I0Z
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C | C1 | sing | 1.53Å | 1.52Å | |
C2 | C1 | sing | 1.53Å | 1.52Å | |
C1 | N | sing | 1.47Å | 1.48Å | |
N | C3 | sing | 1.47Å | 1.47Å | |
C3 | C4 | sing | 1.53Å | 1.52Å | |
C4 | C5 | sing | 1.53Å | 1.53Å | |
C6 | C5 | sing | 1.53Å | 1.53Å | |
C7 | C6 | sing | 1.53Å | 1.53Å | |
N | C7 | sing | 1.47Å | 1.47Å | |
C5 | C8 | sing | 1.51Å | 1.52Å | |
O | C8 | doub | 1.21Å | 1.22Å | |
C8 | N1 | sing | 1.35Å | 1.35Å | |
N1 | C9 | sing | 1.47Å | 1.47Å | |
C9 | C10 | sing | 1.53Å | 1.52Å | |
C10 | C11 | sing | 1.53Å | 1.52Å | |
C11 | C12 | sing | 1.53Å | 1.52Å | |
C12 | C13 | sing | 1.53Å | 1.50Å | |
C13 | N2 | sing | 1.47Å | 1.47Å | |
N2 | C14 | sing | 1.37Å | 1.38Å | Aromatic |
N3 | C14 | doub | 1.31Å | 1.32Å | Aromatic |
C15 | N3 | sing | 1.36Å | 1.39Å | Aromatic |
C15 | C16 | doub | 1.40Å | 1.39Å | Aromatic |
C16 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
C17 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
C18 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
C19 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
N2 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
C20 | C15 | sing | 1.41Å | 1.39Å | Aromatic |
C14 | C21 | sing | 1.48Å | 1.47Å | |
C21 | C22 | sing | 1.41Å | 1.43Å | |
C22 | C23 | doub | 1.36Å | 1.35Å | |
C24 | C23 | sing | 1.51Å | 1.50Å | |
C23 | C25 | sing | 1.41Å | 1.45Å | |
C25 | O1 | doub | 1.22Å | 1.23Å | |
N4 | C25 | sing | 1.35Å | 1.40Å | |
C26 | N4 | sing | 1.46Å | 1.46Å | |
C27 | N4 | sing | 1.35Å | 1.37Å | |
C21 | C27 | doub | 1.38Å | 1.36Å | |
C28 | C12 | sing | 1.53Å | 1.52Å | |
N1 | C28 | sing | 1.47Å | 1.46Å | |
C4 | H11 | sing | 1.09Å | 1.10Å | |
C4 | H10 | sing | 1.09Å | 1.10Å | |
C5 | H12 | sing | 1.09Å | 1.10Å | |
C6 | H14 | sing | 1.09Å | 1.10Å | |
C6 | H13 | sing | 1.09Å | 1.10Å | |
C7 | H16 | sing | 1.09Å | 1.10Å | |
C7 | H15 | sing | 1.09Å | 1.10Å | |
C10 | H19 | sing | 1.09Å | 1.10Å | |
C10 | H20 | sing | 1.09Å | 1.10Å | |
C13 | H24 | sing | 1.09Å | 1.10Å | |
C13 | H23 | sing | 1.09Å | 1.10Å | |
C17 | H26 | sing | 1.08Å | 1.08Å | |
C22 | H29 | sing | 1.08Å | 1.08Å | |
C24 | H31 | sing | 1.09Å | 1.10Å | |
C24 | H32 | sing | 1.09Å | 1.10Å | |
C24 | H30 | sing | 1.09Å | 1.10Å | |
C26 | H34 | sing | 1.09Å | 1.10Å | |
C26 | H35 | sing | 1.09Å | 1.10Å | |
C26 | H33 | sing | 1.09Å | 1.10Å | |
C28 | H37 | sing | 1.09Å | 1.10Å | |
C28 | H38 | sing | 1.09Å | 1.10Å | |
C27 | H36 | sing | 1.08Å | 1.08Å | |
C19 | H28 | sing | 1.08Å | 1.08Å | |
