UHH
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C12 | doub | 1.34Å | 1.54Å | |
C1 | C2 | sing | 1.53Å | 1.54Å | |
C1 | H1 | sing | 1.09Å | 1.08Å | |
C2 | C11 | sing | 1.55Å | 1.53Å | |
C2 | C15 | sing | 1.57Å | 1.55Å | |
C2 | C19 | sing | 1.58Å | 1.55Å | |
C3 | C19 | sing | 1.56Å | 1.55Å | |
C3 | C4 | sing | 1.54Å | 1.53Å | |
C3 | H31 | sing | 1.10Å | 1.10Å | |
C3 | H32 | sing | 1.10Å | 1.10Å | |
C4 | O4 | sing | 1.43Å | 1.43Å | |
C4 | C5 | sing | 1.54Å | 1.55Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C5 | C10 | sing | 1.55Å | 1.54Å | |
C5 | C6 | sing | 1.55Å | 1.53Å | |
C5 | C9 | sing | 1.55Å | 1.54Å | |
C6 | C18 | sing | 1.54Å | 1.54Å | |
C6 | C7 | sing | 1.53Å | 1.54Å | |
C6 | H6 | sing | 1.10Å | 1.10Å | |
C7 | C8 | sing | 1.54Å | 1.53Å | |
C7 | H71 | sing | 1.09Å | 1.10Å | |
C7 | H72 | sing | 1.10Å | 1.10Å | |
C8 | C9 | sing | 1.55Å | 1.52Å | |
C8 | H81 | sing | 1.10Å | 1.10Å | |
C8 | H82 | sing | 1.10Å | 1.10Å | |
C9 | C20 | sing | 1.52Å | 1.54Å | |
C9 | H9 | sing | 1.10Å | 1.10Å | |
C10 | H101 | sing | 1.09Å | 1.10Å | |
C10 | H102 | sing | 1.09Å | 1.10Å | |
C10 | H103 | sing | 1.09Å | 1.10Å | |
C11 | H111 | sing | 1.09Å | 1.10Å | |
C11 | H112 | sing | 1.09Å | 1.10Å | |
C11 | H113 | sing | 1.09Å | 1.10Å | |
C12 | C13 | sing | 1.50Å | 1.53Å | |
C12 | H12 | sing | 1.09Å | 1.08Å | |
C13 | O2 | sing | 1.42Å | 1.43Å | |
C13 | C14 | sing | 1.53Å | 1.53Å | |
C13 | H13 | sing | 1.10Å | 1.10Å | |
C14 | C15 | sing | 1.54Å | 1.54Å | |
C14 | H141 | sing | 1.10Å | 1.10Å | |
C14 | H142 | sing | 1.10Å | 1.10Å | |
C15 | C16 | sing | 1.54Å | 1.54Å | |
C15 | H15 | sing | 1.10Å | 1.10Å | |
C16 | C17 | sing | 1.53Å | 1.54Å | |
C16 | H161 | sing | 1.10Å | 1.10Å | |
C16 | H162 | sing | 1.10Å | 1.10Å | |
C17 | C18 | sing | 1.54Å | 1.54Å | |
C17 | O3 | sing | 1.42Å | 1.43Å | |
C17 | H17 | sing | 1.10Å | 1.10Å | |
C18 | C19 | sing | 1.56Å | 1.56Å | |
C18 | H18 | sing | 1.10Å | 1.10Å | |
C19 | H19 | sing | 1.10Å | 1.10Å | |
C20 | C21 | sing | 1.53Å | 1.53Å | |
C20 | C22 | sing | 1.55Å | 1.54Å | |
C20 | H20 | sing | 1.10Å | 1.10Å | |
C21 | H211 | sing | 1.10Å | 1.10Å | |
C21 | H212 | sing | 1.09Å | 1.10Å | |
C21 | H213 | sing | 1.10Å | 1.10Å | |
C22 | C23 | sing | 1.53Å | 1.52Å | |
C22 | H221 | sing | 1.10Å | 1.10Å | |
C22 | H222 | sing | 1.10Å | 1.10Å | |
C23 | C24 | sing | 1.52Å | 1.35Å | |
C23 | H231 | sing | 1.10Å | 1.10Å | |
C23 | H232 | sing | 1.10Å | 1.10Å | |
C24 | O1 | doub | 1.23Å | 1.22Å | |
C24 | N1 | sing | 1.38Å | 1.33Å | |
N1 | HN11 | sing | 1.02Å | 1.00Å | |
N1 | HN12 | sing | 1.01Å | 1.00Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C12 | C1 | C2 | 117.1° | 124.8° |
