QZM
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O07 | C01 | sing | 1.36Å | 1.41Å | |
C01 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
C01 | C02 | sing | 1.39Å | 1.41Å | Aromatic |
O06 | C02 | sing | 1.36Å | 1.41Å | |
O06 | C25 | sing | 1.43Å | 1.41Å | |
C24 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
C02 | C03 | doub | 1.38Å | 1.39Å | Aromatic |
C21 | C04 | doub | 1.38Å | 1.39Å | Aromatic |
C03 | C04 | sing | 1.38Å | 1.38Å | Aromatic |
C04 | C05 | sing | 1.51Å | 1.54Å | |
C05 | C06 | sing | 1.53Å | 1.55Å | |
C23 | C12 | sing | 1.53Å | 1.54Å | |
N04 | C12 | sing | 1.46Å | 1.48Å | |
N04 | C13 | sing | 1.35Å | 1.48Å | |
C06 | N01 | sing | 1.46Å | 1.48Å | |
C12 | C22 | sing | 1.53Å | 1.53Å | |
C12 | C11 | sing | 1.51Å | 1.52Å | |
N01 | C07 | sing | 1.35Å | 1.47Å | |
N03 | C11 | doub | 1.30Å | 1.41Å | |
N03 | C08 | sing | 1.35Å | 1.40Å | |
C07 | O01 | doub | 1.21Å | 1.19Å | |
C07 | C08 | sing | 1.48Å | 1.56Å | |
C11 | N02 | sing | 1.35Å | 1.45Å | |
C13 | O05 | doub | 1.22Å | 1.42Å | |
C13 | O04 | sing | 1.35Å | 1.19Å | |
C08 | C09 | doub | 1.39Å | 1.39Å | |
N02 | C10 | sing | 1.35Å | 1.37Å | |
C09 | C10 | sing | 1.47Å | 1.47Å | |
C09 | O02 | sing | 1.36Å | 1.39Å | |
C10 | O03 | doub | 1.22Å | 1.40Å | |
C03 | H1 | sing | 1.08Å | 1.08Å | |
C05 | H2 | sing | 1.09Å | 1.10Å | |
C06 | H4 | sing | 1.09Å | 1.10Å | |
C21 | H7 | sing | 1.08Å | 1.08Å | |
C22 | H8 | sing | 1.09Å | 1.10Å | |
C22 | H9 | sing | 1.09Å | 1.10Å | |
C22 | H10 | sing | 1.09Å | 1.10Å | |
C23 | H11 | sing | 1.09Å | 1.10Å | |
C23 | H12 | sing | 1.09Å | 1.10Å | |
C23 | H13 | sing | 1.09Å | 1.10Å | |
C24 | H14 | sing | 1.08Å | 1.08Å | |
C25 | H15 | sing | 1.09Å | 1.10Å | |
C25 | H16 | sing | 1.09Å | 1.10Å | |
C25 | H17 | sing | 1.09Å | 1.10Å | |
N01 | H18 | sing | 0.97Å | 1.00Å | |
N04 | H19 | sing | 0.97Å | 1.00Å | |
O02 | H20 | sing | 0.97Å | 0.95Å | |
O07 | H22 | sing | 0.97Å | 0.95Å | |
O04 | C41 | sing | 1.45Å | 37.44Å | |
C41 | C42 | sing | 1.51Å | 0.00Å | |
C42 | C43 | sing | 1.38Å | 0.00Å | Aromatic |
C43 | C44 | doub | 1.38Å | 0.00Å | Aromatic |
C44 | C45 | sing | 1.38Å | 0.00Å | Aromatic |
C45 | C46 | doub | 1.38Å | 0.00Å | Aromatic |
C46 | C47 | sing | 1.38Å | 0.00Å | Aromatic |
C47 | C42 | doub | 1.38Å | 0.00Å | Aromatic |
C05 | H3 | sing | 1.09Å | 1.10Å | |
C06 | H5 | sing | 1.09Å | 1.10Å | |
N02 | H23 | sing | 0.97Å | 1.00Å | |
C41 | H21 | sing | 1.09Å | 0.00Å | |
C41 | H24 | sing | 1.09Å | 0.00Å | |
