FSP
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.53Å | 1.53Å | |
C1 | H11 | sing | 1.09Å | 1.12Å | |
C1 | H12 | sing | 1.09Å | 1.12Å | |
C1 | H13 | sing | 1.09Å | 1.12Å | |
C2 | C3 | sing | 1.53Å | 1.54Å | |
C2 | H21 | sing | 1.09Å | 1.12Å | |
C2 | H22 | sing | 1.09Å | 1.12Å | |
C3 | C4 | sing | 1.53Å | 1.53Å | |
C3 | H31 | sing | 1.09Å | 1.11Å | |
C3 | H32A | sing | 1.09Å | 1.11Å | |
C4 | C5 | sing | 1.53Å | 1.58Å | |
C4 | H41 | sing | 1.09Å | 1.11Å | |
C4 | H42 | sing | 1.09Å | 1.11Å | |
C5 | N6 | sing | 1.46Å | 1.41Å | |
C5 | C23 | sing | 1.51Å | 1.53Å | |
C5 | H5 | sing | 1.09Å | 1.11Å | |
N6 | C7 | sing | 1.35Å | 1.33Å | |
N6 | HN6 | sing | 0.97Å | 1.02Å | |
C7 | O8 | doub | 1.22Å | 1.23Å | |
C7 | O9 | sing | 1.35Å | 1.28Å | |
O9 | C10 | sing | 1.45Å | 1.39Å | |
C10 | C11 | sing | 1.53Å | 1.51Å | |
C10 | H101 | sing | 1.09Å | 1.11Å | |
C10 | H102 | sing | 1.09Å | 1.12Å | |
C11 | C12 | sing | 1.53Å | 1.58Å | |
C11 | C20 | sing | 1.54Å | 1.52Å | |
C11 | C22 | sing | 1.54Å | 1.52Å | |
C12 | C13 | sing | 1.51Å | 1.52Å | |
C12 | H121 | sing | 1.09Å | 1.12Å | |
C12 | H122 | sing | 1.09Å | 1.12Å | |
C13 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
C13 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
C14 | H14 | sing | 1.08Å | 1.10Å | |
C15 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
C15 | H15 | sing | 1.08Å | 1.10Å | |
C16 | F17 | sing | 1.35Å | 1.33Å | |
C16 | C18 | sing | 1.39Å | 1.39Å | Aromatic |
C18 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
C18 | H18 | sing | 1.08Å | 1.10Å | |
C19 | H19 | sing | 1.08Å | 1.10Å | |
C20 | C21 | sing | 1.54Å | 1.53Å | |
C20 | H201 | sing | 1.09Å | 1.12Å | |
C20 | H202 | sing | 1.09Å | 1.11Å | |
C21 | C22 | sing | 1.54Å | 1.54Å | |
C21 | H211 | sing | 1.09Å | 1.12Å | |
C21 | H212 | sing | 1.09Å | 1.12Å | |
C22 | H221 | sing | 1.09Å | 1.12Å | |
C22 | H222 | sing | 1.09Å | 1.11Å | |
C25 | O26 | doub | 1.21Å | 1.23Å | |
C25 | N27 | sing | 1.35Å | 1.35Å | |
C25 | C23 | sing | 1.49Å | 1.50Å | |
N27 | C28 | sing | 1.39Å | 1.35Å | |
N27 | H27 | sing | 0.97Å | 1.02Å | |
C28 | C29 | doub | 1.36Å | 1.37Å | Aromatic |
C28 | N32 | sing | 1.36Å | 1.37Å | Aromatic |
C29 | C30 | sing | 1.40Å | 1.36Å | Aromatic |
C29 | H29 | sing | 1.08Å | 1.10Å | |
