7V8
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N36 | C35 | sing | 1.47Å | 1.50Å | |
C35 | C34 | sing | 1.53Å | 1.53Å | |
C34 | O33 | sing | 1.43Å | 1.43Å | |
O33 | C16 | sing | 1.36Å | 1.39Å | |
C16 | C15 | doub | 1.37Å | 1.39Å | Aromatic |
C16 | C17 | sing | 1.42Å | 1.44Å | Aromatic |
C20 | C17 | sing | 1.40Å | 1.45Å | Aromatic |
C20 | C21 | doub | 1.36Å | 1.38Å | Aromatic |
N52 | C51 | sing | 1.47Å | 1.51Å | |
C15 | C10 | sing | 1.40Å | 1.44Å | Aromatic |
C17 | C18 | doub | 1.41Å | 1.44Å | Aromatic |
O8 | C7 | doub | 1.22Å | 1.23Å | |
C21 | C22 | sing | 1.39Å | 1.42Å | Aromatic |
C51 | C50 | sing | 1.53Å | 1.52Å | |
C10 | N9 | sing | 1.39Å | 1.43Å | |
C10 | N19 | doub | 1.32Å | 1.34Å | Aromatic |
C50 | O49 | sing | 1.43Å | 1.42Å | |
C7 | N9 | sing | 1.35Å | 1.41Å | |
C7 | C2 | sing | 1.48Å | 1.55Å | |
C18 | N19 | sing | 1.34Å | 1.41Å | Aromatic |
C18 | C23 | sing | 1.41Å | 1.43Å | Aromatic |
C22 | C23 | doub | 1.36Å | 1.38Å | Aromatic |
C1 | C2 | doub | 1.39Å | 1.41Å | Aromatic |
C1 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
C2 | N3 | sing | 1.32Å | 1.38Å | Aromatic |
O49 | C6 | sing | 1.36Å | 1.38Å | |
C6 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
N3 | C4 | doub | 1.32Å | 1.38Å | Aromatic |
C5 | C4 | sing | 1.39Å | 1.42Å | Aromatic |
C4 | C11 | sing | 1.48Å | 1.55Å | |
C11 | N13 | sing | 1.35Å | 1.42Å | |
C11 | O12 | doub | 1.21Å | 1.23Å | |
N13 | C14 | sing | 1.39Å | 1.44Å | |
N24 | C14 | doub | 1.32Å | 1.33Å | Aromatic |
N24 | C25 | sing | 1.34Å | 1.40Å | Aromatic |
C14 | C28 | sing | 1.40Å | 1.46Å | Aromatic |
C29 | C25 | sing | 1.41Å | 1.45Å | Aromatic |
C29 | C30 | doub | 1.36Å | 1.38Å | Aromatic |
C25 | C26 | doub | 1.42Å | 1.44Å | Aromatic |
C28 | C27 | doub | 1.37Å | 1.39Å | Aromatic |
C30 | C31 | sing | 1.39Å | 1.42Å | Aromatic |
C26 | C27 | sing | 1.42Å | 1.46Å | Aromatic |
C26 | C32 | sing | 1.40Å | 1.45Å | Aromatic |
C27 | O37 | sing | 1.36Å | 1.39Å | |
C31 | C32 | doub | 1.36Å | 1.39Å | Aromatic |
O37 | C38 | sing | 1.43Å | 1.42Å | |
C38 | C39 | sing | 1.53Å | 1.55Å | |
C39 | N40 | sing | 1.47Å | 1.50Å | |
N13 | H56 | sing | 0.97Å | 1.00Å | |
C5 | H54 | sing | 1.08Å | 1.08Å | |
C29 | H63 | sing | 1.08Å | 1.08Å | |