C12 | C1 | H1 | 121.5° | 117.7° |
C1 | C12 | C13 | 115.1° | 123.5° |
C1 | C12 | H12 | 122.5° | 118.7° |
C2 | C1 | H1 | 121.4° | 117.5° |
C1 | C2 | C11 | 106.1° | 106.5° |
C1 | C2 | C15 | 110.5° | 109.8° |
C1 | C2 | C19 | 110.5° | 109.8° |
C11 | C2 | C15 | 110.4° | 108.2° |
C11 | C2 | C19 | 111.3° | 111.8° |
C2 | C11 | H111 | 109.5° | 110.6° |
C2 | C11 | H112 | 109.5° | 110.6° |
C2 | C11 | H113 | 109.5° | 110.6° |
C15 | C2 | C19 | 108.1° | 110.6° |
C2 | C15 | C14 | 113.5° | 111.7° |
C2 | C15 | C16 | 113.9° | 113.2° |
C2 | C15 | H15 | 103.1° | 107.7° |
C2 | C19 | C3 | 114.3° | 113.8° |
C2 | C19 | C18 | 113.7° | 112.2° |
C2 | C19 | H19 | 104.5° | 106.8° |
C19 | C3 | C4 | 113.2° | 114.1° |
C19 | C3 | H31 | 108.2° | 109.3° |
C19 | C3 | H32 | 107.4° | 109.3° |
C3 | C19 | C18 | 114.2° | 111.5° |
C3 | C19 | H19 | 103.9° | 105.4° |
C4 | C3 | H31 | 108.2° | 107.9° |
C4 | C3 | H32 | 107.4° | 108.9° |
C3 | C4 | O4 | 105.2° | 107.3° |
C3 | C4 | C5 | 110.9° | 111.1° |
C3 | C4 | H4 | 112.9° | 109.5° |
H31 | C3 | H32 | 112.4° | 107.2° |
O4 | C4 | C5 | 113.7° | 111.8° |
O4 | C4 | H4 | 110.1° | 106.7° |
C4 | O4 | HO4 | 109.5° | 106.5° |
C5 | C4 | H4 | 104.3° | 110.2° |
C4 | C5 | C10 | 109.8° | 108.8° |
C4 | C5 | C6 | 106.0° | 108.5° |
C4 | C5 | C9 | 122.2° | 116.5° |
C10 | C5 | C6 | 112.3° | 113.6° |
C10 | C5 | C9 | 105.3° | 110.5° |
C5 | C10 | H101 | 109.5° | 110.5° |
C5 | C10 | H102 | 109.5° | 110.6° |
C5 | C10 | H103 | 109.5° | 110.6° |
C6 | C5 | C9 | 101.1° | 98.7° |
C5 | C6 | C18 | 113.6° | 113.3° |
C5 | C6 | C7 | 107.2° | 103.7° |
C5 | C6 | H6 | 113.2° | 108.3° |
C5 | C9 | C8 | 110.9° | 103.8° |
C5 | C9 | C20 | 127.5° | 116.4° |
C5 | C9 | H9 | 102.1° | 109.4° |
C18 | C6 | C7 | 120.4° | 118.4° |
C18 | C6 | H6 | 97.0° | 106.8° |
C6 | C18 | C17 | 112.4° | 112.2° |
C6 | C18 | C19 | 108.9° | 109.0° |
C6 | C18 | H18 | 108.5° | 108.6° |
C7 | C6 | H6 | 104.8° | 105.9° |
C6 | C7 | C8 | 103.3° | 104.4° |
C6 | C7 | H71 | 111.6° | 112.1° |
C6 | C7 | H72 | 112.9° | 111.3° |
C8 | C7 | H71 | 111.6° | 111.3° |
C8 | C7 | H72 | 112.9° | 110.1° |
C7 | C8 | C9 | 105.0° | 106.1° |
C7 | C8 | H81 | 111.0° | 109.8° |
C7 | C8 | H82 | 112.0° | 111.2° |
H71 | C7 | H72 | 104.8° | 107.8° |
C9 | C8 | H81 | 111.0° | 111.6° |
C9 | C8 | H82 | 111.9° | 110.6° |
C8 | C9 | C20 | 121.4° | 113.0° |
C8 | C9 | H9 | 136.6° | 107.3° |
H81 | C8 | H82 | 106.1° | 107.6° |
C20 | C9 | H9 | 39.8° | 106.6° |
C9 | C20 | C21 | 113.7° | 110.0° |
C9 | C20 | C22 | 115.3° | 110.0° |
C9 | C20 | H20 | 101.4° | 108.0° |
H101 | C10 | H102 | 109.5° | 108.3° |
H101 | C10 | H103 | 109.5° | 108.3° |