C43 | H25 | sing | 1.08Å | 0.00Å | |
C44 | H26 | sing | 1.08Å | 0.00Å | |
C45 | H27 | sing | 1.08Å | 0.00Å | |
C46 | H28 | sing | 1.08Å | 0.00Å | |
C47 | H29 | sing | 1.08Å | 0.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O07 | C01 | C24 | 118.5° | 120.1° |
O07 | C01 | C02 | 121.3° | 120.1° |
C01 | O07 | H22 | 109.5° | 113.9° |
C24 | C01 | C02 | 120.2° | 119.8° |
C01 | C24 | C21 | 119.9° | 120.0° |
C01 | C24 | H14 | 120.1° | 120.0° |
C01 | C02 | O06 | 122.7° | 120.1° |
C01 | C02 | C03 | 119.2° | 119.9° |
C02 | O06 | C25 | 115.2° | 117.0° |
O06 | C02 | C03 | 118.2° | 120.1° |
O06 | C25 | H15 | 109.5° | 109.4° |
O06 | C25 | H16 | 109.5° | 109.4° |
O06 | C25 | H17 | 109.5° | 109.5° |
C24 | C21 | C04 | 120.1° | 120.1° |
C24 | C21 | H7 | 120.0° | 119.9° |
C21 | C24 | H14 | 120.1° | 120.0° |
C02 | C03 | C04 | 120.3° | 120.0° |
C02 | C03 | H1 | 119.9° | 120.0° |
C21 | C04 | C03 | 120.4° | 120.1° |
C21 | C04 | C05 | 121.3° | 120.0° |
C04 | C21 | H7 | 119.9° | 119.9° |
C03 | C04 | C05 | 118.3° | 119.9° |
C04 | C03 | H1 | 119.8° | 120.0° |
C04 | C05 | C06 | 110.1° | 109.5° |
C04 | C05 | H2 | 109.3° | 109.5° |
C04 | C05 | H3 | 109.3° | 109.5° |
C05 | C06 | N01 | 108.4° | 109.5° |
C06 | C05 | H2 | 109.3° | 109.4° |
C05 | C06 | H4 | 109.8° | 109.5° |
C06 | C05 | H3 | 109.3° | 109.5° |
C05 | C06 | H5 | 109.8° | 109.5° |
C23 | C12 | N04 | 111.8° | 109.5° |
C23 | C12 | C22 | 110.5° | 109.5° |
C23 | C12 | C11 | 107.7° | 109.5° |
C12 | C23 | H11 | 109.5° | 109.4° |
C12 | C23 | H12 | 109.5° | 109.5° |
C12 | C23 | H13 | 109.5° | 109.5° |
C12 | N04 | C13 | 116.5° | 120.0° |
N04 | C12 | C22 | 111.0° | 109.4° |
N04 | C12 | C11 | 103.5° | 109.4° |
C12 | N04 | H19 | 121.7° | 120.0° |
N04 | C13 | O05 | 121.2° | 120.0° |
N04 | C13 | O04 | 119.2° | 120.0° |
C13 | N04 | H19 | 121.7° | 120.0° |
C06 | N01 | C07 | 119.6° | 120.0° |
N01 | C06 | H4 | 109.7° | 109.5° |
C06 | N01 | H18 | 120.2° | 120.0° |
N01 | C06 | H5 | 109.7° | 109.5° |
C22 | C12 | C11 | 112.1° | 109.5° |
C12 | C22 | H8 | 109.5° | 109.4° |
C12 | C22 | H9 | 109.4° | 109.5° |
C12 | C22 | H10 | 109.5° | 109.5° |
C12 | C11 | N03 | 116.8° | 118.7° |
C12 | C11 | N02 | 122.5° | 118.8° |
N01 | C07 | O01 | 119.5° | 120.0° |
N01 | C07 | C08 | 119.0° | 119.9° |
C07 | N01 | H18 | 120.1° | 120.0° |
C11 | N03 | C08 | 120.4° | 122.2° |
N03 | C11 | N02 | 120.7° | 122.6° |
N03 | C08 | C07 | 119.8° | 120.3° |
N03 | C08 | C09 | 119.7° | 119.4° |
O01 | C07 | C08 | 121.5° | 120.1° |