C31 | H65 | sing | 1.08Å | 1.08Å | |
C28 | H62 | sing | 1.08Å | 1.08Å | |
C23 | H61 | sing | 1.08Å | 1.08Å | |
C1 | H53 | sing | 1.08Å | 1.08Å | |
C15 | H57 | sing | 1.08Å | 1.08Å | |
C21 | H59 | sing | 1.08Å | 1.08Å | |
N9 | H55 | sing | 0.97Å | 1.00Å | |
C22 | H60 | sing | 1.08Å | 1.08Å | |
C32 | H66 | sing | 1.08Å | 1.08Å | |
N36 | H34 | sing | 1.01Å | 1.00Å | |
N36 | H35 | sing | 1.01Å | 1.00Å | |
C35 | H69 | sing | 1.09Å | 1.10Å | |
C35 | H70 | sing | 1.09Å | 1.10Å | |
C34 | H67 | sing | 1.09Å | 1.10Å | |
C34 | H68 | sing | 1.09Å | 1.10Å | |
C20 | H58 | sing | 1.08Å | 1.08Å | |
C50 | H92 | sing | 1.09Å | 1.10Å | |
C50 | H91 | sing | 1.09Å | 1.10Å | |
C51 | H94 | sing | 1.09Å | 1.10Å | |
C51 | H93 | sing | 1.09Å | 1.10Å | |
N52 | H97 | sing | 1.01Å | 1.00Å | |
N52 | H95 | sing | 1.01Å | 1.00Å | |
C30 | H64 | sing | 1.08Å | 1.08Å | |
C38 | H71 | sing | 1.09Å | 1.10Å | |
C38 | H72 | sing | 1.09Å | 1.10Å | |
C39 | H73 | sing | 1.09Å | 1.10Å | |
C39 | H74 | sing | 1.09Å | 1.10Å | |
N40 | H31 | sing | 1.01Å | 1.00Å | |
N40 | H32 | sing | 1.01Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N36 | C35 | C34 | 108.8° | 109.5° |
C35 | N36 | H34 | 109.5° | 111.0° |
C35 | N36 | H35 | 109.5° | 111.0° |
N36 | C35 | H69 | 109.6° | 109.5° |
N36 | C35 | H70 | 109.6° | 109.5° |
C35 | C34 | O33 | 107.1° | 109.4° |
C34 | C35 | H69 | 109.6° | 109.4° |
C34 | C35 | H70 | 109.6° | 109.5° |
C35 | C34 | H67 | 110.1° | 109.5° |
C35 | C34 | H68 | 110.0° | 109.4° |
C34 | O33 | C16 | 117.9° | 117.0° |
O33 | C34 | H67 | 110.0° | 109.5° |
O33 | C34 | H68 | 110.1° | 109.4° |
O33 | C16 | C15 | 125.1° | 120.9° |
O33 | C16 | C17 | 116.9° | 120.9° |
C15 | C16 | C17 | 118.1° | 118.1° |
C16 | C15 | C10 | 122.0° | 119.8° |
C16 | C15 | H57 | 119.0° | 120.0° |
C16 | C17 | C20 | 123.8° | 121.3° |
C16 | C17 | C18 | 117.9° | 119.1° |
C17 | C20 | C21 | 120.4° | 119.7° |
C20 | C17 | C18 | 118.3° | 119.7° |
C17 | C20 | H58 | 119.8° | 120.2° |
C20 | C21 | C22 | 120.5° | 120.8° |
C20 | C21 | H59 | 119.8° | 119.6° |
C21 | C20 | H58 | 119.8° | 120.1° |
N52 | C51 | C50 | 107.7° | 109.4° |
N52 | C51 | H94 | 109.9° | 109.4° |
N52 | C51 | H93 | 109.9° | 109.5° |
C51 | N52 | H97 | 109.5° | 111.0° |
