C,1,9.9,s,
C,2,25.6,s,
C,3,77.4,s,
O,4,,,
C,5,173.8,s,
O,6,,,
C,7,33.43,s,
C,8,25.86,s,
C,9,27.3,s,
C,10,28.1,s,
C,11,29.07,s,
C,12,29.09,s,
C,13,32.2,s,
C,14,128.31,s,
C,15,130.2,s,
C,16,45.4,s,
C,17,85.5,s,
O,18,,,
C,19,62.7,s,
Cl,20,,,
C,21,36.5,s,
C,22,41.8,s,
H,23,0.9,t,7.0
H,24,0.9,t,7.0
H,25,0.9,t,7.0
H,26,1.53,qd,"7.0,5.7"
H,27,1.53,qd,"7.0,5.7"
H,28,4.88,td,"5.7,1.9"
H,29,2.31,ddd,"15.4,9.5,9.1"
H,30,2.31,dd,"15.4,10.4"
H,31,1.46,m,
H,32,1.46,m,
H,33,1.27,m,
H,34,1.27,m,
H,35,1.25,m,
H,36,1.25,m,
H,37,1.3,m,
H,38,1.3,m,
H,39,1.32,m,
H,40,1.32,m,
H,41,1.98,m,
H,42,1.98,m,
H,43,5.45,ddd,"11.0,10.3,4.7"
H,44,6.16,dd,"11.0,8.3"
H,45,2.69,ddd,"8.3,1.9,1.5"
H,46,4.52,dd,"1.5,1.3"
H,47,,,
H,48,4.12,ddd,"10.0,5.9,1.3"
H,49,2.32,ddd,"12.4,10.0,1.3"
H,50,2.32,ddd,"12.4,8.8,5.9"
H,51,2.29,dtd,"8.8,1.9,1.3"
