C,1,12.85,s,
C,2,120.71,s,
C,3,142.04,s,
C,4,51.67,s,
N,5,,,
C,6,80.2,s,
O,7,,,
C,8,77.48,s,
C,9,130.1,s,
C,10,119.45,s,
C,11,148.8,s,
N,12,,,
C,13,146.9,s,
C,14,102.1,s,
C,15,148.66,s,
O,16,,,
C,17,56.13,s,
C,18,149.47,s,
O,19,,,
C,20,56.13,s,
C,21,98.7,s,
C,22,127.21,s,
C,23,66.72,s,
C,24,24.51,s,
C,25,42.38,s,
C,26,57.37,s,
C,27,173.5,s,
O,28,,,
O,29,,,
C,30,51.7,s,
H,31,1.65,d,7.0
H,32,1.65,d,7.0
H,33,1.65,d,7.0
H,34,5.45,q,7.0
H,35,3.82,s,
H,36,3.82,s,
H,37,5.11,s,
H,38,5.11,s,
H,39,7.07,dd,"5.6,0.5"
H,40,8.73,d,5.6
H,41,7.13,d,0.5
H,42,3.95,s,
H,43,3.95,s,
H,44,3.95,s,
H,45,3.94,s,
H,46,3.94,s,
H,47,3.94,s,
H,48,7.45,t,0.5
H,49,3.84,dd,"0.9,0.8"
H,50,2.11,ddd,"12.4,0.9,0.6"
H,51,2.11,ddd,"12.4,8.5,0.8"
H,52,2.99,ddd,"9.6,8.5,0.6"
H,53,3.18,d,9.6
H,54,3.64,s,
H,55,3.64,s,
H,56,3.64,s,
