C,1,12.72,s,
C,2,118.86,s,
C,3,140.39,s,
C,4,46.86,s,
N,5,,,
C,6,57.09,s,
C,7,34.0,s,
C,8,53.0,s,
C,9,174.7,s,
O,10,,,
N,11,,,
O,12,,,
C,13,63.4,s,
C,14,139.75,s,
C,15,101.61,s,
C,16,156.6,s,
O,17,,,
C,18,114.62,s,
C,19,120.6,s,
C,20,132.0,s,
C,21,78.41,s,
C,22,35.12,s,
C,23,42.38,s,
C,24,40.4,s,
C,25,70.43,s,
O,26,,,
H,27,1.67,d,7.0
H,28,1.67,d,7.0
H,29,1.67,d,7.0
H,30,5.45,q,7.0
H,31,4.69,s,
H,32,4.69,s,
H,33,,,
H,34,3.7,ddd,"11.5,3.6,1.9"
H,35,2.15,dd,"12.4,3.6"
H,36,2.15,dd,"12.4,11.5"
H,37,3.73,s,
H,38,3.73,s,
H,39,3.73,s,
H,40,7.09,dd,"1.9,0.5"
H,41,,,
H,42,6.77,dd,"7.8,1.9"
H,43,7.56,dd,"7.8,0.5"
H,44,4.77,dd,"7.7,0.9"
H,45,1.88,ddd,"12.4,10.8,7.7"
H,46,1.88,ddd,"12.4,4.9,0.9"
H,47,2.99,ddd,"10.8,4.9,3.8"
H,48,2.83,m,
H,49,4.04,dd,"9.4,4.4"
H,50,4.04,dd,"9.4,1.8"
