Caffeine (XYZ)
Small-molecule caffeine — 3D ball-and-stick.
Rendering…
Make it your own.
format: xyz
24
Caffeine
O 0.470000 2.568800 0.000600
O -3.127100 -0.443600 -0.000300
N -0.968600 -1.312500 0.000000
N 2.218200 0.141200 -0.000300
N -1.347700 1.079700 -0.000100
N 1.411900 -1.937200 0.000200
C 0.857900 0.259200 -0.000800
C 0.389700 -1.026400 -0.000400
C 0.030700 1.422000 -0.000600
C -1.906100 -0.249500 -0.000400
C 2.503200 -1.199800 0.000300
C -1.427600 -2.696000 0.000800
C 3.192600 1.206100 0.000300
C -2.296900 2.188100 0.000700
H 3.516300 -1.578700 0.000800
H -1.045100 -3.197300 -0.893700
H -2.518600 -2.759600 0.001100
H -1.044700 -3.196300 0.895700
H 4.199200 0.780100 0.000200
H 3.046800 1.809200 -0.899200
H 3.046600 1.808300 0.900400
H -1.808700 3.165100 -0.000300
H -2.932200 2.102700 0.888100
H -2.934600 2.102100 -0.884900