O,1,,,
C,2,,,
C,3,43.85,s,
C,4,43.2,s,
S,5,,,
C,6,75.8,s,
C,7,30.5,s,
C,8,53.09,s,
C,9,65.95,s,
C,10,80.4,s,
O,11,,,
N,12,,,
C,13,165.39,s,
O,14,,,
C,15,76.67,s,
C,16,30.5,s,
C,17,53.09,s,
C,18,,,
O,19,,,
C,20,43.85,s,
C,21,62.4,s,
S,22,,,
S,23,,,
C,24,80.4,s,
O,25,,,
C,26,65.95,s,
N,27,,,
C,28,165.39,s,
O,29,,,
H,30,2.06,dd,"15.4,3.3"
H,31,2.06,dd,"15.4,3.0"
H,32,4.08,ddd,"5.5,3.3,3.0"
H,33,1.77,dd,"12.4,8.7"
H,34,1.77,dd,"12.4,1.6"
H,35,2.83,ddd,"9.8,8.7,1.6"
H,36,3.18,dd,"9.8,2.7"
H,37,5.25,dd,"5.5,2.7"
H,38,,,
H,39,1.77,dd,"12.4,9.1"
H,40,1.77,dd,"12.4,10.3"
H,41,2.83,ddd,"10.3,9.1,7.1"
H,42,2.06,dd,"15.4,1.8"
H,43,2.06,dd,"15.4,7.5"
H,44,4.42,ddd,"7.5,6.9,1.8"
H,45,5.25,dd,"9.0,6.9"
H,46,,,
H,47,3.18,dd,"9.0,7.1"
