 108.8° | 109.4° |
C24 | C25 | H57 | 108.8° | 109.4° |
N10 | C9 | C11 | 119.8° | 127.9° |
C9 | C11 | C12 | 118.8° | 117.5° |
C9 | C11 | C16 | 122.5° | 123.1° |
C28 | C29 | O39 | 120.4° | 118.3° |
C29 | C28 | H59 | 108.0° | 109.4° |
C29 | C28 | H60 | 108.0° | 109.4° |
C25 | C26 | N22 | 115.0° | 117.1° |
C26 | C25 | H58 | 108.8° | 108.6° |
C26 | C25 | H57 | 108.7° | 110.1° |
C26 | N22 | C16 | 126.3° | 121.7° |
C26 | N22 | H53 | 116.8° | 119.2° |
C12 | C11 | C16 | 118.7° | 119.3° |
C11 | C12 | C13 | 121.2° | 120.7° |
C11 | C12 | H46 | 119.4° | 119.6° |
C11 | C16 | N22 | 120.7° | 123.7° |
C11 | C16 | C15 | 119.6° | 119.3° |
C12 | C13 | C14 | 120.2° | 119.9° |
C12 | C13 | H47 | 119.9° | 120.0° |
C13 | C12 | H46 | 119.4° | 119.6° |
N22 | C16 | C15 | 119.7° | 117.0° |
C16 | N22 | H53 | 116.9° | 119.1° |
C13 | C14 | C15 | 119.3° | 119.9° |
C13 | C14 | N17 | 124.9° | 120.0° |
C14 | C13 | H47 | 119.9° | 120.1° |
C16 | C15 | C14 | 121.0° | 120.7° |
C16 | C15 | H48 | 119.5° | 119.6° |
C15 | C14 | N17 | 115.8° | 120.0° |
C14 | C15 | H48 | 119.5° | 119.6° |
C14 | N17 | C18 | 127.7° | 120.0° |
C14 | N17 | H49 | 116.2° | 120.0° |
O19 | C18 | N17 | 126.1° | 120.0° |
O19 | C18 | O20 | 124.4° | 120.0° |
N17 | C18 | O20 | 109.5° | 120.0° |
C18 | N17 | H49 | 116.2° | 120.0° |
C18 | O20 | C21 | 116.4° | 117.0° |
O20 | C21 | H50 | 109.5° | 109.5° |
O20 | C21 | H51 | 109.4° | 109.5° |
O20 | C21 | H52 | 109.4° | 109.5° |
H50 | C21 | H51 | 109.5° | 109.5° |
H50 | C21 | H52 | 109.5° | 109.5° |
H51 | C21 | H52 | 109.5° | 109.4° |
H56 | C24 | H55 | 109.5° | 109.7° |
H41 | C3 | H42 | 109.5° | 109.6° |
H58 | C25 | H57 | 109.5° | 109.4° |
H59 | C28 | H60 | 109.5° | 109.4° |
H62 | C31 | H63 | 109.5° | 109.7° |
H65 | C32 | H64 | 109.5° | 109.2° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C32 | C31 | C30 | H62 | 120.2° | 119.8° |
C32 | C31 | C30 | H63 | 120.3° | 119.8° |
C31 | C32 | N5 | H65 | 120.2° | 120.3° |
C31 | C32 | N5 | H64 | 120.2° | 120.3° |
C32 | C31 | C30 | C33 | 171.0° | 172.7° |
C32 | C31 | C30 | C28 | 64.4° | 67.6° |
C31 | C32 | N5 | C2 | 177.3° | 160.9° |
C31 | C32 | N5 | C29 | 5.0° | 18.8° |
C32 | C31 | C30 | H61 | 51.4° | 52.1° |
C32 | C31 | H62 | H63 | 119.3° | 120.4° |
C31 | C32 | H65 | H64 | 119.4° | 119.5° |
C30 | C31 | C32 | N5 | 44.4° | 50.7° |
C31 | C30 | C33 | C34 | 31.2° | 121.2° |
C31 | C30 | C33 | C28 | 122.6° | 118.8° |