H102 | C10 | H103 | 109.5° | 108.4° |
H111 | C11 | H112 | 109.4° | 108.4° |
H111 | C11 | H113 | 109.4° | 108.3° |
H112 | C11 | H113 | 109.5° | 108.4° |
C13 | C12 | H12 | 122.4° | 117.8° |
C12 | C13 | O2 | 108.7° | 108.7° |
C12 | C13 | C14 | 110.8° | 112.6° |
C12 | C13 | H13 | 108.6° | 108.8° |
O2 | C13 | C14 | 107.9° | 109.1° |
O2 | C13 | H13 | 111.5° | 107.4° |
C13 | O2 | HO2 | 109.5° | 106.5° |
C14 | C13 | H13 | 109.4° | 110.1° |
C13 | C14 | C15 | 112.0° | 111.1° |
C13 | C14 | H141 | 108.6° | 108.7° |
C13 | C14 | H142 | 108.1° | 109.8° |
C15 | C14 | H141 | 108.6° | 110.5° |
C15 | C14 | H142 | 108.1° | 111.3° |
C14 | C15 | C16 | 108.7° | 112.2° |
C14 | C15 | H15 | 108.9° | 105.7° |
H141 | C14 | H142 | 111.5° | 105.3° |
C16 | C15 | H15 | 108.4° | 105.7° |
C15 | C16 | C17 | 114.6° | 115.3° |
C15 | C16 | H161 | 107.8° | 107.7° |
C15 | C16 | H162 | 106.6° | 109.4° |
C17 | C16 | H161 | 107.8° | 107.8° |
C17 | C16 | H162 | 106.6° | 109.8° |
C16 | C17 | C18 | 113.7° | 112.4° |
C16 | C17 | O3 | 108.3° | 110.0° |
C16 | C17 | H17 | 107.7° | 107.4° |
H161 | C16 | H162 | 113.6° | 106.4° |
C18 | C17 | O3 | 110.3° | 112.8° |
C18 | C17 | H17 | 105.6° | 108.4° |
C17 | C18 | C19 | 111.3° | 112.3° |
C17 | C18 | H18 | 106.0° | 106.9° |
O3 | C17 | H17 | 111.2° | 105.3° |
C17 | O3 | HO3 | 109.5° | 106.5° |
C19 | C18 | H18 | 109.7° | 107.6° |
C18 | C19 | H19 | 104.7° | 106.6° |
C21 | C20 | C22 | 107.7° | 112.1° |
C21 | C20 | H20 | 110.1° | 107.7° |
C20 | C21 | H211 | 109.5° | 110.5° |
C20 | C21 | H212 | 109.5° | 111.7° |
C20 | C21 | H213 | 109.5° | 111.2° |
C22 | C20 | H20 | 108.3° | 109.0° |
C20 | C22 | C23 | 114.9° | 115.2° |
C20 | C22 | H221 | 107.7° | 108.9° |
C20 | C22 | H222 | 106.5° | 108.8° |
H211 | C21 | H212 | 109.4° | 107.1° |
H211 | C21 | H213 | 109.5° | 107.9° |
H212 | C21 | H213 | 109.5° | 108.2° |
C23 | C22 | H221 | 107.7° | 109.0° |
C23 | C22 | H222 | 106.4° | 108.2° |
C22 | C23 | C24 | 123.2° | 113.7° |
C22 | C23 | H231 | 105.1° | 108.6° |
C22 | C23 | H232 | 101.9° | 111.1° |
H221 | C22 | H222 | 113.8° | 106.3° |
C24 | C23 | H231 | 105.1° | 106.7° |
C24 | C23 | H232 | 101.9° | 109.7° |
C23 | C24 | O1 | 121.8° | 123.9° |
C23 | C24 | N1 | 117.8° | 112.4° |
H231 | C23 | H232 | 121.0° | 106.8° |
O1 | C24 | N1 | 120.4° | 123.7° |
C24 | N1 | HN11 | 112.3° | 119.6° |
C24 | N1 | HN12 | 123.8° | 120.9° |
HN11 | N1 | HN12 | 123.9° | 119.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C12 | C1 | C2 | H1 | 180.0° | 178.7° |
C12 | C1 | C2 | C11 | 161.5° | 130.3° |
C12 | C1 | C2 | C15 | 41.8° | 13.3° |
C12 | C1 | C2 | C19 | 77.8° | 108.5° |