C07 | C08 | C09 | 120.5° | 120.2° |
C11 | N02 | C10 | 118.7° | 120.1° |
C11 | N02 | H23 | 120.6° | 119.9° |
O05 | C13 | O04 | 119.6° | 120.0° |
C13 | O04 | C41 | 49.5° | 117.0° |
C08 | C09 | C10 | 120.5° | 117.7° |
C08 | C09 | O02 | 117.7° | 121.2° |
N02 | C10 | C09 | 120.0° | 118.0° |
N02 | C10 | O03 | 119.0° | 121.0° |
C10 | N02 | H23 | 120.6° | 120.0° |
C10 | C09 | O02 | 121.8° | 121.1° |
C09 | C10 | O03 | 121.0° | 121.0° |
C09 | O02 | H20 | 109.5° | 114.0° |
H2 | C05 | H3 | 109.4° | 109.5° |
H4 | C06 | H5 | 109.5° | 109.4° |
H8 | C22 | H9 | 109.5° | 109.5° |
H8 | C22 | H10 | 109.5° | 109.4° |
H9 | C22 | H10 | 109.5° | 109.5° |
H11 | C23 | H12 | 109.4° | 109.5° |
H11 | C23 | H13 | 109.5° | 109.5° |
H12 | C23 | H13 | 109.5° | 109.5° |
H15 | C25 | H16 | 109.4° | 109.5° |
H15 | C25 | H17 | 109.5° | 109.5° |
H16 | C25 | H17 | 109.5° | 109.5° |
O04 | C41 | C42 | 90.0° | 109.5° |
O04 | C41 | H21 | 90.0° | 109.5° |
O04 | C41 | H24 | 90.0° | 109.5° |
C41 | C42 | C43 | 90.0° | 120.0° |
C41 | C42 | C47 | 90.0° | 120.0° |
C42 | C41 | H21 | 90.0° | 109.5° |
C42 | C41 | H24 | 90.0° | 109.5° |
C42 | C43 | C44 | 90.0° | 120.0° |
C43 | C42 | C47 | 90.0° | 120.0° |
C42 | C43 | H25 | 90.0° | 120.0° |
C43 | C44 | C45 | 90.0° | 120.0° |
C44 | C43 | H25 | 90.0° | 120.0° |
C43 | C44 | H26 | 90.0° | 120.0° |
C44 | C45 | C46 | 90.0° | 120.0° |
C45 | C44 | H26 | 90.0° | 120.0° |
C44 | C45 | H27 | 90.0° | 120.0° |
C45 | C46 | C47 | 90.0° | 120.0° |
C46 | C45 | H27 | 90.0° | 120.0° |
C45 | C46 | H28 | 90.0° | 120.0° |
C46 | C47 | C42 | 90.0° | 120.0° |
C47 | C46 | H28 | 90.0° | 120.0° |
C46 | C47 | H29 | 90.0° | 120.0° |
C42 | C47 | H29 | 90.0° | 120.0° |
H21 | C41 | H24 | 90.0° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O07 | C01 | C24 | C02 | 179.7° | 179.8° |
O07 | C01 | C02 | O06 | 0.1° | 0.3° |
O07 | C01 | C24 | C21 | 179.9° | 179.7° |
O07 | C01 | C02 | C03 | 179.9° | 179.7° |
O07 | C01 | C24 | H14 | 0.1° | 0.2° |
C24 | C01 | C02 | O06 | 179.9° | 180.0° |
C01 | C24 | C21 | H14 | 180.0° | 179.9° |
C24 | C01 | C02 | C03 | 0.4° | 0.0° |
C01 | C24 | C21 | C04 | 0.1° | 0.1° |
C01 | C24 | C21 | H7 | 179.9° | 180.0° |
C24 | C01 | O07 | H22 | 180.0° | 90.0° |
C01 | C02 | O06 | C03 | 179.7° | 180.0° |
C01 | C02 | O06 | C25 | 163.1° | 180.0° |
C02 | C01 | C24 | C21 | 0.2° | 0.1° |
C01 | C02 | C03 | C04 | 0.4° | 0.0° |
C01 | C02 | C03 | H1 | 179.6° | 180.0° |
C02 | C01 | C24 | H14 | 179.8° | 179.9° |
C02 | C01 | O07 | H22 | 0.3° | 89.8° |