C51 | N52 | H95 | 109.5° | 111.0° |
C15 | C10 | N9 | 129.0° | 119.2° |
C15 | C10 | N19 | 120.7° | 121.7° |
C10 | C15 | H57 | 119.0° | 120.1° |
C17 | C18 | N19 | 121.7° | 120.0° |
C17 | C18 | C23 | 119.6° | 119.1° |
O8 | C7 | N9 | 124.3° | 120.0° |
O8 | C7 | C2 | 118.7° | 120.0° |
C21 | C22 | C23 | 121.3° | 121.0° |
C22 | C21 | H59 | 119.7° | 119.6° |
C21 | C22 | H60 | 119.3° | 119.5° |
C51 | C50 | O49 | 106.1° | 109.5° |
C51 | C50 | H92 | 110.3° | 109.5° |
C51 | C50 | H91 | 110.3° | 109.4° |
C50 | C51 | H94 | 109.9° | 109.5° |
C50 | C51 | H93 | 109.9° | 109.5° |
N9 | C10 | N19 | 110.4° | 119.2° |
C10 | N9 | C7 | 129.1° | 120.0° |
C10 | N9 | H55 | 115.5° | 120.1° |
C10 | N19 | C18 | 119.8° | 121.4° |
C50 | O49 | C6 | 115.6° | 117.0° |
O49 | C50 | H92 | 110.3° | 109.5° |
O49 | C50 | H91 | 110.3° | 109.5° |
N9 | C7 | C2 | 117.0° | 120.0° |
C7 | N9 | H55 | 115.4° | 119.9° |
C7 | C2 | C1 | 118.5° | 119.6° |
C7 | C2 | N3 | 122.2° | 119.6° |
N19 | C18 | C23 | 118.7° | 121.0° |
C18 | C23 | C22 | 119.9° | 119.8° |
C18 | C23 | H61 | 120.1° | 120.1° |
C22 | C23 | H61 | 120.1° | 120.1° |
C23 | C22 | H60 | 119.3° | 119.5° |
C2 | C1 | C6 | 121.6° | 119.2° |
C1 | C2 | N3 | 119.3° | 120.8° |
C2 | C1 | H53 | 119.2° | 120.4° |
C1 | C6 | O49 | 126.1° | 120.8° |
C1 | C6 | C5 | 117.9° | 118.5° |
C6 | C1 | H53 | 119.2° | 120.4° |
C2 | N3 | C4 | 120.7° | 121.7° |
O49 | C6 | C5 | 116.0° | 120.8° |
C6 | C5 | C4 | 121.3° | 119.2° |
C6 | C5 | H54 | 119.4° | 120.4° |
N3 | C4 | C5 | 119.2° | 120.8° |
N3 | C4 | C11 | 121.2° | 119.6° |
C5 | C4 | C11 | 119.6° | 119.6° |
C4 | C5 | H54 | 119.3° | 120.5° |
C4 | C11 | N13 | 118.1° | 120.0° |
C4 | C11 | O12 | 118.8° | 120.1° |
N13 | C11 | O12 | 123.1° | 119.9° |
C11 | N13 | C14 | 130.5° | 120.0° |
C11 | N13 | H56 | 114.8° | 120.0° |
N13 | C14 | N24 | 107.7° | 119.2° |
N13 | C14 | C28 | 130.9° | 119.2° |
C14 | N13 | H56 | 114.7° | 120.0° |
C14 | N24 | C25 | 120.2° | 121.4° |
N24 | C14 | C28 | 121.3° | 121.7° |
N24 | C25 | C29 | 118.4° | 121.0° |
N24 | C25 | C26 | 121.2° | 119.9° |
C14 | C28 | C27 | 120.9° | 119.8° |
C14 | C28 | H62 | 119.5° | 120.1° |
C25 | C29 | C30 | 119.8° | 119.8° |
C29 | C25 | C26 | 120.4° | 119.1° |
C25 | C29 | H63 | 120.1° | 120.1° |
