C,1,121.79,s,
C,2,134.89,s,
C,3,169.86,s,
O,4,,,
O,5,,,
C,6,75.65,s,
C,7,48.16,s,
C,8,48.16,s,
C,9,74.22,s,
O,10,,,
C,11,62.7,s,
O,12,,,
C,13,64.49,s,
C,14,17.2,s,
C,15,77.48,s,
O,16,,,
C,17,51.45,s,
Cl,18,,,
C,19,40.59,s,
C,20,71.01,s,
O,21,,,
C,22,167.45,s,
O,23,,,
C,24,127.89,s,
C,25,12.74,s,
C,26,141.31,s,
C,27,59.7,s,
O,28,,,
C,29,53.1,s,
H,30,5.94,s,
H,31,5.94,s,
H,32,4.8,dd,"10.9,7.8"
H,33,2.52,dd,"7.8,5.7"
H,34,2.52,dd,"5.7,5.4"
H,35,4.19,dd,"5.4,3.8"
H,36,,,
H,37,3.36,d,3.8
H,38,1.4,s,
H,39,1.4,s,
H,40,1.4,s,
H,41,,,
H,42,3.27,s,
H,43,3.27,s,
H,44,2.27,dd,"12.4,2.3"
H,45,2.27,dd,"12.4,11.0"
H,46,5.55,ddd,"11.0,7.5,2.3"
H,47,1.9,s,
H,48,1.9,s,
H,49,1.9,s,
H,50,5.7,t,7.0
H,51,4.18,d,7.0
H,52,4.18,d,7.0
H,53,,,
H,54,2.73,dd,"10.9,7.5"