C30 | N31 | doub | 1.31Å | 1.40Å | Aromatic |
C30 | H30 | sing | 1.08Å | 1.10Å | |
N31 | N32 | sing | 1.40Å | 1.38Å | Aromatic |
N32 | H32 | sing | 0.97Å | 1.02Å | |
C23 | O24 | doub | 1.21Å | 1.33Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | H11 | 112.1° | 109.5° |
C2 | C1 | H12 | 109.8° | 109.5° |
C2 | C1 | H13 | 112.1° | 109.5° |
C1 | C2 | C3 | 109.8° | 109.4° |
C1 | C2 | H21 | 112.1° | 109.5° |
C1 | C2 | H22 | 112.1° | 109.4° |
H11 | C1 | H12 | 112.1° | 109.5° |
H11 | C1 | H13 | 98.4° | 109.4° |
H12 | C1 | H13 | 112.0° | 109.5° |
C3 | C2 | H21 | 112.1° | 109.5° |
C3 | C2 | H22 | 112.1° | 109.5° |
C2 | C3 | C4 | 109.6° | 109.4° |
C2 | C3 | H31 | 112.1° | 109.5° |
C2 | C3 | H32A | 112.1° | 109.5° |
H21 | C2 | H22 | 98.4° | 109.5° |
C4 | C3 | H31 | 112.2° | 109.5° |
C4 | C3 | H32A | 112.2° | 109.5° |
C3 | C4 | C5 | 111.7° | 109.4° |
C3 | C4 | H41 | 111.4° | 109.5° |
C3 | C4 | H42 | 111.4° | 109.5° |
H31 | C3 | H32A | 98.3° | 109.5° |
C5 | C4 | H41 | 111.4° | 109.5° |
C5 | C4 | H42 | 111.4° | 109.4° |
C4 | C5 | N6 | 108.5° | 109.5° |
C4 | C5 | C23 | 105.8° | 109.5° |
C4 | C5 | H5 | 112.1° | 109.5° |
H41 | C4 | H42 | 99.0° | 109.5° |
N6 | C5 | C23 | 108.6° | 109.4° |
N6 | C5 | H5 | 109.6° | 109.5° |
C5 | N6 | C7 | 120.0° | 120.0° |
C5 | N6 | HN6 | 123.0° | 120.0° |
C23 | C5 | H5 | 112.1° | 109.5° |
C5 | C23 | C25 | 113.8° | 120.0° |
C5 | C23 | O24 | 120.6° | 120.0° |
C7 | N6 | HN6 | 117.0° | 119.9° |
N6 | C7 | O8 | 120.2° | 119.9° |
N6 | C7 | O9 | 118.9° | 120.0° |
O8 | C7 | O9 | 120.9° | 120.0° |
C7 | O9 | C10 | 113.1° | 120.0° |
O9 | C10 | C11 | 107.1° | 109.5° |
O9 | C10 | H101 | 113.1° | 109.5° |
O9 | C10 | H102 | 113.1° | 109.4° |
C11 | C10 | H101 | 113.1° | 109.5° |
C11 | C10 | H102 | 113.1° | 109.5° |
C10 | C11 | C12 | 113.4° | 112.9° |
C10 | C11 | C20 | 112.3° | 113.6° |
C10 | C11 | C22 | 111.2° | 113.6° |
H101 | C10 | H102 | 97.4° | 109.5° |
C12 | C11 | C20 | 114.0° | 113.6° |
C12 | C11 | C22 | 112.6° | 113.7° |
C11 | C12 | C13 | 110.1° | 109.5° |
C11 | C12 | H121 | 112.0° | 109.5° |
C11 | C12 | H122 | 112.0° | 109.4° |
C20 | C11 | C22 | 91.5° | 87.1° |
C11 | C20 | C21 | 89.3° | 87.1° |
C11 | C20 | H201 | 120.3° | 113.6° |
C11 | C20 | H202 | 120.3° | 113.7° |