C29 | C30 | C31 | 120.3° | 121.0° |
C30 | C29 | H63 | 120.1° | 120.1° |
C29 | C30 | H64 | 119.8° | 119.4° |
C25 | C26 | C27 | 118.6° | 119.1° |
C25 | C26 | C32 | 117.2° | 119.6° |
C28 | C27 | C26 | 117.8° | 118.2° |
C28 | C27 | O37 | 127.9° | 120.9° |
C27 | C28 | H62 | 119.5° | 120.1° |
C30 | C31 | C32 | 121.2° | 120.9° |
C30 | C31 | H65 | 119.4° | 119.5° |
C31 | C30 | H64 | 119.8° | 119.6° |
C27 | C26 | C32 | 124.2° | 121.3° |
C26 | C27 | O37 | 114.3° | 120.9° |
C26 | C32 | C31 | 121.0° | 119.7° |
C26 | C32 | H66 | 119.5° | 120.2° |
C27 | O37 | C38 | 118.5° | 117.0° |
C32 | C31 | H65 | 119.4° | 119.6° |
C31 | C32 | H66 | 119.5° | 120.2° |
O37 | C38 | C39 | 101.3° | 109.5° |
O37 | C38 | H71 | 111.5° | 109.5° |
O37 | C38 | H72 | 111.5° | 109.5° |
C38 | C39 | N40 | 112.8° | 109.5° |
C39 | C38 | H71 | 111.5° | 109.4° |
C39 | C38 | H72 | 111.5° | 109.5° |
C38 | C39 | H73 | 108.6° | 109.5° |
C38 | C39 | H74 | 108.6° | 109.5° |
N40 | C39 | H73 | 108.6° | 109.5° |
N40 | C39 | H74 | 108.6° | 109.4° |
C39 | N40 | H31 | 109.5° | 110.9° |
C39 | N40 | H32 | 109.5° | 111.0° |
H34 | N36 | H35 | 109.4° | 111.0° |
H69 | C35 | H70 | 109.5° | 109.5° |
H67 | C34 | H68 | 109.5° | 109.5° |
H92 | C50 | H91 | 109.5° | 109.5° |
H94 | C51 | H93 | 109.5° | 109.5° |
H97 | N52 | H95 | 109.5° | 111.0° |
H71 | C38 | H72 | 109.5° | 109.5° |
H73 | C39 | H74 | 109.5° | 109.4° |
H31 | N40 | H32 | 109.5° | 111.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N36 | C35 | C34 | H69 | 119.9° | 120.0° |
N36 | C35 | C34 | H70 | 119.9° | 120.1° |
N36 | C35 | C34 | O33 | 180.0° | 64.9° |
C35 | N36 | H34 | H35 | 120.0° | 124.0° |
N36 | C35 | H69 | H70 | 120.3° | 120.0° |
N36 | C35 | C34 | H67 | 60.3° | 175.0° |
N36 | C35 | C34 | H68 | 60.4° | 55.0° |
C35 | C34 | O33 | H67 | 119.6° | 120.0° |
C35 | C34 | O33 | H68 | 119.6° | 119.9° |
C35 | C34 | O33 | C16 | 180.0° | 180.0° |
C34 | C35 | N36 | H34 | 180.0° | 56.1° |
C34 | C35 | N36 | H35 | 60.0° | 180.0° |
C34 | C35 | H69 | H70 | 120.3° | 120.0° |
C35 | C34 | H67 | H68 | 121.1° | 120.0° |
C34 | O33 | C16 | C15 | 0.1° | 0.0° |
C34 | O33 | C16 | C17 | 179.9° | 179.7° |
O33 | C34 | C35 | H69 | 60.1° | 55.0° |
O33 | C34 | C35 | H70 | 60.1° | 175.0° |