O06 | C02 | C03 | C04 | 179.8° | 180.0° |
O06 | C02 | C03 | H1 | 0.2° | 0.0° |
C02 | O06 | C25 | H15 | 180.0° | 60.0° |
C02 | O06 | C25 | H16 | 60.0° | 60.0° |
C02 | O06 | C25 | H17 | 60.0° | 180.0° |
C25 | O06 | C02 | C03 | 17.2° | 0.0° |
O06 | C25 | H15 | H16 | 120.0° | 119.9° |
O06 | C25 | H15 | H17 | 120.0° | 120.0° |
O06 | C25 | H16 | H17 | 120.0° | 120.0° |
C24 | C21 | C04 | H7 | 180.0° | 179.9° |
C24 | C21 | C04 | C03 | 0.1° | 0.0° |
C24 | C21 | C04 | C05 | 179.6° | 180.0° |
C02 | C03 | C04 | C21 | 0.3° | 0.0° |
C02 | C03 | C04 | H1 | 180.0° | 180.0° |
C02 | C03 | C04 | C05 | 179.8° | 180.0° |
C21 | C04 | C03 | C05 | 179.5° | 180.0° |
C21 | C04 | C05 | C06 | 128.3° | 90.0° |
C21 | C04 | C03 | H1 | 179.7° | 180.0° |
C21 | C04 | C05 | H2 | 111.6° | 30.0° |
C04 | C21 | C24 | H14 | 179.9° | 180.0° |
C21 | C04 | C05 | H3 | 8.2° | 150.0° |
C03 | C04 | C05 | C06 | 52.1° | 90.0° |
C03 | C04 | C05 | H2 | 68.0° | 150.0° |
C03 | C04 | C21 | H7 | 179.9° | 180.0° |
C03 | C04 | C05 | H3 | 172.2° | 30.0° |
C04 | C05 | C06 | H2 | 120.1° | 120.0° |
C04 | C05 | C06 | H3 | 120.1° | 120.0° |
C04 | C05 | C06 | N01 | 43.2° | 180.0° |
C05 | C04 | C03 | H1 | 0.2° | 0.0° |
C04 | C05 | H2 | H3 | 119.7° | 120.0° |
C04 | C05 | C06 | H4 | 76.7° | 60.0° |
C05 | C04 | C21 | H7 | 0.3° | 0.0° |
C04 | C05 | C06 | H5 | 163.0° | 60.0° |
C05 | C06 | N01 | H4 | 119.8° | 120.0° |
C05 | C06 | N01 | H5 | 119.8° | 120.0° |
C05 | C06 | N01 | C07 | 67.1° | 180.0° |
C06 | C05 | H2 | H3 | 119.7° | 120.0° |
C05 | C06 | H4 | H5 | 120.5° | 120.0° |
C05 | C06 | N01 | H18 | 112.9° | 0.1° |
C23 | C12 | N04 | C22 | 123.9° | 120.0° |
C23 | C12 | N04 | C11 | 115.6° | 120.0° |
C23 | C12 | N04 | C13 | 148.6° | 60.0° |
C23 | C12 | C22 | C11 | 120.1° | 120.1° |
C23 | C12 | C11 | N03 | 48.8° | 120.3° |
C23 | C12 | C11 | N02 | 132.9° | 59.9° |
C23 | C12 | C22 | H8 | 180.0° | 60.1° |
C23 | C12 | C22 | H9 | 60.0° | 60.0° |
C23 | C12 | C22 | H10 | 60.0° | 180.0° |
C12 | C23 | H11 | H12 | 120.0° | 120.0° |
C12 | C23 | H11 | H13 | 120.0° | 120.0° |
C12 | C23 | H12 | H13 | 120.0° | 120.0° |
C23 | C12 | N04 | H19 | 31.4° | 120.0° |
C12 | N04 | C13 | H19 | 180.0° | 180.0° |
N04 | C12 | C22 | C11 | 115.2° | 120.0° |
N04 | C12 | C11 | N03 | 69.8° | 119.7° |
N04 | C12 | C11 | N02 | 108.5° | 60.1° |
C12 | N04 | C13 | O05 | 90.7° | 0.0° |
C12 | N04 | C13 | O04 | 88.3° | 180.0° |
N04 | C12 | C22 | H8 | 55.3° | 180.0° |
N04 | C12 | C22 | H9 | 175.3° | 60.0° |
