C,1,55.99,s,
O,2,,,
C,3,71.89,s,
C,4,133.32,s,
C,5,135.73,s,
C,6,77.48,s,
O,7,,,
C,8,66.72,s,
C,9,36.08,s,
N,10,,,
C,11,59.89,s,
C,12,129.14,s,
C,13,107.23,s,
C,14,147.16,s,
C,15,146.95,s,
C,16,109.92,s,
C,17,142.78,s,
C,18,40.4,s,
C,19,53.83,s,
O,20,,,
C,21,101.3,s,
O,22,,,
H,23,3.15,s,
H,24,3.15,s,
H,25,3.15,s,
H,26,5.19,ddd,"7.1,5.1,1.2"
H,27,6.14,dd,"11.0,5.1"
H,28,5.99,d,11.0
H,29,,,
H,30,3.84,dd,"8.3,0.5"
H,31,2.2,ddd,"12.4,8.3,7.1"
H,32,2.2,ddd,"12.4,1.2,0.5"
H,33,2.87,s,
H,34,2.87,s,
H,35,6.59,d,0.5
H,36,6.62,d,0.5
H,37,2.83,dd,"4.7,0.9"
H,38,3.31,dd,"9.4,0.9"
H,39,3.31,dd,"9.4,4.7"
H,40,5.88,s,
H,41,5.88,s,
