C,1,15.61,s,
C,2,139.28,s,
C,3,126.82,s,
C,4,20.35,s,
C,5,167.29,s,
O,6,,,
O,7,,,
C,8,77.06,s,
C,9,44.04,s,
C,10,89.85,s,
C,11,20.89,s,
O,12,,,
C,13,186.83,s,
C,14,104.35,s,
C,15,,,
O,16,,,
C,17,130.13,s,
C,18,20.34,s,
C,19,134.91,s,
C,20,78.54,s,
O,21,,,
C,22,172.75,s,
O,23,,,
C,24,77.48,s,
O,25,,,
C,26,51.45,s,
Cl,27,,,
C,28,49.6,s,
H,29,1.9,d,7.0
H,30,1.9,d,7.0
H,31,1.9,d,7.0
H,32,6.46,q,7.0
H,33,1.87,s,
H,34,1.87,s,
H,35,1.87,s,
H,36,5.64,ddd,"12.1,5.0,4.7"
H,37,2.4,dd,"12.4,4.7"
H,38,2.4,dd,"12.4,12.1"
H,39,1.53,s,
H,40,1.53,s,
H,41,1.53,s,
H,42,5.72,s,
H,43,2.08,s,
H,44,2.08,s,
H,45,2.08,s,
H,46,6.01,d,5.7
H,47,5.35,dd,"5.8,5.7"
H,48,,,
H,49,3.65,s,
H,50,3.65,s,
H,51,2.58,dd,"5.8,5.0"