C18 | H27 | sing | 1.08Å | 1.08Å | |
C16 | H25 | sing | 1.08Å | 1.08Å | |
C12 | H | sing | 1.09Å | 1.10Å | |
C11 | H22 | sing | 1.09Å | 1.10Å | |
C11 | H21 | sing | 1.09Å | 1.10Å | |
C9 | H18 | sing | 1.09Å | 1.10Å | |
C9 | H17 | sing | 1.09Å | 1.10Å | |
C3 | H9 | sing | 1.09Å | 1.10Å | |
C3 | H8 | sing | 1.09Å | 1.10Å | |
C1 | H4 | sing | 1.09Å | 1.10Å | |
C2 | H6 | sing | 1.09Å | 1.10Å | |
C2 | H7 | sing | 1.09Å | 1.10Å | |
C2 | H5 | sing | 1.09Å | 1.10Å | |
C | H2 | sing | 1.09Å | 1.10Å | |
C | H1 | sing | 1.09Å | 1.10Å | |
C | H3 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C | C1 | C2 | 112.8° | 109.5° |
C | C1 | N | 112.3° | 109.5° |
C | C1 | H4 | 106.1° | 109.5° |
C1 | C | H2 | 109.5° | 109.5° |
C1 | C | H1 | 109.4° | 109.5° |
C1 | C | H3 | 109.5° | 109.5° |
C2 | C1 | N | 112.5° | 109.4° |
C2 | C1 | H4 | 106.1° | 109.5° |
C1 | C2 | H6 | 109.5° | 109.5° |
C1 | C2 | H7 | 109.4° | 109.5° |
C1 | C2 | H5 | 109.5° | 109.5° |
C1 | N | C3 | 113.5° | 111.0° |
C1 | N | C7 | 116.4° | 111.0° |
N | C1 | H4 | 106.5° | 109.5° |
N | C3 | C4 | 111.0° | 109.5° |
C3 | N | C7 | 108.9° | 111.2° |
N | C3 | H9 | 109.1° | 109.5° |
N | C3 | H8 | 109.1° | 109.5° |
C3 | C4 | C5 | 110.4° | 109.3° |
C3 | C4 | H11 | 109.2° | 109.5° |
C3 | C4 | H10 | 109.2° | 109.5° |
C4 | C3 | H9 | 109.1° | 109.4° |
C4 | C3 | H8 | 109.1° | 109.4° |
C4 | C5 | C6 | 109.6° | 109.1° |
C4 | C5 | C8 | 109.9° | 109.5° |
C5 | C4 | H11 | 109.3° | 109.5° |
C5 | C4 | H10 | 109.3° | 109.5° |
C4 | C5 | H12 | 108.9° | 109.5° |
C5 | C6 | C7 | 110.4° | 109.3° |
C6 | C5 | C8 | 110.5° | 109.6° |
C6 | C5 | H12 | 108.9° | 109.6° |
C5 | C6 | H14 | 109.2° | 109.5° |
C5 | C6 | H13 | 109.2° | 109.5° |
C6 | C7 | N | 111.5° | 109.5° |
C7 | C6 | H14 | 109.2° | 109.5° |
C7 | C6 | H13 | 109.3° | 109.6° |
C6 | C7 | H16 | 109.0° | 109.5° |
C6 | C7 | H15 | 109.0° | 109.5° |
N | C7 | H16 | 109.0° | 109.4° |
N | C7 | H15 | 109.0° | 109.5° |
C5 | C8 | O | 120.4° | 120.0° |
C5 | C8 | N1 | 118.4° | 120.0° |
C8 | C5 | H12 | 109.1° | 109.5° |
O | C8 | N1 | 121.3° | 120.0° |
C8 | N1 | C9 | 122.0° | 120.6° |
C8 | N1 | C28 | 124.9° | 120.7° |
N1 | C9 | C10 | 112.0° | 108.8° |
C9 | N1 | C28 | 112.8° | 118.7° |
N1 | C9 | H18 | 108.9° | 109.6° |
N1 | C9 | H17 | 108.8° | 109.6° |
C9 | C10 | C11 | 111.3° | 109.3° |
C9 | C10 | H19 | 109.0° | 109.5° |
C9 | C10 | H20 | 109.0° | 109.5° |
C10 | C9 | H18 | 108.9° | 109.6° |
C10 | C9 | H17 | 108.8° | 109.6° |
C10 | C11 | C12 | 112.0° | 109.5° |
C11 | C10 | H19 | 109.0° | 109.5° |
