C,1,52.11,s,
O,2,,,
C,3,175.49,s,
O,4,,,
C,5,53.2,s,
C,6,67.97,s,
O,7,,,
C,8,30.78,s,
C,9,28.16,s,
C,10,40.4,s,
C,11,65.13,s,
N,12,,,
O,13,,,
C,14,66.54,s,
C,15,28.05,s,
C,16,108.8,s,
C,17,143.45,s,
N,18,,,
C,19,136.33,s,
C,20,111.1,s,
C,21,122.04,s,
C,22,119.33,s,
C,23,118.35,s,
C,24,127.08,s,
C,25,71.6,s,
C,26,38.62,s,
C,27,42.9,s,
H,28,3.74,s,
H,29,3.74,s,
H,30,3.74,s,
H,31,3.31,dd,"5.7,5.5"
H,32,4.19,ddd,"9.6,6.4,5.7"
H,33,,,
H,34,1.8,m,
H,35,1.8,m,
H,36,1.58,m,
H,37,1.58,m,
H,38,2.83,m,
H,39,4.28,dd,"12.4,11.8"
H,40,4.28,dd,"12.4,4.7"
H,41,3.65,ddd,"12.4,10.5,1.6"
H,42,3.65,ddd,"12.4,9.4,9.3"
H,43,3.01,ddd,"15.4,10.5,9.4"
H,44,3.01,ddd,"15.4,9.3,1.6"
H,45,,,
H,46,7.35,ddd,"7.3,1.4,0.5"
H,47,7.18,ddd,"8.2,7.3,1.4"
H,48,7.13,ddd,"8.2,8.1,1.4"
H,49,7.52,ddd,"8.1,1.4,0.5"
H,50,4.86,dd,"9.7,1.4"
H,51,2.31,ddd,"12.4,6.9,1.4"
H,52,2.31,ddd,"12.4,11.6,9.7"
H,53,2.12,m,