C1 | C12 | C13 | H12 | 180.0° | 179.2° |
C1 | C12 | C13 | O2 | 165.9° | 135.4° |
C1 | C12 | C13 | C14 | 47.5° | 14.4° |
C1 | C12 | C13 | H13 | 72.6° | 107.9° |
C1 | C2 | C11 | C15 | 119.8° | 118.1° |
C1 | C2 | C11 | C19 | 120.2° | 119.9° |
C1 | C2 | C15 | C19 | 121.0° | 121.3° |
C1 | C2 | C19 | C3 | 48.3° | 58.2° |
C1 | C2 | C11 | H111 | 175.7° | 115.5° |
C1 | C2 | C11 | H112 | 64.3° | 124.4° |
C1 | C2 | C11 | H113 | 55.7° | 4.4° |
C2 | C1 | C12 | C13 | 42.6° | 1.3° |
C2 | C1 | C12 | H12 | 137.4° | 177.9° |
C1 | C2 | C15 | C14 | 49.1° | 43.2° |
C1 | C2 | C15 | C16 | 174.2° | 171.0° |
C1 | C2 | C15 | H15 | 68.5° | 72.5° |
C1 | C2 | C19 | C18 | 178.1° | 174.1° |
C1 | C2 | C19 | H19 | 64.5° | 57.7° |
H1 | C1 | C2 | C11 | 18.6° | 48.4° |
H1 | C1 | C2 | C15 | 138.3° | 165.4° |
H1 | C1 | C2 | C19 | 102.2° | 72.8° |
H1 | C1 | C12 | C13 | 137.5° | 180.0° |
H1 | C1 | C12 | H12 | 42.6° | 0.7° |
C11 | C2 | C15 | C19 | 121.9° | 122.8° |
C11 | C2 | C19 | C3 | 69.3° | 59.8° |
C2 | C11 | H111 | H112 | 120.0° | 121.4° |
C2 | C11 | H111 | H113 | 120.0° | 121.3° |
C2 | C11 | H112 | H113 | 120.0° | 121.4° |
C11 | C2 | C15 | C14 | 166.2° | 159.1° |
C11 | C2 | C15 | C16 | 68.7° | 73.1° |
C11 | C2 | C15 | H15 | 48.6° | 43.4° |
C11 | C2 | C19 | C18 | 64.3° | 68.0° |
C11 | C2 | C19 | H19 | 177.9° | 175.7° |
C15 | C2 | C19 | C3 | 169.4° | 179.6° |
C15 | C2 | C11 | H111 | 55.9° | 2.5° |
C15 | C2 | C11 | H112 | 175.9° | 117.5° |
C15 | C2 | C11 | H113 | 64.1° | 122.4° |
C2 | C15 | C14 | C13 | 57.7° | 60.4° |
C2 | C15 | C14 | C16 | 127.8° | 128.4° |
C2 | C15 | C14 | H15 | 114.2° | 116.9° |
C2 | C15 | C14 | H141 | 177.7° | 178.8° |
C2 | C15 | C14 | H142 | 61.2° | 62.2° |
C2 | C15 | C16 | H15 | 114.1° | 117.7° |
C2 | C15 | C16 | C17 | 49.1° | 49.0° |
C2 | C15 | C16 | H161 | 70.9° | 71.4° |
C2 | C15 | C16 | H162 | 166.9° | 173.3° |
C15 | C2 | C19 | C18 | 57.0° | 52.7° |
C15 | C2 | C19 | H19 | 56.5° | 63.7° |
C2 | C19 | C3 | C18 | 133.4° | 128.1° |
C2 | C19 | C3 | H19 | 113.2° | 116.7° |
C2 | C19 | C3 | C4 | 179.6° | 178.6° |
C2 | C19 | C3 | H31 | 59.6° | 60.6° |
C2 | C19 | C3 | H32 | 62.0° | 56.4° |
C2 | C19 | C18 | C6 | 179.6° | 179.3° |
C19 | C2 | C11 | H111 | 64.1° | 124.6° |
C19 | C2 | C11 | H112 | 55.9° | 4.5° |
C19 | C2 | C11 | H113 | 175.9° | 115.5° |
C19 | C2 | C15 | C14 | 72.0° | 78.2° |
C19 | C2 | C15 | C16 | 53.2° | 49.7° |
C19 | C2 | C15 | H15 | 170.4° | 166.2° |
C2 | C19 | C18 | C17 | 55.2° | 54.3° |
C2 | C19 | C18 | H19 | 113.4° | 116.5° |
C2 | C19 | C18 | H18 | 61.8° | 63.1° |
C19 | C3 | C4 | H31 | 120.0° | 121.6° |
C19 | C3 | C4 | H32 | 118.4° | 122.4° |
C19 | C3 | H31 | H32 | 118.4° | 118.3° |
