SIP
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N9 | C10 | sing | 1.47Å | 1.42Å | |
N9 | C7 | sing | 1.35Å | 1.35Å | |
C10 | N11 | sing | 1.48Å | 1.47Å | |
C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
C13 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
C7 | O8 | doub | 1.21Å | 1.20Å | |
C7 | C6 | sing | 1.51Å | 1.52Å | |
C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
N11 | C12 | sing | 1.40Å | 1.41Å | |
N11 | C6 | sing | 1.48Å | 1.49Å | |
C12 | C17 | doub | 1.39Å | 1.39Å | Aromatic |
C1 | C6 | sing | 1.53Å | 1.45Å | |
C1 | C2 | sing | 1.53Å | 1.53Å | |
C6 | C5 | sing | 1.53Å | 1.44Å | |
C15 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
C2 | N3 | sing | 1.47Å | 1.43Å | |
C17 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
C5 | C4 | sing | 1.53Å | 1.53Å | |
N3 | C4 | sing | 1.47Å | 1.44Å | |
N3 | C18 | sing | 1.47Å | 1.21Å | |
C18 | C19 | sing | 1.53Å | 1.53Å | |
C19 | C20 | sing | 1.53Å | 1.53Å | |
C20 | C21 | sing | 1.51Å | 1.53Å | |
O22 | C21 | doub | 1.21Å | 1.19Å | |
C21 | C23 | sing | 1.47Å | 1.53Å | |
C23 | C28 | doub | 1.40Å | 1.39Å | Aromatic |
C23 | C24 | sing | 1.40Å | 1.39Å | Aromatic |
C28 | C27 | sing | 1.38Å | 1.39Å | Aromatic |
C24 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
C27 | C26 | doub | 1.39Å | 1.39Å | Aromatic |
C25 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
C26 | F29 | sing | 1.35Å | 1.37Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H3 | sing | 1.09Å | 1.10Å | |
C2 | H4 | sing | 1.09Å | 1.10Å | |
C4 | H5 | sing | 1.09Å | 1.10Å | |
C4 | H6 | sing | 1.09Å | 1.10Å | |
C5 | H7 | sing | 1.09Å | 1.10Å | |
C5 | H8 | sing | 1.09Å | 1.10Å | |
C10 | H9 | sing | 1.09Å | 1.10Å | |
C13 | H10 | sing | 1.08Å | 1.08Å | |
C14 | H11 | sing | 1.08Å | 1.08Å | |
C15 | H12 | sing | 1.08Å | 1.08Å | |
C16 | H13 | sing | 1.08Å | 1.08Å | |
C17 | H14 | sing | 1.08Å | 1.08Å | |
C18 | H15 | sing | 1.09Å | 1.10Å | |
C18 | H16 | sing | 1.09Å | 1.10Å | |
C19 | H17 | sing | 1.09Å | 1.10Å | |
C19 | H18 | sing | 1.09Å | 1.10Å | |
C20 | H19 | sing | 1.09Å | 1.10Å | |
C20 | H20 | sing | 1.09Å | 1.10Å | |
C24 | H21 | sing | 1.08Å | 1.08Å | |
C25 | H22 | sing | 1.08Å | 1.08Å | |
C27 | H23 | sing | 1.08Å | 1.08Å | |
C28 | H24 | sing | 1.08Å | 1.08Å | |
C10 | H26 | sing | 1.09Å | 1.10Å | |
N9 | H25 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C10 | N9 | C7 | 113.2° | 109.6° |
N9 | C10 | N11 | 104.6° | 106.2° |