O33 | C34 | H67 | H68 | 121.1° | 120.0° |
O33 | C16 | C15 | C17 | 179.9° | 179.7° |
O33 | C16 | C17 | C20 | 0.4° | 0.3° |
O33 | C16 | C15 | C10 | 179.8° | 180.0° |
O33 | C16 | C17 | C18 | 179.8° | 179.7° |
O33 | C16 | C15 | H57 | 0.1° | 0.3° |
C16 | O33 | C34 | H67 | 60.4° | 60.0° |
C16 | O33 | C34 | H68 | 60.4° | 60.1° |
C15 | C16 | C17 | C20 | 179.7° | 180.0° |
C16 | C15 | C10 | H57 | 180.0° | 179.8° |
C15 | C16 | C17 | C18 | 0.0° | 0.0° |
C16 | C15 | C10 | N9 | 179.0° | 179.9° |
C16 | C15 | C10 | N19 | 0.0° | 0.5° |
C16 | C17 | C20 | C18 | 179.8° | 179.9° |
C16 | C17 | C20 | C21 | 179.7° | 180.0° |
C17 | C16 | C15 | C10 | 0.0° | 0.3° |
C16 | C17 | C18 | N19 | 0.0° | 0.0° |
C16 | C17 | C18 | C23 | 179.7° | 179.7° |
C17 | C16 | C15 | H57 | 180.0° | 180.0° |
C16 | C17 | C20 | H58 | 0.3° | 0.0° |
C17 | C20 | C21 | H58 | 180.0° | 180.0° |
C17 | C20 | C21 | C22 | 0.0° | 0.3° |
C20 | C17 | C18 | N19 | 179.8° | 180.0° |
C20 | C17 | C18 | C23 | 0.0° | 0.3° |
C17 | C20 | C21 | H59 | 180.0° | 180.0° |
C21 | C20 | C17 | C18 | 0.0° | 0.0° |
C20 | C21 | C22 | H59 | 180.0° | 179.7° |
C20 | C21 | C22 | C23 | 0.0° | 0.3° |
C20 | C21 | C22 | H60 | 180.0° | 180.0° |
N52 | C51 | C50 | H94 | 119.7° | 120.0° |
N52 | C51 | C50 | H93 | 119.8° | 120.0° |
N52 | C51 | C50 | O49 | 180.0° | 65.0° |
N52 | C51 | C50 | H92 | 60.5° | 55.0° |
N52 | C51 | C50 | H91 | 60.5° | 175.0° |
N52 | C51 | H94 | H93 | 120.8° | 120.0° |
C51 | N52 | H97 | H95 | 120.0° | 123.9° |
C15 | C10 | N9 | N19 | 179.1° | 179.4° |
C15 | C10 | N9 | C7 | 0.1° | 174.9° |
C15 | C10 | N19 | C18 | 0.0° | 0.5° |
C15 | C10 | N9 | H55 | 179.9° | 5.1° |
C17 | C18 | N19 | C10 | 0.0° | 0.3° |
C17 | C18 | N19 | C23 | 179.7° | 179.7° |
C17 | C18 | C23 | C22 | 0.0° | 0.3° |
C17 | C18 | C23 | H61 | 180.0° | 179.7° |
C18 | C17 | C20 | H58 | 180.0° | 179.9° |
O8 | C7 | N9 | C10 | 0.0° | 5.1° |
O8 | C7 | N9 | C2 | 180.0° | 180.0° |
O8 | C7 | C2 | C1 | 0.8° | 0.1° |
O8 | C7 | C2 | N3 | 179.9° | 180.0° |
O8 | C7 | N9 | H55 | 180.0° | 174.9° |
C21 | C22 | C23 | C18 | 0.0° | 0.0° |
C21 | C22 | C23 | H60 | 180.0° | 179.8° |
C21 | C22 | C23 | H61 | 180.0° | 180.0° |
C22 | C21 | C20 | H58 | 180.0° | 179.8° |
C51 | C50 | O49 | H92 | 119.5° | 120.0° |