C19 | C3 | C4 | O4 | 69.4° | 69.8° |
C19 | C3 | C4 | C5 | 54.0° | 52.7° |
C19 | C3 | C4 | H4 | 170.6° | 174.7° |
C3 | C19 | C18 | C6 | 46.6° | 51.7° |
C3 | C19 | C18 | C17 | 171.0° | 176.8° |
C3 | C19 | C18 | H19 | 112.9° | 114.6° |
C3 | C19 | C18 | H18 | 72.0° | 65.8° |
C4 | C3 | H31 | H32 | 118.5° | 117.2° |
C3 | C4 | O4 | C5 | 121.6° | 122.1° |
C3 | C4 | O4 | H4 | 121.9° | 117.3° |
C3 | C4 | C5 | H4 | 121.8° | 121.6° |
C3 | C4 | C5 | C10 | 60.9° | 68.3° |
C3 | C4 | C5 | C6 | 60.6° | 55.8° |
C3 | C4 | C5 | C9 | 175.2° | 165.9° |
C4 | C3 | C19 | C18 | 46.9° | 50.5° |
C4 | C3 | C19 | H19 | 66.4° | 64.7° |
C3 | C4 | O4 | HO4 | 15.1° | 74.9° |
H31 | C3 | C4 | O4 | 50.6° | 51.8° |
H31 | C3 | C4 | C5 | 173.9° | 174.3° |
H31 | C3 | C4 | H4 | 69.4° | 63.7° |
H31 | C3 | C19 | C18 | 166.9° | 171.3° |
H31 | C3 | C19 | H19 | 53.6° | 56.1° |
H32 | C3 | C4 | O4 | 172.3° | 167.8° |
H32 | C3 | C4 | C5 | 64.4° | 69.6° |
H32 | C3 | C4 | H4 | 52.2° | 52.4° |
H32 | C3 | C19 | C18 | 71.5° | 71.7° |
H32 | C3 | C19 | H19 | 175.2° | 173.1° |
O4 | C4 | C5 | H4 | 119.9° | 118.5° |
O4 | C4 | C5 | C10 | 179.2° | 171.8° |
O4 | C4 | C5 | C6 | 57.7° | 64.2° |
O4 | C4 | C5 | C9 | 56.9° | 46.0° |
C4 | C5 | C10 | C6 | 117.6° | 121.0° |
C4 | C5 | C10 | C9 | 133.3° | 129.1° |
C4 | C5 | C6 | C9 | 128.3° | 121.8° |
C4 | C5 | C6 | C18 | 64.4° | 61.2° |
C4 | C5 | C6 | C7 | 160.1° | 169.2° |
C4 | C5 | C6 | H6 | 44.9° | 57.0° |
C4 | C5 | C9 | C8 | 132.7° | 158.5° |
C4 | C5 | C9 | C20 | 53.0° | 76.7° |
C4 | C5 | C9 | H9 | 18.6° | 44.1° |
C4 | C5 | C10 | H101 | 134.5° | 113.1° |
C4 | C5 | C10 | H102 | 14.5° | 126.9° |
C4 | C5 | C10 | H103 | 105.5° | 6.8° |
C5 | C4 | O4 | HO4 | 136.7° | 47.2° |
H4 | C4 | C5 | C10 | 60.9° | 53.3° |
H4 | C4 | C5 | C6 | 177.6° | 177.4° |
H4 | C4 | C5 | C9 | 63.0° | 72.4° |
H4 | C4 | O4 | HO4 | 106.8° | 167.8° |
C10 | C5 | C6 | C9 | 111.8° | 117.0° |
C10 | C5 | C6 | C18 | 55.5° | 60.0° |
C10 | C5 | C6 | C7 | 80.1° | 69.7° |
C10 | C5 | C6 | H6 | 164.8° | 178.2° |
C10 | C5 | C9 | C8 | 101.4° | 76.7° |
C10 | C5 | C9 | C20 | 72.9° | 48.2° |
C10 | C5 | C9 | H9 | 107.3° | 169.0° |
C5 | C10 | H101 | H102 | 120.0° | 121.3° |
C5 | C10 | H101 | H103 | 120.0° | 121.3° |
C5 | C10 | H102 | H103 | 120.0° | 121.4° |
C5 | C6 | C18 | C7 | 129.1° | 121.7° |
C5 | C6 | C18 | H6 | 119.1° | 119.1° |
C5 | C6 | C7 | H6 | 120.6° | 113.9° |
C5 | C6 | C7 | C8 | 36.3° | 33.9° |
C5 | C6 | C7 | H71 | 83.7° | 154.4° |
C5 | C6 | C7 | H72 | 158.6° | 84.8° |
C6 | C5 | C9 | C8 | 15.6° | 42.7° |
C6 | C5 | C9 | C20 | 170.1° | 167.6° |
C6 | C5 | C9 | H9 | 135.7° | 71.6° |
