C,1,51.57,s,
O,2,,,
C,3,166.58,s,
O,4,,,
C,5,105.26,s,
C,6,145.66,s,
N,7,,,
C,8,161.74,s,
O,9,,,
C,10,142.35,s,
C,11,116.11,s,
C,12,131.17,s,
C,13,122.44,s,
C,14,124.58,s,
C,15,134.28,s,
C,16,57.5,s,
C,17,46.0,s,
C,18,53.5,s,
N,19,,,
C,20,48.1,s,
C,21,45.2,s,
C,22,71.0,s,
C,23,20.2,s,
O,24,,,
C,25,29.2,s,
C,26,27.0,s,
C,27,58.9,s,
H,28,3.61,s,
H,29,3.61,s,
H,30,3.61,s,
H,31,8.2,s,
H,32,7.32,ddd,"7.7,1.4,0.5"
H,33,7.43,ddd,"7.7,7.0,1.4"
H,34,6.94,ddd,"8.5,7.0,1.4"
H,35,7.25,ddd,"8.5,1.4,0.5"
H,36,1.78,ddd,"12.4,9.8,7.7"
H,37,1.78,ddd,"12.4,9.5,2.1"
H,38,3.13,ddd,"9.5,9.4,7.7"
H,39,3.13,ddd,"9.8,9.4,2.1"
H,40,2.78,dd,"12.4,6.3"
H,41,2.78,dd,"12.4,11.5"
H,42,1.81,m,
H,43,3.58,qd,"6.1,5.0"
H,44,1.12,d,6.1
H,45,1.12,d,6.1
H,46,1.12,d,6.1
H,47,,,
H,48,2.96,td,"4.2,1.8"
H,49,1.73,ddd,"12.4,3.9,1.8"
H,50,1.73,ddd,"12.4,4.2,2.4"
H,51,4.08,dd,"3.9,2.4"
