C,1,55.46,s,
O,2,,,
C,3,158.96,s,
C,4,104.5,s,
C,5,120.6,s,
C,6,132.0,s,
C,7,139.75,s,
C,8,101.61,s,
N,9,,,
O,10,,,
C,11,63.4,s,
C,12,174.7,s,
O,13,,,
C,14,53.0,s,
C,15,38.34,s,
C,16,55.8,s,
N,17,,,
C,18,157.99,s,
C,19,196.32,s,
C,20,25.87,s,
O,21,,,
C,22,56.1,s,
C,23,38.77,s,
C,24,63.9,s,
O,25,,,
C,26,76.9,s,
C,27,74.22,s,
O,28,,,
H,29,3.84,s,
H,30,3.84,s,
H,31,3.84,s,
H,32,6.93,dd,"8.2,1.9"
H,33,7.56,dd,"8.2,0.5"
H,34,7.09,dd,"1.9,0.5"
H,35,3.73,s,
H,36,3.73,s,
H,37,3.73,s,
H,38,2.15,dd,"12.4,6.8"
H,39,2.15,dd,"12.4,2.1"
H,40,3.49,ddd,"7.6,6.8,2.1"
H,41,2.38,s,
H,42,2.38,s,
H,43,2.38,s,
H,44,2.83,dd,"5.3,4.1"
H,45,2.27,m,
H,46,4.04,dd,"9.4,2.3"
H,47,4.04,dd,"9.4,3.1"
H,48,4.77,d,1.3
H,49,4.19,dd,"4.1,1.3"
H,50,,,
