C,1,51.6,s,
O,2,,,
C,3,172.5,s,
O,4,,,
C,5,38.48,s,
C,6,57.33,s,
C,7,31.5,s,
C,8,21.63,s,
C,9,53.98,s,
N,10,,,
C,11,49.76,s,
C,12,27.17,s,
C,13,23.5,s,
C,14,111.0,s,
C,15,149.5,s,
C,16,134.0,s,
C,17,129.6,s,
C,18,10.6,s,
C,19,170.8,s,
O,20,,,
O,21,,,
H,22,3.61,s,
H,23,3.61,s,
H,24,3.61,s,
H,25,2.76,d,6.0
H,26,2.76,d,6.0
H,27,3.86,dtd,"8.7,6.0,0.7"
H,28,1.84,m,
H,29,1.84,m,
H,30,1.9,m,
H,31,1.9,m,
H,32,2.89,ddd,"10.2,9.4,8.3"
H,33,2.89,td,"9.4,0.7"
H,34,3.34,t,6.4
H,35,3.34,t,6.4
H,36,2.0,tt,"6.8,6.4"
H,37,2.0,tt,"6.8,6.4"
H,38,2.18,dt,"7.0,6.8"
H,39,2.18,dt,"7.0,6.8"
H,40,5.89,t,7.0
H,41,6.31,s,
H,42,1.9,s,
H,43,1.9,s,
H,44,1.9,s,