C6 | C5 | C10 | H101 | 107.9° | 7.9° |
C6 | C5 | C10 | H102 | 132.1° | 112.1° |
C6 | C5 | C10 | H103 | 12.1° | 127.8° |
C5 | C6 | C18 | C17 | 178.9° | 175.8° |
C5 | C6 | C18 | C19 | 57.4° | 59.1° |
C5 | C6 | C18 | H18 | 62.0° | 57.8° |
C9 | C5 | C6 | C18 | 167.3° | 177.0° |
C9 | C5 | C6 | C7 | 31.7° | 47.4° |
C9 | C5 | C6 | H6 | 83.4° | 64.8° |
C5 | C9 | C8 | C7 | 5.9° | 23.2° |
C5 | C9 | C8 | C20 | 174.7° | 127.0° |
C5 | C9 | C8 | H9 | 136.9° | 115.8° |
C5 | C9 | C8 | H81 | 114.1° | 96.4° |
C5 | C9 | C8 | H82 | 127.6° | 143.8° |
C5 | C9 | C20 | H9 | 59.6° | 122.3° |
C9 | C5 | C10 | H101 | 1.2° | 117.8° |
C9 | C5 | C10 | H102 | 118.7° | 2.2° |
C9 | C5 | C10 | H103 | 121.2° | 122.3° |
C5 | C9 | C20 | C21 | 32.8° | 57.3° |
C5 | C9 | C20 | C22 | 157.8° | 178.8° |
C5 | C9 | C20 | H20 | 85.4° | 60.0° |
C18 | C6 | C7 | H6 | 107.5° | 119.6° |
C18 | C6 | C7 | C8 | 168.3° | 160.3° |
C18 | C6 | C7 | H71 | 48.2° | 79.1° |
C18 | C6 | C7 | H72 | 69.5° | 41.7° |
C6 | C18 | C17 | C16 | 170.0° | 174.7° |
C6 | C18 | C17 | C19 | 122.4° | 123.3° |
C6 | C18 | C17 | H18 | 118.4° | 119.0° |
C6 | C18 | C17 | O3 | 48.1° | 49.6° |
C6 | C18 | C17 | H17 | 72.1° | 66.7° |
C6 | C18 | C19 | H18 | 118.6° | 117.6° |
C6 | C18 | C19 | H19 | 66.2° | 62.8° |
C6 | C7 | C8 | H71 | 120.0° | 121.1° |
C6 | C7 | C8 | H72 | 122.3° | 119.5° |
C6 | C7 | H71 | H72 | 122.5° | 122.8° |
C6 | C7 | C8 | C9 | 25.0° | 6.4° |
C6 | C7 | C8 | H81 | 95.0° | 127.2° |
C6 | C7 | C8 | H82 | 146.7° | 113.9° |
C7 | C6 | C18 | C17 | 49.8° | 54.1° |
C7 | C6 | C18 | C19 | 173.5° | 179.2° |
C7 | C6 | C18 | H18 | 67.2° | 63.9° |
H6 | C6 | C7 | C8 | 84.2° | 80.0° |
H6 | C6 | C7 | H71 | 155.8° | 40.5° |
H6 | C6 | C7 | H72 | 38.0° | 161.3° |
H6 | C6 | C18 | C17 | 62.0° | 65.1° |
H6 | C6 | C18 | C19 | 61.7° | 60.0° |
H6 | C6 | C18 | H18 | 178.9° | 177.0° |
C8 | C7 | H71 | H72 | 122.5° | 120.8° |
C7 | C8 | C9 | H81 | 120.0° | 119.6° |
C7 | C8 | C9 | H82 | 121.7° | 120.7° |
C7 | C8 | H81 | H82 | 121.8° | 121.2° |
C7 | C8 | C9 | C20 | 168.8° | 150.2° |
C7 | C8 | C9 | H9 | 142.8° | 92.6° |
H71 | C7 | C8 | C9 | 94.9° | 127.5° |
H71 | C7 | C8 | H81 | 145.1° | 111.8° |
H71 | C7 | C8 | H82 | 26.7° | 7.2° |
H72 | C7 | C8 | C9 | 147.3° | 113.1° |
H72 | C7 | C8 | H81 | 27.3° | 7.7° |
H72 | C7 | C8 | H82 | 91.0° | 126.7° |
C9 | C8 | H81 | H82 | 121.8° | 121.5° |
C8 | C9 | C20 | H9 | 126.7° | 117.7° |
C8 | C9 | C20 | C21 | 153.5° | 177.3° |
C8 | C9 | C20 | C22 | 28.5° | 58.8° |
C8 | C9 | C20 | H20 | 88.3° | 60.1° |
H81 | C8 | C9 | C20 | 71.2° | 30.6° |
H81 | C8 | C9 | H9 | 22.8° | 147.8° |
H82 | C8 | C9 | C20 | 47.1° | 89.2° |
H82 | C8 | C9 | H9 | 95.5° | 28.0° |