N9 | C10 | H9 | 110.7° | 110.1° |
N9 | C10 | H26 | 110.7° | 110.1° |
C10 | N9 | H25 | 123.4° | 125.2° |
N9 | C7 | O8 | 122.7° | 125.8° |
N9 | C7 | C6 | 109.8° | 108.3° |
C7 | N9 | H25 | 123.4° | 125.2° |
C10 | N11 | C12 | 116.8° | 111.0° |
C10 | N11 | C6 | 110.8° | 103.1° |
N11 | C10 | H9 | 110.7° | 110.2° |
N11 | C10 | H26 | 110.7° | 110.1° |
C14 | C13 | C12 | 120.6° | 120.0° |
C13 | C14 | C15 | 120.0° | 120.1° |
C14 | C13 | H10 | 119.7° | 120.0° |
C13 | C14 | H11 | 120.0° | 120.0° |
C13 | C12 | N11 | 118.8° | 120.1° |
C13 | C12 | C17 | 118.9° | 119.8° |
C12 | C13 | H10 | 119.7° | 120.0° |
O8 | C7 | C6 | 127.5° | 125.9° |
C7 | C6 | N11 | 101.6° | 105.3° |
C7 | C6 | C1 | 108.4° | 110.4° |
C7 | C6 | C5 | 111.2° | 110.4° |
C14 | C15 | C16 | 119.8° | 120.1° |
C15 | C14 | H11 | 120.0° | 119.9° |
C14 | C15 | H12 | 120.1° | 119.9° |
C12 | N11 | C6 | 132.5° | 111.0° |
N11 | C12 | C17 | 122.3° | 120.1° |
N11 | C6 | C1 | 108.6° | 110.1° |
N11 | C6 | C5 | 113.1° | 110.1° |
C12 | C17 | C16 | 120.6° | 119.9° |
C12 | C17 | H14 | 119.7° | 120.0° |
C6 | C1 | C2 | 113.6° | 109.3° |
C1 | C6 | C5 | 113.3° | 110.3° |
C6 | C1 | H1 | 108.4° | 109.5° |
C6 | C1 | H2 | 108.4° | 109.5° |
C1 | C2 | N3 | 112.2° | 109.5° |
C2 | C1 | H1 | 108.4° | 109.5° |
C2 | C1 | H2 | 108.4° | 109.6° |
C1 | C2 | H3 | 108.8° | 109.4° |
C1 | C2 | H4 | 108.8° | 109.4° |
C6 | C5 | C4 | 114.4° | 109.3° |
C6 | C5 | H7 | 108.3° | 109.5° |
C6 | C5 | H8 | 108.3° | 109.5° |
C15 | C16 | C17 | 120.1° | 120.1° |
C16 | C15 | H12 | 120.1° | 119.9° |
C15 | C16 | H13 | 119.9° | 119.9° |
C2 | N3 | C4 | 111.4° | 111.3° |
C2 | N3 | C18 | 108.7° | 111.0° |
N3 | C2 | H3 | 108.8° | 109.5° |
N3 | C2 | H4 | 108.8° | 109.5° |
C17 | C16 | H13 | 120.0° | 120.0° |
C16 | C17 | H14 | 119.7° | 120.0° |
C5 | C4 | N3 | 112.5° | 109.4° |
C5 | C4 | H5 | 108.7° | 109.5° |
C5 | C4 | H6 | 108.7° | 109.4° |
C4 | C5 | H7 | 108.2° | 109.5° |
C4 | C5 | H8 | 108.2° | 109.5° |
C4 | N3 | C18 | 109.9° | 111.0° |
N3 | C4 | H5 | 108.7° | 109.5° |
N3 | C4 | H6 | 108.7° | 109.5° |
N3 | C18 | C19 | 111.1° | 109.5° |
N3 | C18 | H15 | 109.1° | 109.5° |
N3 | C18 | H16 | 109.1° | 109.4° |
C18 | C19 | C20 | 111.5° | 109.5° |
C19 | C18 | H15 | 109.1° | 109.5° |
C19 | C18 | H16 | 109.1° | 109.4° |
C18 | C19 | H17 | 109.0° | 109.5° |
C18 | C19 | H18 | 108.9° | 109.5° |
C19 | C20 | C21 | 112.7° | 109.5° |
C20 | C19 | H17 | 108.9° | 109.5° |
C20 | C19 | H18 | 108.9° | 109.4° |