C31 | C30 | C33 | H61 | 119.7° | 120.7° |
C31 | C30 | C33 | C38 | 154.5° | 58.8° |
C31 | C30 | C28 | H61 | 115.7° | 119.9° |
C31 | C30 | C28 | C29 | 46.0° | 49.0° |
C31 | C30 | C28 | H59 | 74.9° | 169.2° |
C31 | C30 | C28 | H60 | 166.9° | 71.1° |
C30 | C31 | H62 | H63 | 119.3° | 120.3° |
C30 | C31 | C32 | H65 | 75.8° | 171.0° |
C30 | C31 | C32 | H64 | 164.6° | 69.6° |
C32 | N5 | C2 | C3 | 26.3° | 67.0° |
C32 | N5 | C2 | C29 | 177.8° | 179.8° |
C32 | N5 | C2 | C6 | 101.6° | 53.8° |
C32 | N5 | C29 | C28 | 13.3° | 2.0° |
C32 | N5 | C29 | O39 | 168.3° | 178.0° |
C32 | N5 | C2 | H40 | 142.4° | 173.5° |
N5 | C32 | C31 | H62 | 75.9° | 170.6° |
N5 | C32 | C31 | H63 | 164.6° | 69.0° |
N5 | C32 | H65 | H64 | 119.4° | 119.5° |
C8 | N7 | C6 | H44 | 180.0° | 179.9° |
N7 | C8 | C9 | H45 | 180.0° | 179.9° |
C8 | N7 | C6 | C2 | 175.2° | 175.8° |
C8 | N7 | C6 | N10 | 0.4° | 4.9° |
N7 | C8 | C9 | N10 | 0.5° | 1.9° |
N7 | C8 | C9 | C11 | 176.2° | 172.9° |
N7 | C6 | C2 | C3 | 56.1° | 125.8° |
C6 | N7 | C8 | C9 | 0.1° | 1.7° |
N7 | C6 | C2 | N5 | 74.8° | 114.1° |
N7 | C6 | C2 | N10 | 175.0° | 179.2° |
N7 | C6 | N10 | C9 | 0.7° | 6.2° |
N7 | C6 | C2 | H40 | 169.0° | 5.6° |
C6 | N7 | C8 | H45 | 179.9° | 178.2° |
C4 | C3 | C2 | H41 | 120.5° | 119.9° |
C4 | C3 | C2 | H42 | 120.5° | 119.9° |
C3 | C4 | C23 | H43 | 180.0° | 179.9° |
C4 | C3 | C2 | N5 | 176.9° | 63.3° |
C4 | C3 | C2 | C6 | 53.0° | 56.9° |
C3 | C4 | C23 | C24 | 177.8° | 178.1° |
C3 | C4 | C23 | H54 | 2.2° | 0.9° |
C4 | C3 | C2 | H40 | 60.3° | 177.1° |
C4 | C3 | H41 | H42 | 118.3° | 120.3° |
C2 | C3 | C4 | C23 | 44.1° | 151.5° |
C3 | C2 | N5 | C6 | 127.8° | 120.8° |
C3 | C2 | N5 | H40 | 116.2° | 119.6° |
C3 | C2 | N5 | C29 | 151.6° | 113.2° |
C3 | C2 | C6 | H40 | 112.9° | 120.2° |
C3 | C2 | C6 | N10 | 118.8° | 53.4° |
C2 | C3 | H41 | H42 | 118.4° | 120.2° |
C2 | C3 | C4 | H43 | 135.9° | 28.6° |
C35 | C34 | C33 | H66 | 180.0° | 179.7° |
C34 | C35 | C36 | H67 | 180.0° | 180.0° |
C35 | C34 | C33 | C30 | 174.0° | 180.0° |
C35 | C34 | C33 | C38 | 0.3° | 0.0° |
C34 | C35 | C36 | C37 | 2.6° | 0.0° |
C34 | C35 | C36 | H68 | 177.4° | 180.0° |
C33 | C34 | C35 | C36 | 1.7° | 0.0° |
C34 | C33 | C30 | C38 | 174.2° | 179.9° |
C34 | C33 | C30 | C28 | 91.3° | 120.0° |
C34 | C33 | C38 | C37 | 0.2° | 0.1° |
C34 | C33 | C30 | H61 | 150.9° | 0.5° |
C33 | C34 | C35 | H67 | 178.3° | 180.0° |