C11 | C22 | C21 | 89.1° | 87.1° |
C11 | C22 | H221 | 120.4° | 113.6° |
C11 | C22 | H222 | 120.4° | 113.6° |
C13 | C12 | H121 | 112.0° | 109.5° |
C13 | C12 | H122 | 112.0° | 109.5° |
C12 | C13 | C14 | 120.3° | 119.9° |
C12 | C13 | C19 | 120.0° | 120.0° |
H121 | C12 | H122 | 98.4° | 109.5° |
C14 | C13 | C19 | 119.7° | 120.1° |
C13 | C14 | C15 | 119.9° | 120.0° |
C13 | C14 | H14 | 120.6° | 120.0° |
C13 | C19 | C18 | 120.2° | 120.1° |
C13 | C19 | H19 | 120.1° | 120.0° |
C15 | C14 | H14 | 119.5° | 120.0° |
C14 | C15 | C16 | 119.8° | 119.9° |
C14 | C15 | H15 | 120.3° | 120.0° |
C16 | C15 | H15 | 120.0° | 120.1° |
C15 | C16 | F17 | 120.1° | 120.0° |
C15 | C16 | C18 | 120.2° | 120.0° |
F17 | C16 | C18 | 119.7° | 120.0° |
C16 | C18 | C19 | 120.3° | 120.0° |
C16 | C18 | H18 | 120.3° | 120.0° |
C19 | C18 | H18 | 119.5° | 120.0° |
C18 | C19 | H19 | 119.8° | 119.9° |
C21 | C20 | H201 | 120.3° | 113.6° |
C21 | C20 | H202 | 120.3° | 113.6° |
C20 | C21 | C22 | 89.9° | 87.1° |
C20 | C21 | H211 | 120.0° | 113.6° |
C20 | C21 | H212 | 120.0° | 113.6° |
H201 | C20 | H202 | 89.7° | 112.9° |
C22 | C21 | H211 | 120.0° | 113.6° |
C22 | C21 | H212 | 120.0° | 113.6° |
C21 | C22 | H221 | 120.4° | 113.6° |
C21 | C22 | H222 | 120.4° | 113.6° |
H211 | C21 | H212 | 90.0° | 112.9° |
H221 | C22 | H222 | 89.6° | 112.9° |
O26 | C25 | N27 | 121.4° | 120.1° |
O26 | C25 | C23 | 120.9° | 120.0° |
N27 | C25 | C23 | 117.6° | 120.0° |
C25 | N27 | C28 | 122.5° | 120.0° |
C25 | N27 | H27 | 118.7° | 120.0° |
C25 | C23 | O24 | 118.9° | 120.0° |
C28 | N27 | H27 | 118.8° | 120.0° |
N27 | C28 | C29 | 124.7° | 126.2° |
N27 | C28 | N32 | 123.5° | 126.3° |
C29 | C28 | N32 | 111.8° | 107.5° |
C28 | C29 | C30 | 106.5° | 107.8° |
C28 | C29 | H29 | 126.8° | 126.1° |
C28 | N32 | N31 | 104.8° | 107.8° |
C28 | N32 | H32 | 127.3° | 126.1° |
C30 | C29 | H29 | 126.6° | 126.1° |
C29 | C30 | N31 | 107.6° | 108.5° |
C29 | C30 | H30 | 125.2° | 125.8° |
N31 | C30 | H30 | 127.2° | 125.8° |
C30 | N31 | N32 | 109.3° | 108.4° |
N31 | N32 | H32 | 127.8° | 126.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | H11 | H12 | 124.0° | 120.1° |
C2 | C1 | H11 | H13 | 118.0° | 120.0° |
C2 | C1 | H12 | H13 | 125.2° | 120.0° |
C1 | C2 | C3 | H21 | 125.3° | 120.0° |
