C,1,13.45,s,
C,2,61.07,s,
O,3,,,
C,4,62.8,s,
C,5,30.5,s,
C,6,59.37,s,
C,7,50.5,s,
O,8,,,
C,9,77.48,s,
C,10,25.81,s,
O,11,,,
C,12,172.75,s,
O,13,,,
O,14,,,
C,15,62.66,s,
C,16,131.7,s,
C,17,128.4,s,
C,18,62.9,s,
N,19,,,
C,20,53.65,s,
C,21,34.8,s,
C,22,76.6,s,
O,23,,,
C,24,172.75,s,
O,25,,,
C,26,75.5,s,
H,27,1.18,d,6.2
H,28,1.18,d,6.2
H,29,1.18,d,6.2
H,30,4.52,q,6.2
H,31,2.51,s,
H,32,2.51,s,
H,33,2.79,s,
H,34,2.79,s,
H,35,1.47,s,
H,36,1.47,s,
H,37,1.47,s,
H,38,,,
H,39,4.63,s,
H,40,4.63,s,
H,41,5.99,dd,"4.5,2.7"
H,42,3.72,dd,"9.4,4.5"
H,43,3.72,dd,"9.4,2.7"
H,44,3.16,ddd,"10.2,9.4,9.2"
H,45,3.16,ddd,"9.7,9.4,1.2"
H,46,2.03,m,
H,47,2.03,m,
H,48,5.43,ddd,"11.8,10.4,6.8"
H,49,4.38,d,10.4