C11 | C10 | H20 | 109.0° | 109.5° |
C10 | C11 | H22 | 108.9° | 109.5° |
C10 | C11 | H21 | 108.8° | 109.5° |
C11 | C12 | C13 | 114.6° | 109.5° |
C11 | C12 | C28 | 109.2° | 109.4° |
C11 | C12 | H | 106.6° | 109.5° |
C12 | C11 | H22 | 108.8° | 109.5° |
C12 | C11 | H21 | 108.8° | 109.4° |
C12 | C13 | N2 | 114.2° | 109.5° |
C13 | C12 | C28 | 112.5° | 109.5° |
C12 | C13 | H24 | 108.3° | 109.4° |
C12 | C13 | H23 | 108.3° | 109.5° |
C13 | C12 | H | 106.9° | 109.5° |
C13 | N2 | C14 | 129.2° | 126.4° |
C13 | N2 | C20 | 124.5° | 126.4° |
N2 | C13 | H24 | 108.3° | 109.5° |
N2 | C13 | H23 | 108.3° | 109.5° |
N2 | C14 | N3 | 113.1° | 109.7° |
C14 | N2 | C20 | 106.2° | 107.3° |
N2 | C14 | C21 | 127.9° | 125.2° |
C14 | N3 | C15 | 104.7° | 109.6° |
N3 | C14 | C21 | 119.0° | 125.1° |
N3 | C15 | C16 | 129.9° | 133.3° |
N3 | C15 | C20 | 110.5° | 107.2° |
C15 | C16 | C17 | 118.6° | 119.8° |
C16 | C15 | C20 | 119.7° | 119.5° |
C15 | C16 | H25 | 120.7° | 120.1° |
C16 | C17 | C18 | 121.0° | 120.5° |
C16 | C17 | H26 | 119.5° | 119.7° |
C17 | C16 | H25 | 120.7° | 120.1° |
C17 | C18 | C19 | 120.9° | 120.5° |
C18 | C17 | H26 | 119.5° | 119.8° |
C17 | C18 | H27 | 119.5° | 119.7° |
C18 | C19 | C20 | 117.6° | 119.8° |
C18 | C19 | H28 | 121.2° | 120.1° |
C19 | C18 | H27 | 119.5° | 119.8° |
C19 | C20 | N2 | 132.3° | 133.9° |
C19 | C20 | C15 | 122.2° | 120.0° |
C20 | C19 | H28 | 121.2° | 120.1° |
N2 | C20 | C15 | 105.5° | 106.2° |
C14 | C21 | C22 | 122.9° | 120.2° |
C14 | C21 | C27 | 119.9° | 120.3° |
C21 | C22 | C23 | 122.6° | 119.1° |
C22 | C21 | C27 | 117.3° | 119.5° |
C21 | C22 | H29 | 118.6° | 120.5° |
C22 | C23 | C24 | 123.0° | 120.3° |
C22 | C23 | C25 | 119.4° | 119.4° |
C23 | C22 | H29 | 118.7° | 120.4° |
C24 | C23 | C25 | 117.6° | 120.3° |
C23 | C24 | H31 | 109.5° | 109.5° |
C23 | C24 | H32 | 109.5° | 109.5° |
C23 | C24 | H30 | 109.4° | 109.5° |
C23 | C25 | O1 | 123.9° | 119.7° |
C23 | C25 | N4 | 116.3° | 120.5° |
O1 | C25 | N4 | 119.7° | 119.8° |
C25 | N4 | C26 | 117.1° | 119.5° |
C25 | N4 | C27 | 122.6° | 121.0° |
C26 | N4 | C27 | 120.2° | 119.5° |
N4 | C26 | H34 | 109.5° | 109.4° |
N4 | C26 | H35 | 109.5° | 109.5° |
N4 | C26 | H33 | 109.5° | 109.4° |
N4 | C27 | C21 | 121.7° | 120.5° |
N4 | C27 | H36 | 119.1° | 119.8° |
C21 | C27 | H36 | 119.2° | 119.7° |
C12 | C28 | N1 | 112.4° | 108.8° |
C12 | C28 | H37 | 108.8° | 109.6° |
C12 | C28 | H38 | 108.7° | 109.6° |
C28 | C12 | H | 106.6° | 109.5° |
N1 | C28 | H37 | 108.7° | 109.6° |
N1 | C28 | H38 | 108.8° | 109.5° |