C34 | C33 | C38 | H69 | 179.8° | 180.0° |
C35 | C36 | C37 | H68 | 180.0° | 180.0° |
C35 | C36 | C37 | C38 | 2.1° | 0.0° |
C35 | C36 | C37 | CL1 | 175.3° | 180.0° |
C36 | C35 | C34 | H66 | 178.3° | 179.7° |
C4 | C23 | C24 | H54 | 180.0° | 178.9° |
C4 | C23 | C24 | C25 | 128.4° | 95.2° |
C4 | C23 | C24 | H56 | 111.0° | 145.1° |
C4 | C23 | C24 | H55 | 7.8° | 24.6° |
C23 | C4 | C3 | H41 | 164.6° | 31.7° |
C23 | C4 | C3 | H42 | 76.4° | 88.7° |
C8 | C9 | N10 | C6 | 0.8° | 5.1° |
C8 | C9 | N10 | C11 | 177.2° | 174.6° |
C8 | C9 | C11 | C12 | 48.2° | 39.0° |
C8 | C9 | C11 | C16 | 132.3° | 138.0° |
C9 | C8 | N7 | H44 | 179.9° | 178.2° |
C33 | C30 | C28 | H61 | 117.7° | 120.4° |
C30 | C33 | C38 | C37 | 174.6° | 180.0° |
C33 | C30 | C28 | C29 | 172.6° | 168.7° |
C30 | C33 | C34 | H66 | 6.0° | 0.3° |
C33 | C30 | C28 | H59 | 51.7° | 71.2° |
C33 | C30 | C28 | H60 | 66.5° | 48.6° |
C33 | C30 | C31 | H62 | 68.7° | 52.9° |
C33 | C30 | C31 | H63 | 50.8° | 67.5° |
C30 | C33 | C38 | H69 | 5.5° | 0.1° |
C38 | C33 | C30 | C28 | 82.9° | 60.1° |
C33 | C38 | C37 | C36 | 0.7° | 0.0° |
C33 | C38 | C37 | H69 | 180.0° | 179.9° |
C33 | C38 | C37 | CL1 | 176.6° | 180.0° |
C38 | C33 | C34 | H66 | 179.7° | 179.7° |
C38 | C33 | C30 | H61 | 34.9° | 179.5° |
C30 | C28 | C29 | N5 | 8.9° | 17.6° |
C30 | C28 | C29 | H59 | 120.9° | 120.2° |
C30 | C28 | C29 | H60 | 120.9° | 120.1° |
C30 | C28 | C29 | O39 | 169.6° | 162.4° |
C30 | C28 | H59 | H60 | 117.2° | 119.7° |
C28 | C30 | C31 | H62 | 55.9° | 172.5° |
C28 | C30 | C31 | H63 | 175.4° | 52.1° |
C36 | C37 | C38 | CL1 | 177.3° | 180.0° |
C37 | C36 | C35 | H67 | 177.5° | 180.0° |
C36 | C37 | C38 | H69 | 179.3° | 180.0° |
N5 | C2 | C6 | H40 | 116.2° | 119.7° |
N5 | C2 | C6 | N10 | 110.2° | 66.7° |
C2 | N5 | C29 | C28 | 164.3° | 177.8° |
C2 | N5 | C29 | O39 | 14.1° | 2.2° |
N5 | C2 | C3 | H41 | 62.6° | 176.8° |
N5 | C2 | C3 | H42 | 56.4° | 56.5° |
C2 | N5 | C32 | H65 | 62.5° | 40.7° |
C2 | N5 | C32 | H64 | 57.1° | 78.8° |
C29 | N5 | C2 | C6 | 80.6° | 126.0° |
N5 | C29 | C28 | O39 | 178.5° | 180.0° |
C29 | N5 | C2 | H40 | 35.4° | 6.3° |
N5 | C29 | C28 | H59 | 112.0° | 137.7° |
N5 | C29 | C28 | H60 | 129.7° | 102.5° |
C29 | N5 | C32 | H65 | 115.1° | 139.1° |
C29 | N5 | C32 | H64 | 125.3° | 101.5° |
C2 | C6 | N10 | C9 | 174.7° | 174.5° |
C6 | C2 | C3 | H41 | 67.5° | 63.0° |
C6 | C2 | C3 | H42 | 173.5° | 176.7° |