C9 | C20 | C21 | C22 | 129.1° | 122.7° |
C9 | C20 | C21 | H20 | 113.1° | 117.4° |
C9 | C20 | C22 | H20 | 112.8° | 118.2° |
C9 | C20 | C21 | H211 | 55.6° | 116.0° |
C9 | C20 | C21 | H212 | 175.6° | 124.8° |
C9 | C20 | C21 | H213 | 64.4° | 3.8° |
C9 | C20 | C22 | C23 | 111.4° | 177.2° |
C9 | C20 | C22 | H221 | 8.6° | 60.0° |
C9 | C20 | C22 | H222 | 131.0° | 55.5° |
H9 | C9 | C20 | C21 | 26.8° | 65.0° |
H9 | C9 | C20 | C22 | 98.2° | 58.9° |
H9 | C9 | C20 | H20 | 145.0° | 177.7° |
H101 | C10 | H102 | H103 | 120.0° | 117.3° |
H111 | C11 | H112 | H113 | 119.9° | 117.3° |
C12 | C13 | O2 | C14 | 120.2° | 123.1° |
C12 | C13 | O2 | H13 | 119.7° | 117.5° |
C12 | C13 | C14 | H13 | 119.7° | 121.5° |
C12 | C13 | C14 | C15 | 55.1° | 44.4° |
C12 | C13 | C14 | H141 | 175.1° | 166.3° |
C12 | C13 | C14 | H142 | 63.8° | 79.1° |
C12 | C13 | O2 | HO2 | 54.9° | 164.4° |
H12 | C12 | C13 | O2 | 14.1° | 45.3° |
H12 | C12 | C13 | C14 | 132.4° | 166.4° |
H12 | C12 | C13 | H13 | 107.4° | 71.4° |
O2 | C13 | C14 | H13 | 121.4° | 117.7° |
O2 | C13 | C14 | C15 | 174.0° | 165.2° |
O2 | C13 | C14 | H141 | 66.0° | 72.9° |
O2 | C13 | C14 | H142 | 55.0° | 41.7° |
C13 | C14 | C15 | H141 | 120.0° | 120.7° |
C13 | C14 | C15 | H142 | 118.9° | 122.7° |
C13 | C14 | H141 | H142 | 119.0° | 117.5° |
C13 | C14 | C15 | C16 | 174.4° | 171.2° |
C13 | C14 | C15 | H15 | 56.5° | 56.5° |
C14 | C13 | O2 | HO2 | 175.1° | 41.3° |
H13 | C13 | C14 | C15 | 64.6° | 77.1° |
H13 | C13 | C14 | H141 | 55.4° | 44.7° |
H13 | C13 | C14 | H142 | 176.5° | 159.4° |
H13 | C13 | O2 | HO2 | 64.8° | 78.0° |
C15 | C14 | H141 | H142 | 119.0° | 120.3° |
C14 | C15 | C16 | H15 | 118.2° | 114.8° |
C14 | C15 | C16 | C17 | 78.5° | 78.5° |
C14 | C15 | C16 | H161 | 161.5° | 161.1° |
C14 | C15 | C16 | H162 | 39.3° | 45.8° |
H141 | C14 | C15 | C16 | 54.4° | 50.5° |
H141 | C14 | C15 | H15 | 63.6° | 64.3° |
H142 | C14 | C15 | C16 | 66.7° | 66.1° |
H142 | C14 | C15 | H15 | 175.4° | 179.1° |
C15 | C16 | C17 | H161 | 120.0° | 120.4° |
C15 | C16 | C17 | H162 | 117.7° | 124.1° |
C15 | C16 | H161 | H162 | 117.9° | 117.3° |
C15 | C16 | C17 | C18 | 45.6° | 49.3° |
C15 | C16 | C17 | O3 | 77.4° | 77.4° |
C15 | C16 | C17 | H17 | 162.2° | 168.5° |
H15 | C15 | C16 | C17 | 163.3° | 166.7° |
H15 | C15 | C16 | H161 | 43.3° | 46.3° |
H15 | C15 | C16 | H162 | 79.0° | 69.0° |
C17 | C16 | H161 | H162 | 117.9° | 117.8° |
C16 | C17 | C18 | O3 | 121.9° | 125.1° |
C16 | C17 | C18 | H17 | 117.8° | 118.6° |
C16 | C17 | O3 | H17 | 118.1° | 115.5° |
C16 | C17 | C18 | C19 | 47.6° | 51.4° |
C16 | C17 | C18 | H18 | 71.6° | 66.4° |
C16 | C17 | O3 | HO3 | 71.3° | 36.8° |
