C,1,51.57,s,
O,2,,,
C,3,166.58,s,
O,4,,,
C,5,105.26,s,
C,6,167.8,s,
N,7,,,
C,8,132.4,s,
C,9,144.4,s,
O,10,,,
C,11,55.76,s,
C,12,110.3,s,
C,13,121.9,s,
C,14,113.3,s,
C,15,136.2,s,
C,16,59.2,s,
C,17,46.0,s,
C,18,51.95,s,
N,19,,,
C,20,60.58,s,
C,21,77.48,s,
O,22,,,
C,23,71.22,s,
C,24,16.94,s,
O,25,,,
C,26,46.61,s,
C,27,24.51,s,
C,28,58.9,s,
H,29,3.61,s,
H,30,3.61,s,
H,31,3.61,s,
H,32,,,
H,33,3.83,s,
H,34,3.83,s,
H,35,3.83,s,
H,36,6.77,dd,"7.3,1.4"
H,37,6.9,dd,"8.3,7.3"
H,38,6.86,dd,"8.3,1.4"
H,39,2.16,ddd,"12.4,10.8,7.8"
H,40,2.16,ddd,"12.4,7.1,0.6"
H,41,3.04,ddd,"10.8,9.4,7.1"
H,42,3.04,ddd,"9.4,7.8,0.6"
H,43,3.05,s,
H,44,3.05,s,
H,45,,,
H,46,4.49,q,6.2
H,47,1.31,d,6.2
H,48,1.31,d,6.2
H,49,1.31,d,6.2
H,50,,,
H,51,2.6,t,3.1
H,52,2.11,ddd,"12.4,3.1,2.1"
H,53,2.11,ddd,"12.4,3.5,3.1"
H,54,4.08,dd,"3.5,2.1"