C51 | C50 | O49 | H91 | 119.5° | 120.0° |
C51 | C50 | O49 | C6 | 179.9° | 180.0° |
C51 | C50 | H92 | H91 | 121.6° | 119.9° |
C50 | C51 | H94 | H93 | 120.8° | 120.0° |
C50 | C51 | N52 | H97 | 180.0° | 56.1° |
C50 | C51 | N52 | H95 | 60.0° | 180.0° |
C10 | N9 | C7 | H55 | 180.0° | 179.9° |
C10 | N9 | C7 | C2 | 180.0° | 175.0° |
N9 | C10 | N19 | C18 | 179.2° | 180.0° |
N9 | C10 | C15 | H57 | 1.0° | 0.3° |
N19 | C10 | N9 | C7 | 179.0° | 4.5° |
C10 | N19 | C18 | C23 | 179.7° | 180.0° |
N19 | C10 | C15 | H57 | 180.0° | 179.7° |
N19 | C10 | N9 | H55 | 1.0° | 175.4° |
C50 | O49 | C6 | C1 | 0.0° | 0.3° |
C50 | O49 | C6 | C5 | 177.7° | 180.0° |
O49 | C50 | H92 | H91 | 121.6° | 120.0° |
O49 | C50 | C51 | H94 | 60.3° | 175.0° |
O49 | C50 | C51 | H93 | 60.2° | 55.0° |
N9 | C7 | C2 | C1 | 179.2° | 180.0° |
N9 | C7 | C2 | N3 | 0.1° | 0.1° |
C7 | C2 | C1 | N3 | 179.3° | 179.9° |
C7 | C2 | C1 | C6 | 179.2° | 179.9° |
C7 | C2 | N3 | C4 | 179.2° | 180.0° |
C7 | C2 | C1 | H53 | 0.9° | 0.1° |
C2 | C7 | N9 | H55 | 0.0° | 5.1° |
N19 | C18 | C23 | C22 | 179.7° | 179.9° |
N19 | C18 | C23 | H61 | 0.3° | 0.0° |
C18 | C23 | C22 | H61 | 180.0° | 180.0° |
C18 | C23 | C22 | H60 | 180.0° | 179.7° |
C23 | C22 | C21 | H59 | 180.0° | 180.0° |
C2 | C1 | C6 | H53 | 180.0° | 180.0° |
C2 | C1 | C6 | O49 | 177.5° | 179.7° |
C2 | C1 | C6 | C5 | 0.2° | 0.0° |
C1 | C2 | N3 | C4 | 0.0° | 0.1° |
C6 | C1 | C2 | N3 | 0.1° | 0.0° |
C1 | C6 | O49 | C5 | 177.7° | 179.7° |
C1 | C6 | C5 | C4 | 0.1° | 0.0° |
C1 | C6 | C5 | H54 | 179.9° | 180.0° |
C2 | N3 | C4 | C5 | 0.0° | 0.1° |
C2 | N3 | C4 | C11 | 179.0° | 180.0° |
N3 | C2 | C1 | H53 | 179.8° | 180.0° |
O49 | C6 | C5 | C4 | 177.8° | 179.7° |
O49 | C6 | C5 | H54 | 2.2° | 0.3° |
O49 | C6 | C1 | H53 | 2.5° | 0.3° |
C6 | O49 | C50 | H92 | 60.6° | 60.0° |
C6 | O49 | C50 | H91 | 60.4° | 60.0° |
C6 | C5 | C4 | N3 | 0.0° | 0.1° |
C6 | C5 | C4 | H54 | 180.0° | 180.0° |
C6 | C5 | C4 | C11 | 179.0° | 180.0° |
C5 | C6 | C1 | H53 | 179.8° | 180.0° |
N3 | C4 | C5 | C11 | 179.0° | 179.9° |
N3 | C4 | C11 | N13 | 0.3° | 0.1° |
N3 | C4 | C11 | O12 | 179.6° | 180.0° |
N3 | C4 | C5 | H54 | 180.0° | 179.9° |
C5 | C4 | C11 | N13 | 178.6° | 180.0° |