C19 | C20 | H19 | 108.7° | 109.5° |
C19 | C20 | H20 | 108.7° | 109.5° |
C20 | C21 | O22 | 120.2° | 120.0° |
C20 | C21 | C23 | 119.5° | 120.0° |
C21 | C20 | H19 | 108.7° | 109.5° |
C21 | C20 | H20 | 108.7° | 109.5° |
O22 | C21 | C23 | 120.3° | 120.0° |
C21 | C23 | C28 | 120.8° | 120.2° |
C21 | C23 | C24 | 119.3° | 120.1° |
C28 | C23 | C24 | 119.9° | 119.7° |
C23 | C28 | C27 | 120.0° | 119.9° |
C23 | C28 | H24 | 120.0° | 120.1° |
C23 | C24 | C25 | 120.2° | 119.9° |
C23 | C24 | H21 | 119.9° | 120.1° |
C28 | C27 | C26 | 120.1° | 120.1° |
C28 | C27 | H23 | 120.0° | 120.0° |
C27 | C28 | H24 | 120.0° | 120.0° |
C24 | C25 | C26 | 119.9° | 120.1° |
C25 | C24 | H21 | 119.9° | 120.0° |
C24 | C25 | H22 | 120.1° | 119.9° |
C27 | C26 | C25 | 120.0° | 120.3° |
C27 | C26 | F29 | 120.1° | 119.9° |
C26 | C27 | H23 | 120.0° | 119.9° |
C25 | C26 | F29 | 119.9° | 119.9° |
C26 | C25 | H22 | 120.1° | 119.9° |
H1 | C1 | H2 | 109.5° | 109.5° |
H3 | C2 | H4 | 109.5° | 109.4° |
H5 | C4 | H6 | 109.5° | 109.5° |
H7 | C5 | H8 | 109.5° | 109.5° |
H9 | C10 | H26 | 109.5° | 110.1° |
H15 | C18 | H16 | 109.4° | 109.5° |
H17 | C19 | H18 | 109.5° | 109.5° |
H19 | C20 | H20 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C10 | N9 | C7 | H25 | 180.0° | 179.9° |
N9 | C10 | N11 | H9 | 119.3° | 119.2° |
N9 | C10 | N11 | H26 | 119.2° | 119.2° |
C10 | N9 | C7 | O8 | 180.0° | 179.3° |
C10 | N9 | C7 | C6 | 0.0° | 0.7° |
N9 | C10 | N11 | C12 | 179.9° | 145.5° |
N9 | C10 | N11 | C6 | 0.1° | 26.5° |
N9 | C10 | H9 | H26 | 122.3° | 121.6° |
C7 | N9 | C10 | N11 | 0.1° | 17.4° |
N9 | C7 | O8 | C6 | 180.0° | 180.0° |
N9 | C7 | C6 | N11 | 0.1° | 16.3° |
N9 | C7 | C6 | C1 | 114.2° | 135.2° |
N9 | C7 | C6 | C5 | 120.7° | 102.5° |
C7 | N9 | C10 | H9 | 119.2° | 136.7° |
C7 | N9 | C10 | H26 | 119.3° | 101.8° |
C10 | N11 | C12 | C13 | 0.1° | 172.9° |
C10 | N11 | C6 | C7 | 0.1° | 25.8° |
C10 | N11 | C12 | C6 | 179.8° | 114.1° |
C10 | N11 | C12 | C17 | 179.9° | 7.3° |
C10 | N11 | C6 | C1 | 114.0° | 144.9° |
C10 | N11 | C6 | C5 | 119.4° | 93.2° |
N11 | C10 | H9 | H26 | 122.2° | 121.7° |
N11 | C10 | N9 | H25 | 179.9° | 162.5° |
C14 | C13 | C12 | H10 | 180.0° | 180.0° |
C13 | C14 | C15 | H11 | 180.0° | 180.0° |
C14 | C13 | C12 | N11 | 179.9° | 179.8° |
C14 | C13 | C12 | C17 | 0.0° | 0.0° |
C13 | C14 | C15 | C16 | 0.1° | 0.0° |
C13 | C14 | C15 | H12 | 179.9° | 180.0° |
C12 | C13 | C14 | C15 | 0.0° | 0.0° |