C2 | C6 | N7 | H44 | 4.8° | 4.3° |
C6 | N10 | C9 | C11 | 176.4° | 169.6° |
N10 | C6 | C2 | H40 | 5.9° | 173.7° |
N10 | C6 | N7 | H44 | 179.6° | 175.0° |
O27 | C26 | C25 | C24 | 46.6° | 9.3° |
O27 | C26 | C25 | N22 | 179.9° | 180.0° |
O27 | C26 | N22 | C16 | 7.8° | 15.1° |
O27 | C26 | N22 | H53 | 172.2° | 164.9° |
O27 | C26 | C25 | H58 | 167.0° | 129.0° |
O27 | C26 | C25 | H57 | 73.8° | 111.3° |
C38 | C37 | C36 | H68 | 177.9° | 179.9° |
C23 | C24 | C25 | H56 | 120.6° | 120.0° |
C23 | C24 | C25 | H55 | 120.6° | 120.1° |
C23 | C24 | C25 | C26 | 59.1° | 63.7° |
C23 | C24 | H56 | H55 | 118.2° | 120.4° |
C24 | C23 | C4 | H43 | 2.2° | 2.0° |
C23 | C24 | C25 | H58 | 61.3° | 55.5° |
C23 | C24 | C25 | H57 | 179.5° | 175.3° |
CL1 | C37 | C36 | H68 | 4.7° | 0.0° |
CL1 | C37 | C38 | H69 | 3.4° | 0.0° |
C24 | C25 | C26 | H58 | 120.4° | 119.6° |
C24 | C25 | C26 | H57 | 120.4° | 120.6° |
C24 | C25 | C26 | N22 | 133.5° | 170.6° |
C25 | C24 | C23 | H54 | 51.6° | 83.7° |
C25 | C24 | H56 | H55 | 118.2° | 119.5° |
C24 | C25 | H58 | H57 | 118.8° | 119.8° |
N10 | C9 | C11 | C12 | 135.3° | 134.7° |
N10 | C9 | C11 | C16 | 44.2° | 48.2° |
N10 | C9 | C8 | H45 | 179.5° | 178.2° |
C9 | C11 | C12 | C16 | 179.5° | 177.1° |
C9 | C11 | C12 | C13 | 179.4° | 178.3° |
C9 | C11 | C16 | N22 | 3.8° | 1.3° |
C9 | C11 | C16 | C15 | 177.8° | 178.5° |
C9 | C11 | C12 | H46 | 0.6° | 1.8° |
C11 | C9 | C8 | H45 | 3.7° | 7.0° |
C29 | C28 | H59 | H60 | 117.3° | 119.8° |
C29 | C28 | C30 | H61 | 69.7° | 70.9° |
O39 | C29 | C28 | H59 | 69.5° | 42.2° |
O39 | C29 | C28 | H60 | 48.8° | 77.5° |
C25 | C26 | N22 | C16 | 172.1° | 165.0° |
C26 | C25 | C24 | H56 | 179.6° | 176.3° |
C26 | C25 | C24 | H55 | 61.5° | 56.4° |
C25 | C26 | N22 | H53 | 7.9° | 15.1° |
C26 | C25 | H58 | H57 | 118.7° | 120.2° |
C26 | N22 | C16 | C11 | 64.3° | 59.1° |
C26 | N22 | C16 | H53 | 180.0° | 180.0° |
C26 | N22 | C16 | C15 | 114.1° | 123.6° |
N22 | C26 | C25 | H58 | 13.1° | 51.0° |
N22 | C26 | C25 | H57 | 106.1° | 68.8° |
C11 | C12 | C13 | H46 | 180.0° | 179.9° |
C12 | C11 | C16 | N22 | 176.7° | 175.7° |
C11 | C12 | C13 | C14 | 2.3° | 0.2° |
C12 | C11 | C16 | C15 | 1.7° | 1.5° |
C11 | C12 | C13 | H47 | 177.7° | 179.6° |
C16 | C11 | C12 | C13 | 0.1° | 1.2° |
C11 | C16 | N22 | C15 | 178.4° | 177.3° |
C11 | C16 | C15 | C14 | 1.0° | 1.0° |
C11 | C16 | C15 | H48 | 179.0° | 179.6° |
C16 | C11 | C12 | H46 | 179.9° | 178.9° |