C1 | C2 | C3 | H22 | 125.3° | 119.9° |
C1 | C2 | H21 | H22 | 118.0° | 120.0° |
C1 | C2 | C3 | C4 | 60.3° | 180.0° |
C1 | C2 | C3 | H31 | 64.9° | 60.0° |
C1 | C2 | C3 | H32A | 174.4° | 60.0° |
H11 | C1 | H12 | H13 | 109.5° | 119.9° |
H11 | C1 | C2 | C3 | 54.7° | 59.9° |
H11 | C1 | C2 | H21 | 70.5° | 179.9° |
H11 | C1 | C2 | H22 | 180.0° | 60.0° |
H12 | C1 | C2 | C3 | 180.0° | 180.0° |
H12 | C1 | C2 | H21 | 54.8° | 60.0° |
H12 | C1 | C2 | H22 | 54.7° | 60.0° |
H13 | C1 | C2 | C3 | 54.7° | 60.0° |
H13 | C1 | C2 | H21 | 180.0° | 60.0° |
H13 | C1 | C2 | H22 | 70.5° | 180.0° |
C3 | C2 | H21 | H22 | 118.0° | 120.1° |
C2 | C3 | C4 | H31 | 125.2° | 120.0° |
C2 | C3 | C4 | H32A | 125.3° | 120.0° |
C2 | C3 | H31 | H32A | 118.0° | 120.1° |
C2 | C3 | C4 | C5 | 164.4° | 180.0° |
C2 | C3 | C4 | H41 | 39.2° | 60.0° |
C2 | C3 | C4 | H42 | 70.3° | 60.0° |
H21 | C2 | C3 | C4 | 174.4° | 60.0° |
H21 | C2 | C3 | H31 | 60.3° | 180.0° |
H21 | C2 | C3 | H32A | 49.2° | 60.0° |
H22 | C2 | C3 | C4 | 64.9° | 60.1° |
H22 | C2 | C3 | H31 | 169.8° | 59.9° |
H22 | C2 | C3 | H32A | 60.3° | 179.9° |
C4 | C3 | H31 | H32A | 118.1° | 120.0° |
C3 | C4 | C5 | H41 | 125.2° | 120.0° |
C3 | C4 | C5 | H42 | 125.3° | 120.0° |
C3 | C4 | H41 | H42 | 117.3° | 120.0° |
C3 | C4 | C5 | N6 | 43.4° | 65.0° |
C3 | C4 | C5 | C23 | 159.7° | 175.0° |
C3 | C4 | C5 | H5 | 77.8° | 55.0° |
H31 | C3 | C4 | C5 | 70.3° | 60.0° |
H31 | C3 | C4 | H41 | 164.4° | 180.0° |
H31 | C3 | C4 | H42 | 55.0° | 60.0° |
H32A | C3 | C4 | C5 | 39.2° | 60.0° |
H32A | C3 | C4 | H41 | 86.1° | 60.0° |
H32A | C3 | C4 | H42 | 164.4° | 180.0° |
C5 | C4 | H41 | H42 | 117.3° | 120.0° |
C4 | C5 | N6 | C23 | 114.5° | 120.0° |
C4 | C5 | N6 | H5 | 122.7° | 120.0° |
C4 | C5 | C23 | H5 | 122.5° | 120.0° |
C4 | C5 | N6 | C7 | 127.3° | 85.0° |
C4 | C5 | N6 | HN6 | 52.7° | 95.0° |
C4 | C5 | C23 | C25 | 57.8° | 75.0° |
C4 | C5 | C23 | O24 | 93.3° | 105.0° |
H41 | C4 | C5 | N6 | 81.9° | 175.0° |
H41 | C4 | C5 | C23 | 34.5° | 55.1° |
H41 | C4 | C5 | H5 | 157.0° | 65.0° |
H42 | C4 | C5 | N6 | 168.6° | 55.0° |
H42 | C4 | C5 | C23 | 75.0° | 65.0° |
H42 | C4 | C5 | H5 | 47.5° | 175.0° |
N6 | C5 | C23 | H5 | 121.2° | 120.0° |
C5 | N6 | C7 | HN6 | 180.0° | 180.0° |
C5 | N6 | C7 | O8 | 25.6° | 0.0° |