C13 | C12 | N11 | C17 | 180.0° | 179.8° |
C13 | C12 | N11 | C6 | 179.9° | 58.9° |
C13 | C12 | C17 | C16 | 0.1° | 0.0° |
C12 | C13 | C14 | H11 | 180.0° | 180.0° |
C13 | C12 | C17 | H14 | 179.9° | 180.0° |
O8 | C7 | C6 | N11 | 179.9° | 163.7° |
O8 | C7 | C6 | C1 | 65.8° | 44.8° |
O8 | C7 | C6 | C5 | 59.3° | 77.5° |
O8 | C7 | N9 | H25 | 0.0° | 0.8° |
C7 | C6 | N11 | C12 | 179.9° | 144.8° |
C7 | C6 | N11 | C1 | 114.1° | 119.1° |
C7 | C6 | N11 | C5 | 119.3° | 119.0° |
C7 | C6 | C1 | C5 | 123.9° | 122.4° |
C7 | C6 | C1 | C2 | 77.8° | 65.9° |
C7 | C6 | C5 | C4 | 77.8° | 65.9° |
C7 | C6 | C1 | H1 | 42.8° | 174.2° |
C7 | C6 | C1 | H2 | 161.5° | 54.1° |
C7 | C6 | C5 | H7 | 161.5° | 54.1° |
C7 | C6 | C5 | H8 | 42.9° | 174.2° |
C6 | C7 | N9 | H25 | 180.0° | 179.2° |
C14 | C15 | C16 | H12 | 180.0° | 179.9° |
C14 | C15 | C16 | C17 | 0.1° | 0.1° |
C15 | C14 | C13 | H10 | 180.0° | 180.0° |
C14 | C15 | C16 | H13 | 179.9° | 180.0° |
C12 | N11 | C6 | C1 | 65.8° | 96.2° |
C12 | N11 | C6 | C5 | 60.8° | 25.7° |
N11 | C12 | C17 | C16 | 179.9° | 179.8° |
C12 | N11 | C10 | H9 | 60.7° | 95.3° |
N11 | C12 | C13 | H10 | 0.1° | 0.2° |
N11 | C12 | C17 | H14 | 0.1° | 0.2° |
C12 | N11 | C10 | H26 | 60.8° | 26.3° |
C6 | N11 | C12 | C17 | 0.2° | 121.3° |
N11 | C6 | C1 | C5 | 126.5° | 121.7° |
N11 | C6 | C1 | C2 | 172.5° | 178.2° |
N11 | C6 | C5 | C4 | 168.6° | 178.2° |
N11 | C6 | C1 | H1 | 66.9° | 58.3° |
N11 | C6 | C1 | H2 | 51.9° | 61.8° |
N11 | C6 | C5 | H7 | 47.9° | 61.8° |
N11 | C6 | C5 | H8 | 70.7° | 58.3° |
C6 | N11 | C10 | H9 | 119.1° | 145.7° |
C6 | N11 | C10 | H26 | 119.4° | 92.7° |
C12 | C17 | C16 | C15 | 0.2° | 0.0° |
C12 | C17 | C16 | H14 | 180.0° | 180.0° |
C17 | C12 | C13 | H10 | 180.0° | 180.0° |
C12 | C17 | C16 | H13 | 179.8° | 180.0° |
C6 | C1 | C2 | H1 | 120.6° | 119.9° |
C6 | C1 | C2 | H2 | 120.6° | 120.0° |
C6 | C1 | C2 | N3 | 52.1° | 58.4° |
C1 | C6 | C5 | C4 | 44.5° | 56.4° |
C6 | C1 | H1 | H2 | 118.1° | 120.1° |
C6 | C1 | C2 | H3 | 68.3° | 61.7° |
C6 | C1 | C2 | H4 | 172.5° | 178.4° |
C1 | C6 | C5 | H7 | 76.1° | 176.4° |
C1 | C6 | C5 | H8 | 165.3° | 63.5° |
C2 | C1 | C6 | C5 | 46.0° | 56.4° |
C1 | C2 | N3 | H3 | 120.4° | 120.0° |
C1 | C2 | N3 | H4 | 120.4° | 120.0° |
C1 | C2 | N3 | C4 | 55.7° | 62.2° |
C1 | C2 | N3 | C18 | 176.9° | 173.7° |
C2 | C1 | H1 | H2 | 118.1° | 120.1° |
C1 | C2 | H3 | H4 | 118.8° | 119.9° |
C6 | C5 | C4 | H7 | 120.7° | 120.0° |
C6 | C5 | C4 | H8 | 120.7° | 119.9° |