C5 | C4 | C11 | O12 | 1.4° | 0.1° |
C4 | C11 | N13 | O12 | 180.0° | 179.9° |
C4 | C11 | N13 | C14 | 180.0° | 174.9° |
C4 | C11 | N13 | H56 | 0.0° | 5.2° |
C11 | C4 | C5 | H54 | 1.0° | 0.0° |
C11 | N13 | C14 | H56 | 180.0° | 179.9° |
C11 | N13 | C14 | N24 | 179.7° | 5.0° |
C11 | N13 | C14 | C28 | 1.1° | 174.9° |
O12 | C11 | N13 | C14 | 0.0° | 5.0° |
O12 | C11 | N13 | H56 | 180.0° | 174.9° |
N13 | C14 | N24 | C28 | 178.8° | 179.9° |
N13 | C14 | N24 | C25 | 178.7° | 180.0° |
N13 | C14 | C28 | C27 | 178.3° | 180.0° |
N13 | C14 | C28 | H62 | 1.7° | 0.1° |
C14 | N24 | C25 | C29 | 179.9° | 180.0° |
C14 | N24 | C25 | C26 | 0.0° | 0.1° |
N24 | C14 | C28 | C27 | 0.2° | 0.0° |
N24 | C14 | N13 | H56 | 0.2° | 174.9° |
N24 | C14 | C28 | H62 | 179.8° | 180.0° |
C25 | N24 | C14 | C28 | 0.2° | 0.1° |
N24 | C25 | C29 | C26 | 179.9° | 179.9° |
N24 | C25 | C29 | C30 | 179.9° | 180.0° |
N24 | C25 | C26 | C27 | 0.1° | 0.1° |
N24 | C25 | C26 | C32 | 179.9° | 180.0° |
N24 | C25 | C29 | H63 | 0.1° | 0.3° |
C14 | C28 | C27 | H62 | 180.0° | 179.9° |
C14 | C28 | C27 | C26 | 0.1° | 0.1° |
C14 | C28 | C27 | O37 | 179.8° | 180.0° |
C28 | C14 | N13 | H56 | 178.9° | 5.2° |
C25 | C29 | C30 | H63 | 180.0° | 179.7° |
C25 | C29 | C30 | C31 | 0.1° | 0.1° |
C29 | C25 | C26 | C27 | 180.0° | 180.0° |
C29 | C25 | C26 | C32 | 0.0° | 0.0° |
C25 | C29 | C30 | H64 | 180.0° | 180.0° |
C30 | C29 | C25 | C26 | 0.0° | 0.0° |
C29 | C30 | C31 | H64 | 180.0° | 179.9° |
C29 | C30 | C31 | C32 | 0.1° | 0.1° |
C29 | C30 | C31 | H65 | 179.9° | 180.0° |
C25 | C26 | C27 | C28 | 0.1° | 0.1° |
C25 | C26 | C27 | C32 | 180.0° | 179.9° |
C25 | C26 | C27 | O37 | 179.7° | 180.0° |
C25 | C26 | C32 | C31 | 0.0° | 0.1° |
C26 | C25 | C29 | H63 | 180.0° | 179.8° |
C25 | C26 | C32 | H66 | 180.0° | 180.0° |
C28 | C27 | C26 | O37 | 179.8° | 179.9° |
C28 | C27 | C26 | C32 | 179.9° | 180.0° |
C28 | C27 | O37 | C38 | 0.0° | 0.0° |
C30 | C31 | C32 | C26 | 0.0° | 0.1° |
C30 | C31 | C32 | H65 | 180.0° | 179.9° |
C31 | C30 | C29 | H63 | 180.0° | 179.8° |
C30 | C31 | C32 | H66 | 180.0° | 180.0° |
C27 | C26 | C32 | C31 | 180.0° | 180.0° |
C26 | C27 | O37 | C38 | 179.7° | 179.9° |
C26 | C27 | C28 | H62 | 180.0° | 180.0° |
C27 | C26 | C32 | H66 | 0.0° | 0.0° |