C5 | N6 | C7 | O9 | 153.6° | 180.0° |
N6 | C5 | C23 | C25 | 174.1° | 165.0° |
N6 | C5 | C23 | O24 | 23.0° | 15.0° |
C23 | C5 | N6 | C7 | 118.2° | 155.0° |
C23 | C5 | N6 | HN6 | 61.8° | 25.0° |
C5 | C23 | C25 | O26 | 49.1° | 0.0° |
C5 | C23 | C25 | N27 | 127.0° | 180.0° |
C5 | C23 | C25 | O24 | 151.6° | 180.0° |
H5 | C5 | N6 | C7 | 4.6° | 35.0° |
H5 | C5 | N6 | HN6 | 175.4° | 145.0° |
H5 | C5 | C23 | C25 | 64.8° | 45.0° |
H5 | C5 | C23 | O24 | 144.2° | 135.0° |
N6 | C7 | O8 | O9 | 179.2° | 180.0° |
N6 | C7 | O9 | C10 | 174.2° | 180.0° |
HN6 | N6 | C7 | O8 | 154.4° | 180.0° |
HN6 | N6 | C7 | O9 | 26.4° | 0.0° |
O8 | C7 | O9 | C10 | 6.6° | 0.0° |
C7 | O9 | C10 | C11 | 154.6° | 180.0° |
C7 | O9 | C10 | H101 | 80.1° | 60.0° |
C7 | O9 | C10 | H102 | 29.4° | 60.0° |
O9 | C10 | C11 | H101 | 125.3° | 120.0° |
O9 | C10 | C11 | H102 | 125.3° | 120.0° |
O9 | C10 | H101 | H102 | 119.0° | 120.0° |
O9 | C10 | C11 | C12 | 63.1° | 54.2° |
O9 | C10 | C11 | C20 | 165.9° | 174.6° |
O9 | C10 | C11 | C22 | 65.0° | 77.1° |
C11 | C10 | H101 | H102 | 119.0° | 120.0° |
C10 | C11 | C12 | C20 | 130.1° | 131.2° |
C10 | C11 | C12 | C22 | 127.3° | 131.3° |
C10 | C11 | C20 | C22 | 113.7° | 114.6° |
C10 | C11 | C12 | C13 | 44.8° | 64.7° |
C10 | C11 | C12 | H121 | 80.4° | 175.3° |
C10 | C11 | C12 | H122 | 170.1° | 55.3° |
C10 | C11 | C20 | C21 | 110.9° | 140.0° |
C10 | C11 | C20 | H201 | 14.4° | 105.5° |
C10 | C11 | C20 | H202 | 123.9° | 25.4° |
C10 | C11 | C22 | C21 | 111.9° | 140.0° |
C10 | C11 | C22 | H221 | 122.9° | 25.4° |
C10 | C11 | C22 | H222 | 13.4° | 105.4° |
H101 | C10 | C11 | C12 | 171.6° | 65.8° |
H101 | C10 | C11 | C20 | 40.6° | 65.4° |
H101 | C10 | C11 | C22 | 60.3° | 162.9° |
H102 | C10 | C11 | C12 | 62.1° | 174.2° |
H102 | C10 | C11 | C20 | 68.8° | 54.6° |
H102 | C10 | C11 | C22 | 169.8° | 42.9° |
C12 | C11 | C20 | C22 | 115.7° | 114.6° |
C11 | C12 | C13 | H121 | 125.3° | 120.0° |
C11 | C12 | C13 | H122 | 125.3° | 119.9° |
C11 | C12 | H121 | H122 | 117.9° | 119.9° |
C11 | C12 | C13 | C14 | 108.6° | 91.0° |
C11 | C12 | C13 | C19 | 71.3° | 89.3° |
C12 | C11 | C20 | C21 | 118.5° | 89.2° |
C12 | C11 | C20 | H201 | 116.2° | 25.4° |
C12 | C11 | C20 | H202 | 6.8° | 156.2° |
C12 | C11 | C22 | C21 | 119.6° | 89.1° |