C6 | C5 | C4 | N3 | 48.8° | 58.4° |
C5 | C6 | C1 | H1 | 166.6° | 63.5° |
C5 | C6 | C1 | H2 | 74.6° | 176.4° |
C6 | C5 | C4 | H5 | 169.2° | 178.3° |
C6 | C5 | C4 | H6 | 71.7° | 61.6° |
C6 | C5 | H7 | H8 | 117.8° | 120.1° |
C15 | C16 | C17 | H13 | 180.0° | 180.0° |
C16 | C15 | C14 | H11 | 179.9° | 180.0° |
C15 | C16 | C17 | H14 | 179.9° | 180.0° |
C2 | N3 | C4 | C5 | 54.0° | 62.1° |
C2 | N3 | C4 | C18 | 120.5° | 124.2° |
C2 | N3 | C18 | C19 | 150.5° | 170.0° |
N3 | C2 | C1 | H1 | 172.7° | 61.5° |
N3 | C2 | C1 | H2 | 68.5° | 178.3° |
N3 | C2 | H3 | H4 | 118.8° | 120.1° |
C2 | N3 | C4 | H5 | 174.5° | 177.9° |
C2 | N3 | C4 | H6 | 66.5° | 57.8° |
C2 | N3 | C18 | H15 | 89.2° | 50.0° |
C2 | N3 | C18 | H16 | 30.2° | 70.1° |
C17 | C16 | C15 | H12 | 179.9° | 180.0° |
C5 | C4 | N3 | H5 | 120.5° | 120.0° |
C5 | C4 | N3 | H6 | 120.4° | 119.9° |
C5 | C4 | N3 | C18 | 174.5° | 173.7° |
C5 | C4 | H5 | H6 | 118.6° | 120.0° |
C4 | C5 | H7 | H8 | 117.7° | 120.0° |
C4 | N3 | C18 | C19 | 87.4° | 65.7° |
C4 | N3 | C2 | H3 | 64.7° | 57.8° |
C4 | N3 | C2 | H4 | 176.1° | 177.8° |
N3 | C4 | H5 | H6 | 118.6° | 120.0° |
N3 | C4 | C5 | H7 | 71.9° | 178.4° |
N3 | C4 | C5 | H8 | 169.5° | 61.6° |
C4 | N3 | C18 | H15 | 32.9° | 174.3° |
C4 | N3 | C18 | H16 | 152.3° | 54.3° |
N3 | C18 | C19 | H15 | 120.3° | 120.1° |
N3 | C18 | C19 | H16 | 120.3° | 120.0° |
N3 | C18 | C19 | C20 | 178.0° | 179.9° |
C18 | N3 | C2 | H3 | 56.5° | 66.3° |
C18 | N3 | C2 | H4 | 62.7° | 53.7° |
C18 | N3 | C4 | H5 | 65.0° | 53.7° |
C18 | N3 | C4 | H6 | 54.0° | 66.4° |
N3 | C18 | H15 | H16 | 119.2° | 120.0° |
N3 | C18 | C19 | H17 | 57.7° | 60.1° |
N3 | C18 | C19 | H18 | 61.7° | 60.0° |
C18 | C19 | C20 | H17 | 120.3° | 120.0° |
C18 | C19 | C20 | H18 | 120.3° | 120.0° |
C18 | C19 | C20 | C21 | 138.6° | 180.0° |
C19 | C18 | H15 | H16 | 119.3° | 119.9° |
C18 | C19 | H17 | H18 | 119.1° | 120.1° |
C18 | C19 | C20 | H19 | 100.9° | 60.0° |
C18 | C19 | C20 | H20 | 18.2° | 60.0° |
C19 | C20 | C21 | H19 | 120.5° | 120.1° |
C19 | C20 | C21 | H20 | 120.5° | 120.0° |
C19 | C20 | C21 | O22 | 28.4° | 0.0° |
C19 | C20 | C21 | C23 | 151.5° | 180.0° |
C20 | C19 | C18 | H15 | 61.8° | 60.0° |
C20 | C19 | C18 | H16 | 57.7° | 60.0° |
C20 | C19 | H17 | H18 | 119.1° | 119.9° |
C19 | C20 | H19 | H20 | 118.5° | 120.0° |
C20 | C21 | O22 | C23 | 180.0° | 180.0° |
C20 | C21 | C23 | C28 | 136.8° | 180.0° |
C20 | C21 | C23 | C24 | 43.9° | 0.3° |