C11 | C16 | N22 | H53 | 115.7° | 120.9° |
C12 | C13 | C14 | H47 | 180.0° | 179.8° |
C12 | C13 | C14 | C15 | 3.0° | 0.4° |
C12 | C13 | C14 | N17 | 177.7° | 179.6° |
N22 | C16 | C15 | C14 | 177.4° | 176.4° |
N22 | C16 | C15 | H48 | 2.6° | 2.9° |
C13 | C14 | C15 | C16 | 1.4° | 0.0° |
C13 | C14 | C15 | N17 | 179.3° | 180.0° |
C13 | C14 | N17 | C18 | 13.0° | 144.7° |
C13 | C14 | C15 | H48 | 178.6° | 179.4° |
C14 | C13 | C12 | H46 | 177.7° | 179.8° |
C13 | C14 | N17 | H49 | 167.0° | 35.2° |
C16 | C15 | C14 | H48 | 180.0° | 179.4° |
C16 | C15 | C14 | N17 | 179.3° | 180.0° |
C15 | C16 | N22 | H53 | 65.9° | 56.4° |
C15 | C14 | N17 | C18 | 166.3° | 35.3° |
C15 | C14 | C13 | H47 | 177.0° | 179.8° |
C15 | C14 | N17 | H49 | 13.7° | 144.8° |
C14 | N17 | C18 | O19 | 4.5° | 4.8° |
C14 | N17 | C18 | H49 | 180.0° | 179.9° |
C14 | N17 | C18 | O20 | 176.9° | 175.4° |
N17 | C14 | C13 | H47 | 2.3° | 0.2° |
N17 | C14 | C15 | H48 | 0.7° | 0.6° |
O19 | C18 | N17 | O20 | 178.6° | 179.9° |
O19 | C18 | O20 | C21 | 1.6° | 0.1° |
O19 | C18 | N17 | H49 | 175.5° | 175.4° |
N17 | C18 | O20 | C21 | 177.0° | 180.0° |
C18 | O20 | C21 | H50 | 180.0° | 180.0° |
C18 | O20 | C21 | H51 | 60.0° | 60.0° |
C18 | O20 | C21 | H52 | 60.0° | 60.0° |
O20 | C18 | N17 | H49 | 3.1° | 4.5° |
O20 | C21 | H50 | H51 | 120.0° | 120.0° |
O20 | C21 | H50 | H52 | 120.0° | 120.0° |
O20 | C21 | H51 | H52 | 119.9° | 120.0° |
H47 | C13 | C12 | H46 | 2.3° | 0.3° |
H50 | C21 | H51 | H52 | 120.0° | 120.0° |
H54 | C23 | C24 | H56 | 69.0° | 36.0° |
H54 | C23 | C24 | H55 | 172.2° | 156.5° |
H54 | C23 | C4 | H43 | 177.8° | 179.0° |
H56 | C24 | C25 | H58 | 59.2° | 64.6° |
H56 | C24 | C25 | H57 | 60.0° | 55.3° |
H55 | C24 | C25 | H58 | 178.1° | 175.6° |
H55 | C24 | C25 | H57 | 58.9° | 64.6° |
H66 | C34 | C35 | H67 | 1.7° | 0.4° |
H40 | C2 | C3 | H41 | 179.2° | 57.2° |
H40 | C2 | C3 | H42 | 60.3° | 63.1° |
H41 | C3 | C4 | H43 | 15.4° | 148.4° |
H42 | C3 | C4 | H43 | 103.6° | 91.2° |
H44 | N7 | C8 | H45 | 0.1° | 1.9° |
H59 | C28 | C30 | H61 | 169.4° | 49.2° |
H60 | C28 | C30 | H61 | 51.2° | 169.0° |
H61 | C30 | C31 | H62 | 171.6° | 67.7° |
H61 | C30 | C31 | H63 | 68.9° | 171.9° |
H62 | C31 | C32 | H65 | 163.9° | 69.2° |
H62 | C31 | C32 | H64 | 44.4° | 50.3° |
H63 | C31 | C32 | H65 | 44.4° | 51.3° |
H63 | C31 | C32 | H64 | 75.2° | 170.7° |
H67 | C35 | C36 | H68 | 2.5° | 0.1° |