C12 | C11 | C22 | H221 | 5.6° | 156.3° |
C12 | C11 | C22 | H222 | 115.1° | 25.5° |
C20 | C11 | C12 | C13 | 85.3° | 66.5° |
C20 | C11 | C12 | H121 | 149.5° | 53.5° |
C20 | C11 | C12 | H122 | 40.0° | 173.5° |
C11 | C20 | C21 | H201 | 125.3° | 114.5° |
C11 | C20 | C21 | H202 | 125.2° | 114.6° |
C11 | C20 | H201 | H202 | 125.5° | 131.2° |
C20 | C11 | C22 | C21 | 2.8° | 25.4° |
C11 | C20 | C21 | H211 | 122.5° | 89.1° |
C11 | C20 | C21 | H212 | 128.0° | 140.0° |
C20 | C11 | C22 | H221 | 122.5° | 89.1° |
C20 | C11 | C22 | H222 | 128.0° | 140.0° |
C22 | C11 | C12 | C13 | 172.2° | 164.0° |
C22 | C11 | C12 | H121 | 46.9° | 44.0° |
C22 | C11 | C12 | H122 | 62.6° | 76.0° |
C22 | C11 | C20 | H201 | 128.1° | 140.0° |
C22 | C11 | C20 | H202 | 122.5° | 89.2° |
C11 | C22 | C21 | H221 | 125.3° | 114.5° |
C11 | C22 | C21 | H222 | 125.3° | 114.5° |
C11 | C22 | C21 | H211 | 122.5° | 89.1° |
C11 | C22 | C21 | H212 | 128.0° | 140.0° |
C11 | C22 | H221 | H222 | 125.6° | 131.2° |
C13 | C12 | H121 | H122 | 117.9° | 120.1° |
C12 | C13 | C14 | C19 | 179.9° | 179.7° |
C12 | C13 | C14 | C15 | 179.8° | 180.0° |
C12 | C13 | C14 | H14 | 0.2° | 0.0° |
C12 | C13 | C19 | C18 | 179.8° | 179.7° |
C12 | C13 | C19 | H19 | 0.2° | 0.2° |
H121 | C12 | C13 | C14 | 16.6° | 29.0° |
H121 | C12 | C13 | C19 | 163.5° | 150.8° |
H122 | C12 | C13 | C14 | 126.1° | 149.0° |
H122 | C12 | C13 | C19 | 54.0° | 30.7° |
C13 | C14 | C15 | H14 | 180.0° | 179.9° |
C13 | C14 | C15 | C16 | 0.1° | 0.0° |
C13 | C14 | C15 | H15 | 179.9° | 179.9° |
C14 | C13 | C19 | C18 | 0.1° | 0.5° |
C14 | C13 | C19 | H19 | 179.8° | 179.9° |
C19 | C13 | C14 | C15 | 0.1° | 0.3° |
C19 | C13 | C14 | H14 | 179.9° | 179.8° |
C13 | C19 | C18 | C16 | 0.0° | 0.5° |
C13 | C19 | C18 | H19 | 180.0° | 179.6° |
C13 | C19 | C18 | H18 | 179.9° | 179.8° |
C14 | C15 | C16 | H15 | 180.0° | 179.9° |
C14 | C15 | C16 | F17 | 179.8° | 180.0° |
C14 | C15 | C16 | C18 | 0.2° | 0.0° |
H14 | C14 | C15 | C16 | 179.9° | 179.9° |
H14 | C14 | C15 | H15 | 0.1° | 0.0° |
C15 | C16 | F17 | C18 | 180.0° | 179.9° |
C15 | C16 | C18 | C19 | 0.2° | 0.2° |
C15 | C16 | C18 | H18 | 179.8° | 179.9° |
H15 | C15 | C16 | F17 | 0.2° | 0.1° |
H15 | C15 | C16 | C18 | 179.8° | 180.0° |
F17 | C16 | C18 | C19 | 179.8° | 179.7° |
