AspirinΒΆ
This is an aspirin (salicylic acid acetate) molecule structure expressed in the xyz format. To extract this structure, copy and paste into a new file that ends with the .xyz extension. Aspirin is a nosteroidal anti-inflammatory drug.
21
C -1.2193 0.0035 -0.1981
C -1.1640 -1.3182 -0.4119
C 0.0288 -1.9190 -0.4609
C 1.1340 -1.1804 -0.2982
C 1.1079 0.1507 -0.0691
C -0.1097 0.7536 -0.0201
C -0.2578 2.1005 0.2022
O -1.3543 2.6303 0.1527
O 0.7894 2.9312 0.4540
H -2.2369 0.4278 -0.1697
H -2.0864 -1.9070 -0.5504
H 0.0979 -3.0040 -0.6465
H 2.0930 -1.7193 -0.3754
O 2.2801 0.8526 0.0583
H 1.4768 2.4814 0.9635
C 3.4118 0.1827 0.4237
C 4.4355 0.1941 -0.6948
O 3.5663 -0.3358 1.5078
H 5.3477 -0.3706 -0.3975
H 4.7371 1.2398 -0.9307
H 4.0201 -0.2812 -1.6122