H161 | C16 | C17 | C18 | 74.4° | 71.1° |
H161 | C16 | C17 | O3 | 162.6° | 162.3° |
H161 | C16 | C17 | H17 | 42.2° | 48.1° |
H162 | C16 | C17 | C18 | 163.3° | 173.4° |
H162 | C16 | C17 | O3 | 40.3° | 46.7° |
H162 | C16 | C17 | H17 | 80.1° | 67.4° |
C18 | C17 | O3 | H17 | 116.9° | 118.1° |
C17 | C18 | C19 | H18 | 117.0° | 117.4° |
C17 | C18 | C19 | H19 | 58.1° | 62.2° |
C18 | C17 | O3 | HO3 | 53.7° | 163.3° |
O3 | C17 | C18 | C19 | 74.3° | 73.7° |
O3 | C17 | C18 | H18 | 166.5° | 168.6° |
H17 | C17 | C18 | C19 | 165.4° | 170.1° |
H17 | C17 | C18 | H18 | 46.2° | 52.3° |
H17 | C17 | O3 | HO3 | 170.6° | 78.6° |
H18 | C18 | C19 | H19 | 175.1° | 179.6° |
C21 | C20 | C22 | H20 | 119.1° | 119.1° |
C20 | C21 | H211 | H212 | 120.0° | 121.9° |
C20 | C21 | H211 | H213 | 120.0° | 121.7° |
C20 | C21 | H212 | H213 | 120.0° | 122.7° |
C21 | C20 | C22 | C23 | 120.4° | 60.1° |
C21 | C20 | C22 | H221 | 119.6° | 62.7° |
C21 | C20 | C22 | H222 | 2.9° | 178.2° |
C22 | C20 | C21 | H211 | 175.4° | 6.7° |
C22 | C20 | C21 | H212 | 55.4° | 112.5° |
C22 | C20 | C21 | H213 | 64.6° | 126.4° |
C20 | C22 | C23 | H221 | 120.0° | 122.8° |
C20 | C22 | C23 | H222 | 117.6° | 122.0° |
C20 | C22 | H221 | H222 | 117.8° | 117.1° |
C20 | C22 | C23 | C24 | 162.3° | 177.3° |
C20 | C22 | C23 | H231 | 42.3° | 58.7° |
C20 | C22 | C23 | H232 | 84.8° | 58.5° |
H20 | C20 | C21 | H211 | 57.5° | 126.5° |
H20 | C20 | C21 | H212 | 62.5° | 7.4° |
H20 | C20 | C21 | H213 | 177.5° | 113.7° |
H20 | C20 | C22 | C23 | 1.4° | 59.0° |
H20 | C20 | C22 | H221 | 121.4° | 178.2° |
H20 | C20 | C22 | H222 | 116.2° | 62.7° |
H211 | C21 | H212 | H213 | 120.0° | 116.1° |
C23 | C22 | H221 | H222 | 117.8° | 116.4° |
C22 | C23 | C24 | H231 | 120.0° | 119.7° |
C22 | C23 | C24 | H232 | 113.0° | 125.0° |
C22 | C23 | H231 | H232 | 114.4° | 119.8° |
C22 | C23 | C24 | O1 | 1.5° | 1.7° |
C22 | C23 | C24 | N1 | 178.6° | 180.0° |
H221 | C22 | C23 | C24 | 77.8° | 59.9° |
H221 | C22 | C23 | H231 | 162.2° | 178.5° |
H221 | C22 | C23 | H232 | 35.2° | 64.3° |
H222 | C22 | C23 | C24 | 44.7° | 55.3° |
H222 | C22 | C23 | H231 | 75.3° | 63.3° |
H222 | C22 | C23 | H232 | 157.6° | 179.5° |
C24 | C23 | H231 | H232 | 114.3° | 117.2° |
C23 | C24 | O1 | N1 | 179.9° | 178.2° |
C23 | C24 | N1 | HN11 | 0.0° | 0.6° |
C23 | C24 | N1 | HN12 | 180.0° | 179.3° |
H231 | C23 | C24 | O1 | 118.5° | 118.1° |
H231 | C23 | C24 | N1 | 61.4° | 60.3° |
H232 | C23 | C24 | O1 | 114.5° | 126.6° |
H232 | C23 | C24 | N1 | 65.7° | 55.0° |
O1 | C24 | N1 | HN11 | 179.9° | 179.0° |
O1 | C24 | N1 | HN12 | 0.1° | 0.9° |
C24 | N1 | HN11 | HN12 | 180.0° | 179.9° |