H11 | C4 | H10 | 109.4° | 109.6° |
H14 | C6 | H13 | 109.5° | 109.5° |
H16 | C7 | H15 | 109.4° | 109.5° |
H19 | C10 | H20 | 109.5° | 109.5° |
H24 | C13 | H23 | 109.5° | 109.5° |
H31 | C24 | H32 | 109.5° | 109.5° |
H31 | C24 | H30 | 109.5° | 109.4° |
H32 | C24 | H30 | 109.5° | 109.5° |
H34 | C26 | H35 | 109.4° | 109.4° |
H34 | C26 | H33 | 109.5° | 109.5° |
H35 | C26 | H33 | 109.5° | 109.5° |
H37 | C28 | H38 | 109.5° | 109.7° |
H22 | C11 | H21 | 109.4° | 109.4° |
H18 | C9 | H17 | 109.5° | 109.7° |
H9 | C3 | H8 | 109.5° | 109.4° |
H6 | C2 | H7 | 109.5° | 109.4° |
H6 | C2 | H5 | 109.5° | 109.5° |
H7 | C2 | H5 | 109.5° | 109.5° |
H2 | C | H1 | 109.5° | 109.5° |
H2 | C | H3 | 109.4° | 109.5° |
H1 | C | H3 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C | C1 | C2 | N | 128.3° | 120.0° |
C | C1 | C2 | H4 | 115.7° | 120.1° |
C | C1 | N | H4 | 115.7° | 120.1° |
C | C1 | N | C3 | 154.3° | 65.0° |
C | C1 | N | C7 | 78.2° | 59.2° |
C | C1 | C2 | H6 | 180.0° | 60.0° |
C | C1 | C2 | H7 | 60.0° | 60.0° |
C | C1 | C2 | H5 | 60.0° | 180.0° |
C1 | C | H2 | H1 | 120.0° | 120.0° |
C1 | C | H2 | H3 | 120.0° | 120.0° |
C1 | C | H1 | H3 | 120.0° | 120.0° |
C2 | C1 | N | H4 | 115.8° | 120.0° |
C2 | C1 | N | C3 | 77.2° | 175.0° |
C2 | C1 | N | C7 | 50.3° | 60.8° |
C1 | C2 | H6 | H7 | 120.0° | 120.0° |
C1 | C2 | H6 | H5 | 120.0° | 120.0° |
C1 | C2 | H7 | H5 | 120.0° | 120.0° |
C2 | C1 | C | H2 | 180.0° | 60.0° |
C2 | C1 | C | H1 | 60.0° | 180.0° |
C2 | C1 | C | H3 | 60.0° | 60.1° |
C1 | N | C3 | C7 | 131.4° | 124.1° |
C1 | N | C3 | C4 | 166.6° | 174.2° |
C1 | N | C7 | C6 | 169.0° | 174.2° |
C1 | N | C7 | H16 | 48.6° | 54.2° |
C1 | N | C7 | H15 | 70.7° | 65.8° |
C1 | N | C3 | H9 | 46.4° | 65.8° |
C1 | N | C3 | H8 | 73.1° | 54.2° |
N | C1 | C2 | H6 | 51.8° | 60.0° |
N | C1 | C2 | H7 | 171.8° | 180.0° |
N | C1 | C2 | H5 | 68.3° | 60.0° |
N | C1 | C | H2 | 51.6° | 60.0° |
N | C1 | C | H1 | 68.4° | 60.1° |
N | C1 | C | H3 | 171.6° | 180.0° |
N | C3 | C4 | H9 | 120.2° | 120.1° |
N | C3 | C4 | H8 | 120.2° | 120.0° |
N | C3 | C4 | C5 | 59.2° | 59.2° |
C3 | N | C7 | C6 | 61.3° | 61.8° |
N | C3 | C4 | H11 | 60.9° | 179.1° |
N | C3 | C4 | H10 | 179.4° | 60.8° |
C3 | N | C7 | H16 | 178.4° | 178.2° |
C3 | N | C7 | H15 | 59.0° | 58.3° |
N | C3 | H9 | H8 | 119.3° | 120.0° |
C3 | N | C1 | H4 | 38.6° | 55.0° |
C3 | C4 | C5 | H11 | 120.1° | 119.9° |
C3 | C4 | C5 | H10 | 120.2° | 119.9° |
C3 | C4 | C5 | C6 | 53.8° | 57.6° |
C4 | C3 | N | C7 | 62.0° | 61.8° |
C3 | C4 | C5 | C8 | 175.4° | 177.6° |