N04 | C12 | C22 | H10 | 64.7° | 60.0° |
N04 | C12 | C23 | H11 | 180.0° | 180.0° |
N04 | C12 | C23 | H12 | 60.0° | 60.0° |
N04 | C12 | C23 | H13 | 60.0° | 60.0° |
C13 | N04 | C12 | C22 | 87.4° | 60.0° |
C13 | N04 | C12 | C11 | 33.0° | 180.0° |
N04 | C13 | O05 | O04 | 179.0° | 180.0° |
N04 | C13 | O04 | C41 | 45.0° | 180.0° |
C06 | N01 | C07 | H18 | 180.0° | 179.9° |
C06 | N01 | C07 | O01 | 0.8° | 0.0° |
C06 | N01 | C07 | C08 | 179.7° | 180.0° |
N01 | C06 | C05 | H2 | 163.3° | 60.0° |
N01 | C06 | H4 | H5 | 120.5° | 120.0° |
N01 | C06 | C05 | H3 | 77.0° | 60.0° |
C22 | C12 | C11 | N03 | 170.5° | 0.2° |
C22 | C12 | C11 | N02 | 11.1° | 180.0° |
C12 | C22 | H8 | H9 | 120.0° | 120.0° |
C12 | C22 | H8 | H10 | 120.0° | 119.9° |
C12 | C22 | H9 | H10 | 120.0° | 120.0° |
C22 | C12 | C23 | H11 | 55.8° | 60.0° |
C22 | C12 | C23 | H12 | 175.8° | 180.0° |
C22 | C12 | C23 | H13 | 64.2° | 59.9° |
C22 | C12 | N04 | H19 | 92.6° | 120.0° |
C12 | C11 | N03 | N02 | 178.4° | 179.8° |
C12 | C11 | N03 | C08 | 179.5° | 179.7° |
C12 | C11 | N02 | C10 | 179.6° | 180.0° |
C11 | C12 | C22 | H8 | 59.9° | 60.0° |
C11 | C12 | C22 | H9 | 60.1° | 180.0° |
C11 | C12 | C22 | H10 | 179.9° | 59.9° |
C11 | C12 | C23 | H11 | 66.9° | 60.0° |
C11 | C12 | C23 | H12 | 53.1° | 59.9° |
C11 | C12 | C23 | H13 | 173.1° | 180.0° |
C11 | C12 | N04 | H19 | 147.0° | 0.0° |
C12 | C11 | N02 | H23 | 0.4° | 0.2° |
N01 | C07 | C08 | N03 | 59.4° | 0.3° |
N01 | C07 | O01 | C08 | 179.5° | 180.0° |
N01 | C07 | C08 | C09 | 120.6° | 180.0° |
C07 | N01 | C06 | H4 | 173.0° | 60.0° |
C07 | N01 | C06 | H5 | 52.7° | 60.0° |
C11 | N03 | C08 | C07 | 179.7° | 179.8° |
C11 | N03 | C08 | C09 | 0.3° | 0.6° |
N03 | C11 | N02 | C10 | 1.4° | 0.2° |
N03 | C11 | N02 | H23 | 178.6° | 180.0° |
N03 | C08 | C07 | O01 | 121.1° | 179.7° |
N03 | C08 | C07 | C09 | 180.0° | 179.7° |
C08 | N03 | C11 | N02 | 1.2° | 0.5° |
N03 | C08 | C09 | C10 | 0.4° | 0.3° |
N03 | C08 | C09 | O02 | 179.5° | 179.7° |
O01 | C07 | C08 | C09 | 58.9° | 0.0° |
O01 | C07 | N01 | H18 | 179.2° | 180.0° |
C07 | C08 | C09 | C10 | 179.6° | 179.9° |
C07 | C08 | C09 | O02 | 0.5° | 0.1° |
C08 | C07 | N01 | H18 | 0.3° | 0.0° |
C11 | N02 | C10 | H23 | 180.0° | 179.8° |
C11 | N02 | C10 | C09 | 0.7° | 0.1° |
C11 | N02 | C10 | O03 | 179.0° | 180.0° |
O05 | C13 | N04 | H19 | 89.3° | 180.0° |
O05 | C13 | O04 | C41 | 134.0° | 0.0° |
O04 | C13 | N04 | H19 | 91.7° | 0.0° |
C13 | O04 | C41 | C42 | 90.0° | 180.0° |
C13 | O04 | C41 | H21 | 90.0° | 60.0° |