C32 | C26 | C27 | O37 | 0.3° | 0.0° |
C26 | C32 | C31 | H66 | 180.0° | 180.0° |
C26 | C32 | C31 | H65 | 179.9° | 180.0° |
C27 | O37 | C38 | C39 | 180.0° | 180.0° |
O37 | C27 | C28 | H62 | 0.2° | 0.1° |
C27 | O37 | C38 | H71 | 61.4° | 60.0° |
C27 | O37 | C38 | H72 | 61.3° | 60.0° |
C32 | C31 | C30 | H64 | 179.9° | 180.0° |
O37 | C38 | C39 | H71 | 118.7° | 120.0° |
O37 | C38 | C39 | H72 | 118.7° | 120.0° |
O37 | C38 | C39 | N40 | 179.9° | 65.0° |
O37 | C38 | H71 | H72 | 123.8° | 120.0° |
O37 | C38 | C39 | H73 | 59.4° | 174.9° |
O37 | C38 | C39 | H74 | 59.6° | 55.0° |
C38 | C39 | N40 | H73 | 120.5° | 120.1° |
C38 | C39 | N40 | H74 | 120.5° | 120.0° |
C39 | C38 | H71 | H72 | 123.8° | 119.9° |
C38 | C39 | H73 | H74 | 118.5° | 120.0° |
C38 | C39 | N40 | H31 | 180.0° | 56.1° |
C38 | C39 | N40 | H32 | 60.0° | 180.0° |
N40 | C39 | C38 | H71 | 61.4° | 55.1° |
N40 | C39 | C38 | H72 | 61.2° | 175.0° |
N40 | C39 | H73 | H74 | 118.5° | 120.0° |
C39 | N40 | H31 | H32 | 120.0° | 123.9° |
H63 | C29 | C30 | H64 | 0.0° | 0.3° |
H65 | C31 | C32 | H66 | 0.0° | 0.0° |
H65 | C31 | C30 | H64 | 0.1° | 0.1° |
H61 | C23 | C22 | H60 | 0.0° | 0.2° |
H59 | C21 | C22 | H60 | 0.0° | 0.3° |
H59 | C21 | C20 | H58 | 0.0° | 0.1° |
H34 | N36 | C35 | H69 | 60.1° | 176.0° |
H34 | N36 | C35 | H70 | 60.2° | 64.0° |
H35 | N36 | C35 | H69 | 59.9° | 60.0° |
H35 | N36 | C35 | H70 | 179.9° | 60.0° |
H69 | C35 | C34 | H67 | 179.8° | 65.0° |
H69 | C35 | C34 | H68 | 59.5° | 174.9° |
H70 | C35 | C34 | H67 | 59.6° | 54.9° |
H70 | C35 | C34 | H68 | 179.7° | 65.1° |
H92 | C50 | C51 | H94 | 179.7° | 64.9° |
H92 | C50 | C51 | H93 | 59.2° | 175.0° |
H91 | C50 | C51 | H94 | 59.2° | 55.0° |
H91 | C50 | C51 | H93 | 179.7° | 65.0° |
H94 | C51 | N52 | H97 | 60.3° | 63.9° |
H94 | C51 | N52 | H95 | 59.7° | 60.0° |
H93 | C51 | N52 | H97 | 60.2° | 176.0° |
H93 | C51 | N52 | H95 | 179.8° | 60.0° |
H71 | C38 | C39 | H73 | 178.1° | 65.0° |
H71 | C38 | C39 | H74 | 59.1° | 175.0° |
H72 | C38 | C39 | H73 | 59.3° | 54.9° |
H72 | C38 | C39 | H74 | 178.3° | 65.0° |
H73 | C39 | N40 | H31 | 59.5° | 64.0° |
H73 | C39 | N40 | H32 | 179.5° | 59.9° |
H74 | C39 | N40 | H31 | 59.5° | 176.1° |
H74 | C39 | N40 | H32 | 60.5° | 60.0° |