C3 | C4 | H11 | H10 | 119.5° | 120.1° |
C3 | C4 | C5 | H12 | 65.2° | 62.3° |
C4 | C3 | H9 | H8 | 119.3° | 119.9° |
C4 | C5 | C6 | C8 | 121.2° | 119.9° |
C4 | C5 | C6 | H12 | 119.0° | 119.9° |
C4 | C5 | C6 | C7 | 52.9° | 57.6° |
C4 | C5 | C8 | H12 | 119.3° | 120.1° |
C4 | C5 | C8 | O | 26.6° | 85.6° |
C4 | C5 | C8 | N1 | 152.6° | 94.3° |
C5 | C4 | H11 | H10 | 119.6° | 120.1° |
C4 | C5 | C6 | H14 | 67.3° | 62.3° |
C4 | C5 | C6 | H13 | 173.1° | 177.7° |
C5 | C4 | C3 | H9 | 179.4° | 60.9° |
C5 | C4 | C3 | H8 | 61.0° | 179.2° |
C5 | C6 | C7 | H14 | 120.1° | 119.9° |
C5 | C6 | C7 | H13 | 120.2° | 120.0° |
C5 | C6 | C7 | N | 57.5° | 59.2° |
C6 | C5 | C8 | H12 | 119.7° | 120.2° |
C6 | C5 | C8 | O | 94.4° | 34.1° |
C6 | C5 | C8 | N1 | 86.3° | 146.0° |
C6 | C5 | C4 | H11 | 66.3° | 177.5° |
C6 | C5 | C4 | H10 | 174.0° | 62.3° |
C5 | C6 | H14 | H13 | 119.5° | 120.0° |
C5 | C6 | C7 | H16 | 177.9° | 179.2° |
C5 | C6 | C7 | H15 | 62.8° | 60.8° |
C6 | C7 | N | H16 | 120.3° | 120.0° |
C6 | C7 | N | H15 | 120.3° | 120.0° |
C7 | C6 | C5 | C8 | 174.1° | 177.6° |
C7 | C6 | C5 | H12 | 66.1° | 62.3° |
C7 | C6 | H14 | H13 | 119.6° | 120.1° |
C6 | C7 | H16 | H15 | 119.1° | 120.0° |
N | C7 | C6 | H14 | 62.6° | 60.7° |
N | C7 | C6 | H13 | 177.7° | 179.2° |
N | C7 | H16 | H15 | 119.1° | 120.0° |
C7 | N | C3 | H9 | 177.8° | 58.3° |
C7 | N | C3 | H8 | 58.2° | 178.3° |
C7 | N | C1 | H4 | 166.1° | 179.2° |
C5 | C8 | O | N1 | 179.2° | 180.0° |
C5 | C8 | N1 | C9 | 172.3° | 5.2° |
C5 | C8 | N1 | C28 | 0.9° | 175.1° |
C8 | C5 | C4 | H11 | 55.3° | 62.5° |
C8 | C5 | C4 | H10 | 64.4° | 57.6° |
C8 | C5 | C6 | H14 | 54.0° | 57.6° |
C8 | C5 | C6 | H13 | 65.7° | 62.4° |
O | C8 | N1 | C9 | 6.9° | 174.8° |
O | C8 | N1 | C28 | 179.9° | 4.9° |
O | C8 | C5 | H12 | 145.9° | 154.3° |
C8 | N1 | C9 | C28 | 174.0° | 179.7° |
C8 | N1 | C9 | C10 | 131.2° | 126.1° |
C8 | N1 | C28 | C12 | 129.0° | 126.1° |
N1 | C8 | C5 | H12 | 33.3° | 25.8° |
C8 | N1 | C28 | H37 | 8.5° | 114.1° |
C8 | N1 | C28 | H38 | 110.6° | 6.3° |
C8 | N1 | C9 | H18 | 10.8° | 6.4° |
C8 | N1 | C9 | H17 | 108.4° | 114.1° |
N1 | C9 | C10 | H18 | 120.4° | 119.8° |
N1 | C9 | C10 | H17 | 120.4° | 119.8° |
N1 | C9 | C10 | C11 | 52.1° | 54.6° |
C9 | N1 | C28 | C12 | 57.2° | 53.6° |
N1 | C9 | C10 | H19 | 68.2° | 174.6° |
N1 | C9 | C10 | H20 | 172.4° | 65.4° |
C9 | N1 | C28 | H37 | 177.7° | 66.2° |
C9 | N1 | C28 | H38 | 63.2° | 173.4° |
N1 | C9 | H18 | H17 | 118.8° | 120.4° |
C9 | C10 | C11 | H19 | 120.3° | 120.0° |
C9 | C10 | C11 | H20 | 120.3° | 120.0° |