F17 | C16 | C18 | H18 | 0.2° | 0.0° |
C16 | C18 | C19 | H18 | 180.0° | 179.7° |
C16 | C18 | C19 | H19 | 180.0° | 179.9° |
H18 | C18 | C19 | H19 | 0.0° | 0.2° |
C21 | C20 | H201 | H202 | 125.5° | 131.2° |
C20 | C21 | C22 | H211 | 125.3° | 114.6° |
C20 | C21 | C22 | H212 | 125.3° | 114.5° |
C20 | C21 | H211 | H212 | 125.3° | 131.2° |
C20 | C21 | C22 | H221 | 122.5° | 89.1° |
C20 | C21 | C22 | H222 | 128.0° | 140.0° |
H201 | C20 | C21 | C22 | 128.0° | 140.0° |
H201 | C20 | C21 | H211 | 2.8° | 25.4° |
H201 | C20 | C21 | H212 | 106.7° | 105.5° |
H202 | C20 | C21 | C22 | 122.5° | 89.2° |
H202 | C20 | C21 | H211 | 112.2° | 156.3° |
H202 | C20 | C21 | H212 | 2.8° | 25.4° |
C22 | C21 | H211 | H212 | 125.3° | 131.3° |
C21 | C22 | H221 | H222 | 125.6° | 131.3° |
H211 | C21 | C22 | H221 | 112.2° | 156.3° |
H211 | C21 | C22 | H222 | 2.8° | 25.4° |
H212 | C21 | C22 | H221 | 2.8° | 25.5° |
H212 | C21 | C22 | H222 | 106.7° | 105.5° |
O26 | C25 | N27 | C23 | 176.1° | 180.0° |
O26 | C25 | N27 | C28 | 3.2° | 0.0° |
O26 | C25 | N27 | H27 | 176.8° | 180.0° |
O26 | C25 | C23 | O24 | 159.3° | 180.0° |
C25 | N27 | C28 | H27 | 180.0° | 179.9° |
C25 | N27 | C28 | C29 | 66.9° | 0.3° |
C25 | N27 | C28 | N32 | 113.6° | 180.0° |
N27 | C25 | C23 | O24 | 24.6° | 0.0° |
C23 | C25 | N27 | C28 | 172.9° | 180.0° |
C23 | C25 | N27 | H27 | 7.1° | 0.0° |
N27 | C28 | C29 | N32 | 179.5° | 179.8° |
N27 | C28 | C29 | C30 | 179.7° | 179.9° |
N27 | C28 | C29 | H29 | 0.3° | 0.3° |
N27 | C28 | N32 | N31 | 179.7° | 180.0° |
N27 | C28 | N32 | H32 | 0.3° | 0.0° |
H27 | N27 | C28 | C29 | 113.1° | 179.7° |
H27 | N27 | C28 | N32 | 66.4° | 0.0° |
C28 | C29 | C30 | H29 | 180.0° | 179.6° |
C28 | C29 | C30 | N31 | 0.0° | 0.4° |
C28 | C29 | C30 | H30 | 180.0° | 179.8° |
C29 | C28 | N32 | N31 | 0.2° | 0.2° |
C29 | C28 | N32 | H32 | 179.8° | 179.8° |
N32 | C28 | C29 | C30 | 0.1° | 0.4° |
N32 | C28 | C29 | H29 | 179.9° | 180.0° |
C28 | N32 | N31 | C30 | 0.2° | 0.0° |
C28 | N32 | N31 | H32 | 180.0° | 180.0° |
C29 | C30 | N31 | H30 | 180.0° | 179.8° |
C29 | C30 | N31 | N32 | 0.1° | 0.2° |
H29 | C29 | C30 | N31 | 180.0° | 180.0° |
H29 | C29 | C30 | H30 | 0.0° | 0.2° |
C30 | N31 | N32 | H32 | 179.8° | 180.0° |
H30 | C30 | N31 | N32 | 179.9° | 180.0° |