C,1,56.1,s,
O,2,,,
C,3,145.65,s,
C,4,109.92,s,
C,5,126.6,s,
C,6,128.45,s,
C,7,113.6,s,
C,8,148.2,s,
O,9,,,
C,10,56.8,s,
N,11,,,
C,12,53.4,s,
C,13,28.05,s,
C,14,139.6,s,
C,15,114.9,s,
C,16,34.7,s,
C,17,71.11,s,
O,18,,,
C,19,42.27,s,
C,20,60.6,s,
H,21,3.86,s,
H,22,3.86,s,
H,23,3.86,s,
H,24,6.62,d,0.5
H,25,6.91,d,0.5
H,26,,,
H,27,4.14,s,
H,28,4.14,s,
H,29,3.34,ddd,"13.4,9.4,6.9"
H,30,3.34,ddd,"9.4,5.3,0.7"
H,31,2.73,ddd,"12.4,6.9,0.7"
H,32,2.73,ddd,"13.4,12.4,5.3"
H,33,5.54,dd,"5.2,2.8"
H,34,2.44,ddd,"15.4,2.8,2.0"
H,35,2.44,ddd,"15.4,9.4,5.2"
H,36,4.19,ddd,"9.4,2.1,2.0"
H,37,,,
H,38,2.83,dd,"11.7,2.1"
H,39,4.24,d,11.7