C9 | C10 | C11 | C12 | 52.6° | 61.3° |
C10 | C9 | N1 | C28 | 54.8° | 53.6° |
C9 | C10 | H19 | H20 | 119.1° | 120.1° |
C9 | C10 | C11 | H22 | 173.0° | 178.6° |
C9 | C10 | C11 | H21 | 67.8° | 58.7° |
C10 | C9 | H18 | H17 | 118.9° | 120.3° |
C10 | C11 | C12 | H22 | 120.4° | 120.1° |
C10 | C11 | C12 | H21 | 120.4° | 120.0° |
C10 | C11 | C12 | C13 | 179.2° | 178.7° |
C10 | C11 | C12 | C28 | 53.6° | 61.3° |
C11 | C10 | H19 | H20 | 119.2° | 120.1° |
C10 | C11 | C12 | H | 61.3° | 58.7° |
C10 | C11 | H22 | H21 | 118.8° | 120.0° |
C11 | C10 | C9 | H18 | 172.5° | 174.4° |
C11 | C10 | C9 | H17 | 68.2° | 65.2° |
C11 | C12 | C13 | C28 | 125.5° | 119.9° |
C11 | C12 | C13 | H | 117.8° | 120.0° |
C11 | C12 | C13 | N2 | 49.4° | 65.7° |
C11 | C12 | C28 | H | 114.8° | 120.0° |
C11 | C12 | C28 | N1 | 55.7° | 54.6° |
C12 | C11 | C10 | H19 | 67.7° | 178.7° |
C12 | C11 | C10 | H20 | 172.9° | 58.7° |
C11 | C12 | C13 | H24 | 71.3° | 174.3° |
C11 | C12 | C13 | H23 | 170.1° | 54.3° |
C11 | C12 | C28 | H37 | 176.1° | 65.1° |
C11 | C12 | C28 | H38 | 64.8° | 174.4° |
C12 | C11 | H22 | H21 | 118.8° | 119.9° |
C12 | C13 | N2 | H24 | 120.7° | 120.0° |
C12 | C13 | N2 | H23 | 120.7° | 120.0° |
C12 | C13 | N2 | C14 | 64.4° | 84.6° |
C12 | C13 | N2 | C20 | 112.2° | 95.4° |
C13 | C12 | C28 | H | 116.8° | 120.1° |
C13 | C12 | C28 | N1 | 176.0° | 174.6° |
C12 | C13 | H24 | H23 | 117.9° | 120.0° |
C13 | C12 | C28 | H37 | 55.5° | 54.8° |
C13 | C12 | C28 | H38 | 63.6° | 65.6° |
C13 | C12 | C11 | H22 | 58.9° | 58.6° |
C13 | C12 | C11 | H21 | 60.4° | 61.3° |
C13 | N2 | C14 | C20 | 177.0° | 180.0° |
C13 | N2 | C14 | N3 | 175.2° | 180.0° |
C13 | N2 | C20 | C19 | 4.8° | 0.1° |
C13 | N2 | C20 | C15 | 175.7° | 180.0° |
C13 | N2 | C14 | C21 | 6.5° | 0.0° |
N2 | C13 | C12 | C28 | 174.9° | 174.4° |
N2 | C13 | H24 | H23 | 117.8° | 120.0° |
N2 | C13 | C12 | H | 68.4° | 54.3° |
N2 | C14 | N3 | C21 | 178.4° | 180.0° |
N2 | C14 | N3 | C15 | 1.3° | 0.0° |
C14 | N2 | C20 | C19 | 178.0° | 180.0° |
C14 | N2 | C20 | C15 | 1.5° | 0.0° |
N2 | C14 | C21 | C22 | 30.6° | 55.0° |
N2 | C14 | C21 | C27 | 150.3° | 124.8° |
C14 | N2 | C13 | H24 | 174.9° | 35.4° |
C14 | N2 | C13 | H23 | 56.3° | 155.4° |
C14 | N3 | C15 | C16 | 179.4° | 180.0° |
N3 | C14 | N2 | C20 | 1.8° | 0.0° |
C14 | N3 | C15 | C20 | 0.2° | 0.0° |
N3 | C14 | C21 | C22 | 147.6° | 125.1° |
N3 | C14 | C21 | C27 | 31.5° | 55.2° |
N3 | C15 | C16 | C20 | 179.6° | 180.0° |
N3 | C15 | C16 | C17 | 178.8° | 180.0° |
N3 | C15 | C20 | C19 | 178.7° | 180.0° |