C13 | O04 | C41 | H24 | 90.0° | 60.0° |
C08 | C09 | C10 | N02 | 0.2° | 0.1° |
C08 | C09 | C10 | O02 | 179.9° | 180.0° |
C08 | C09 | C10 | O03 | 179.9° | 179.9° |
C08 | C09 | O02 | H20 | 179.9° | 180.0° |
N02 | C10 | C09 | O03 | 179.7° | 179.9° |
N02 | C10 | C09 | O02 | 179.7° | 179.9° |
C10 | C09 | O02 | H20 | 0.0° | 0.0° |
C09 | C10 | N02 | H23 | 179.3° | 179.7° |
O02 | C09 | C10 | O03 | 0.0° | 0.1° |
O03 | C10 | N02 | H23 | 1.0° | 0.2° |
H2 | C05 | C06 | H4 | 43.4° | 180.0° |
H2 | C05 | C06 | H5 | 76.9° | 60.0° |
H4 | C06 | N01 | H18 | 7.0° | 120.0° |
H4 | C06 | C05 | H3 | 163.2° | 60.1° |
H7 | C21 | C24 | H14 | 0.1° | 0.1° |
H8 | C22 | H9 | H10 | 120.0° | 120.0° |
H11 | C23 | H12 | H13 | 120.0° | 120.0° |
H15 | C25 | H16 | H17 | 120.0° | 120.1° |
H18 | N01 | C06 | H5 | 127.3° | 120.0° |
O04 | C41 | C42 | H21 | 90.0° | 120.0° |
O04 | C41 | C42 | H24 | 90.0° | 120.0° |
O04 | C41 | C42 | C43 | 90.0° | 90.0° |
O04 | C41 | C42 | C47 | 90.0° | 90.3° |
O04 | C41 | H21 | H24 | 90.0° | 120.0° |
C41 | C42 | C43 | C47 | 90.0° | 179.7° |
C41 | C42 | C43 | C44 | 90.0° | 180.0° |
C41 | C42 | C47 | C46 | 90.0° | 179.8° |
C42 | C41 | H21 | H24 | 90.0° | 120.0° |
C41 | C42 | C43 | H25 | 90.0° | 0.0° |
C41 | C42 | C47 | H29 | 90.0° | 0.3° |
C42 | C43 | C44 | H25 | 90.0° | 180.0° |
C42 | C43 | C44 | C45 | 90.0° | 0.0° |
C43 | C42 | C47 | C46 | 90.0° | 0.5° |
C43 | C42 | C41 | H21 | 90.0° | 30.0° |
C43 | C42 | C41 | H24 | 90.0° | 150.0° |
C42 | C43 | C44 | H26 | 90.0° | 180.0° |
C43 | C42 | C47 | H29 | 90.0° | 180.0° |
C43 | C44 | C45 | H26 | 90.0° | 180.0° |
C43 | C44 | C45 | C46 | 90.0° | 0.0° |
C44 | C43 | C42 | C47 | 90.0° | 0.3° |
C43 | C44 | C45 | H27 | 90.0° | 179.9° |
C44 | C45 | C46 | H27 | 90.0° | 179.9° |
C44 | C45 | C46 | C47 | 90.0° | 0.3° |
C45 | C44 | C43 | H25 | 90.0° | 180.0° |
C44 | C45 | C46 | H28 | 90.0° | 180.0° |
C45 | C46 | C47 | H28 | 90.0° | 179.8° |
C45 | C46 | C47 | C42 | 90.0° | 0.5° |
C46 | C45 | C44 | H26 | 90.0° | 180.0° |
C45 | C46 | C47 | H29 | 90.0° | 180.0° |
C46 | C47 | C42 | H29 | 90.0° | 179.5° |
C47 | C46 | C45 | H27 | 90.0° | 179.8° |
C47 | C42 | C41 | H21 | 90.0° | 149.7° |
C47 | C42 | C41 | H24 | 90.0° | 29.7° |
C47 | C42 | C43 | H25 | 90.0° | 179.7° |
C42 | C47 | C46 | H28 | 90.0° | 179.7° |
H3 | C05 | C06 | H5 | 42.9° | 180.0° |
H25 | C43 | C44 | H26 | 90.0° | 0.0° |
H26 | C44 | C45 | H27 | 90.0° | 0.1° |
H27 | C45 | C46 | H28 | 90.0° | 0.1° |
H28 | C46 | C47 | H29 | 90.0° | 0.3° |