C21 | C20 | C19 | H17 | 18.3° | 60.0° |
C21 | C20 | C19 | H18 | 101.1° | 60.0° |
C21 | C20 | H19 | H20 | 118.6° | 120.0° |
O22 | C21 | C23 | C28 | 43.3° | 0.0° |
O22 | C21 | C23 | C24 | 136.1° | 179.7° |
O22 | C21 | C20 | H19 | 148.9° | 120.0° |
O22 | C21 | C20 | H20 | 92.1° | 120.0° |
C21 | C23 | C28 | C24 | 179.4° | 179.7° |
C21 | C23 | C28 | C27 | 179.8° | 179.7° |
C21 | C23 | C24 | C25 | 179.8° | 180.0° |
C23 | C21 | C20 | H19 | 31.1° | 60.0° |
C23 | C21 | C20 | H20 | 88.0° | 60.0° |
C21 | C23 | C24 | H21 | 0.2° | 0.1° |
C21 | C23 | C28 | H24 | 0.2° | 0.0° |
C23 | C28 | C27 | H24 | 180.0° | 179.7° |
C28 | C23 | C24 | C25 | 0.4° | 0.3° |
C23 | C28 | C27 | C26 | 0.2° | 0.6° |
C28 | C23 | C24 | H21 | 179.6° | 179.8° |
C23 | C28 | C27 | H23 | 179.8° | 179.7° |
C24 | C23 | C28 | C27 | 0.4° | 0.6° |
C23 | C24 | C25 | H21 | 180.0° | 179.9° |
C23 | C24 | C25 | C26 | 0.2° | 0.1° |
C23 | C24 | C25 | H22 | 179.8° | 180.0° |
C24 | C23 | C28 | H24 | 179.6° | 179.7° |
C28 | C27 | C26 | H23 | 180.0° | 179.7° |
C28 | C27 | C26 | C25 | 0.0° | 0.3° |
C28 | C27 | C26 | F29 | 180.0° | 179.7° |
C24 | C25 | C26 | C27 | 0.0° | 0.1° |
C24 | C25 | C26 | H22 | 180.0° | 179.9° |
C24 | C25 | C26 | F29 | 180.0° | 180.0° |
C27 | C26 | C25 | F29 | 180.0° | 180.0° |
C27 | C26 | C25 | H22 | 180.0° | 180.0° |
C26 | C27 | C28 | H24 | 179.8° | 179.7° |
C26 | C25 | C24 | H21 | 179.8° | 179.9° |
C25 | C26 | C27 | H23 | 180.0° | 179.9° |
F29 | C26 | C25 | H22 | 0.0° | 0.1° |
F29 | C26 | C27 | H23 | 0.1° | 0.0° |
H1 | C1 | C2 | H3 | 52.3° | 178.4° |
H1 | C1 | C2 | H4 | 66.9° | 58.5° |
H2 | C1 | C2 | H3 | 171.1° | 58.3° |
H2 | C1 | C2 | H4 | 51.9° | 61.6° |
H5 | C4 | C5 | H7 | 48.5° | 61.6° |
H5 | C4 | C5 | H8 | 70.0° | 58.4° |
H6 | C4 | C5 | H7 | 167.6° | 58.4° |
H6 | C4 | C5 | H8 | 49.1° | 178.4° |
H9 | C10 | N9 | H25 | 60.8° | 43.2° |
H10 | C13 | C14 | H11 | 0.0° | 0.0° |
H11 | C14 | C15 | H12 | 0.1° | 0.0° |
H12 | C15 | C16 | H13 | 0.1° | 0.1° |
H13 | C16 | C17 | H14 | 0.2° | 0.0° |
H15 | C18 | C19 | H17 | 178.0° | 60.0° |
H15 | C18 | C19 | H18 | 58.5° | 179.9° |
H16 | C18 | C19 | H17 | 62.6° | 180.0° |
H16 | C18 | C19 | H18 | 178.0° | 60.0° |
H17 | C19 | C20 | H19 | 138.8° | 180.0° |
H17 | C19 | C20 | H20 | 102.1° | 60.0° |
H18 | C19 | C20 | H19 | 19.4° | 60.0° |
H18 | C19 | C20 | H20 | 138.4° | 180.0° |
H21 | C24 | C25 | H22 | 0.2° | 0.2° |
H23 | C27 | C28 | H24 | 0.2° | 0.0° |
H26 | C10 | N9 | H25 | 60.7° | 78.3° |