N3 | C15 | C20 | N2 | 0.8° | 0.0° |
C15 | N3 | C14 | C21 | 177.2° | 180.0° |
N3 | C15 | C16 | H25 | 1.2° | 0.1° |
C15 | C16 | C17 | H25 | 180.0° | 180.0° |
C15 | C16 | C17 | C18 | 0.0° | 0.0° |
C16 | C15 | C20 | C19 | 0.9° | 0.0° |
C16 | C15 | C20 | N2 | 179.5° | 180.0° |
C15 | C16 | C17 | H26 | 180.0° | 179.9° |
C16 | C17 | C18 | H26 | 180.0° | 179.9° |
C16 | C17 | C18 | C19 | 0.7° | 0.0° |
C17 | C16 | C15 | C20 | 0.8° | 0.0° |
C16 | C17 | C18 | H27 | 179.2° | 180.0° |
C17 | C18 | C19 | H27 | 180.0° | 179.9° |
C17 | C18 | C19 | C20 | 0.6° | 0.0° |
C17 | C18 | C19 | H28 | 179.4° | 180.0° |
C18 | C17 | C16 | H25 | 180.0° | 180.0° |
C18 | C19 | C20 | H28 | 180.0° | 180.0° |
C18 | C19 | C20 | N2 | 179.7° | 180.0° |
C18 | C19 | C20 | C15 | 0.2° | 0.0° |
C19 | C18 | C17 | H26 | 179.3° | 179.9° |
C19 | C20 | N2 | C15 | 179.5° | 180.0° |
C20 | C19 | C18 | H27 | 179.4° | 180.0° |
C20 | N2 | C14 | C21 | 176.4° | 180.0° |
C20 | N2 | C13 | H24 | 8.6° | 144.6° |
C20 | N2 | C13 | H23 | 127.1° | 24.6° |
N2 | C20 | C19 | H28 | 0.3° | 0.0° |
C15 | C20 | C19 | H28 | 179.8° | 180.0° |
C20 | C15 | C16 | H25 | 179.2° | 180.0° |
C14 | C21 | C22 | C27 | 179.1° | 179.8° |
C14 | C21 | C22 | C23 | 179.1° | 179.7° |
C14 | C21 | C27 | N4 | 179.5° | 179.7° |
C14 | C21 | C22 | H29 | 0.9° | 0.2° |
C14 | C21 | C27 | H36 | 0.5° | 0.2° |
C21 | C22 | C23 | H29 | 180.0° | 179.9° |
C21 | C22 | C23 | C24 | 178.1° | 180.0° |
C21 | C22 | C23 | C25 | 0.1° | 0.0° |
C22 | C21 | C27 | N4 | 1.3° | 0.1° |
C22 | C21 | C27 | H36 | 178.7° | 180.0° |
C22 | C23 | C24 | C25 | 178.2° | 180.0° |
C22 | C23 | C25 | O1 | 174.2° | 180.0° |
C22 | C23 | C25 | N4 | 2.2° | 0.0° |
C23 | C22 | C21 | C27 | 1.7° | 0.1° |
C22 | C23 | C24 | H31 | 180.0° | 90.0° |
C22 | C23 | C24 | H32 | 60.0° | 150.0° |
C22 | C23 | C24 | H30 | 60.0° | 29.9° |
C24 | C23 | C25 | O1 | 7.6° | 0.0° |
C24 | C23 | C25 | N4 | 176.1° | 180.0° |
C24 | C23 | C22 | H29 | 1.9° | 0.0° |
C23 | C24 | H31 | H32 | 120.0° | 120.1° |
C23 | C24 | H31 | H30 | 120.0° | 120.0° |
C23 | C24 | H32 | H30 | 120.0° | 120.0° |
C23 | C25 | O1 | N4 | 176.2° | 180.0° |
C23 | C25 | N4 | C26 | 176.9° | 180.0° |
C23 | C25 | N4 | C27 | 2.6° | 0.0° |
C25 | C23 | C22 | H29 | 180.0° | 180.0° |
C25 | C23 | C24 | H31 | 1.8° | 90.0° |
C25 | C23 | C24 | H32 | 118.2° | 30.0° |
C25 | C23 | C24 | H30 | 121.8° | 150.1° |
O1 | C25 | N4 | C26 | 6.6° | 0.0° |
O1 | C25 | N4 | C27 | 173.9° | 179.9° |
C25 | N4 | C26 | C27 | 179.6° | 180.0° |
C25 | N4 | C27 | C21 | 0.9° | 0.1° |
C25 | N4 | C26 | H34 | 180.0° | 0.0° |
C25 | N4 | C26 | H35 | 60.0° | 120.0° |
C25 | N4 | C26 | H33 | 60.0° | 120.0° |
C25 | N4 | C27 | H36 | 179.1° | 180.0° |
C26 | N4 | C27 | C21 | 178.6° | 180.0° |
N4 | C26 | H34 | H35 | 120.0° | 119.9° |
N4 | C26 | H34 | H33 | 120.0° | 120.0° |
N4 | C26 | H35 | H33 | 120.0° | 120.0° |
C26 | N4 | C27 | H36 | 1.4° | 0.0° |
N4 | C27 | C21 | H36 | 180.0° | 179.9° |
C27 | N4 | C26 | H34 | 0.4° | 180.0° |
C27 | N4 | C26 | H35 | 119.5° | 60.1° |
C27 | N4 | C26 | H33 | 120.4° | 60.0° |
C27 | C21 | C22 | H29 | 178.3° | 180.0° |
C12 | C28 | N1 | H37 | 120.5° | 119.8° |
C12 | C28 | N1 | H38 | 120.4° | 119.8° |
C28 | C12 | C13 | H24 | 54.2° | 54.5° |
C28 | C12 | C13 | H23 | 64.4° | 65.5° |
C12 | C28 | H37 | H38 | 118.7° | 120.4° |
C28 | C12 | C11 | H22 | 174.0° | 178.6° |
C28 | C12 | C11 | H21 | 66.8° | 58.7° |
N1 | C28 | H37 | H38 | 118.7° | 120.3° |
N1 | C28 | C12 | H | 59.1° | 65.3° |
C28 | N1 | C9 | H18 | 175.2° | 173.4° |
C28 | N1 | C9 | H17 | 65.6° | 66.2° |
H11 | C4 | C5 | H12 | 174.7° | 57.6° |
H11 | C4 | C3 | H9 | 59.3° | 59.0° |
H11 | C4 | C3 | H8 | 178.8° | 60.9° |
H10 | C4 | C5 | H12 | 55.0° | 177.7° |
H10 | C4 | C3 | H9 | 60.4° | 179.2° |
H10 | C4 | C3 | H8 | 59.1° | 59.3° |
H12 | C5 | C6 | H14 | 173.7° | 177.8° |
H12 | C5 | C6 | H13 | 54.1° | 57.7° |
H14 | C6 | C7 | H16 | 57.7° | 59.2° |
H14 | C6 | C7 | H15 | 177.1° | 179.2° |
H13 | C6 | C7 | H16 | 62.0° | 60.8° |
H13 | C6 | C7 | H15 | 57.4° | 59.1° |
H19 | C10 | C11 | H22 | 52.7° | 58.7° |
H19 | C10 | C11 | H21 | 171.9° | 61.3° |
H19 | C10 | C9 | H18 | 52.2° | 65.6° |
H19 | C10 | C9 | H17 | 171.5° | 54.8° |
H20 | C10 | C11 | H22 | 66.8° | 61.4° |
H20 | C10 | C11 | H21 | 52.5° | 178.7° |
H20 | C10 | C9 | H18 | 67.2° | 54.4° |
H20 | C10 | C9 | H17 | 52.0° | 174.8° |
H24 | C13 | C12 | H | 170.9° | 65.6° |
H23 | C13 | C12 | H | 52.3° | 174.4° |
H26 | C17 | C18 | H27 | 0.8° | 0.2° |
H26 | C17 | C16 | H25 | 0.0° | 0.2° |
H31 | C24 | H32 | H30 | 120.0° | 119.9° |
H34 | C26 | H35 | H33 | 120.0° | 120.1° |
H37 | C28 | C12 | H | 61.3° | 174.9° |
H38 | C28 | C12 | H | 179.6° | 54.4° |
H28 | C19 | C18 | H27 | 0.7° | 0.1° |
H | C12 | C11 | H22 | 59.1° | 61.4° |
H | C12 | C11 | H21 | 178.4° | 178.6° |
H4 | C1 | C2 | H6 | 64.3° | 180.0° |
H4 | C1 | C2 | H7 | 55.7° | 60.1° |
H4 | C1 | C2 | H5 | 175.7° | 60.0° |
H4 | C1 | C | H2 | 64.3° | 180.0° |
H4 | C1 | C | H1 | 175.6° | 60.0° |
H4 | C1 | C | H3 | 55.7° | 60.0° |
H6 | C2 | H7 | H5 | 120.0° | 120.0° |
H2 | C | H1 | H3 | 120.0° | 120.0° |