C,1,21.04,s,
C,2,170.09,s,
O,3,,,
O,4,,,
C,5,73.63,s,
C,6,34.8,s,
C,7,70.7,s,
N,8,,,
O,9,,,
C,10,80.5,s,
C,11,122.4,s,
C,12,138.1,s,
C,13,67.61,s,
O,14,,,
C,15,174.6,s,
O,16,,,
C,17,83.9,s,
O,18,,,
C,19,31.9,s,
C,20,16.45,s,
C,21,16.45,s,
C,22,72.5,s,
C,23,16.6,s,
O,24,,,
C,25,97.5,s,
H,26,2.0,s,
H,27,2.0,s,
H,28,2.0,s,
H,29,5.12,ddd,"7.1,3.2,0.6"
H,30,2.05,m,
H,31,2.05,m,
H,32,3.65,ddd,"10.7,9.4,6.6"
H,33,3.65,ddd,"11.4,9.4,2.9"
H,34,4.28,dd,"9.4,2.9"
H,35,4.28,dd,"9.4,5.7"
H,36,6.44,dd,"5.7,2.9"
H,37,4.78,s,
H,38,4.78,s,
H,39,,,
H,40,2.08,m,6.6
H,41,0.88,d,6.6
H,42,0.88,d,6.6
H,43,0.88,d,6.6
H,44,0.88,d,6.6
H,45,0.88,d,6.6
H,46,0.88,d,6.6
H,47,3.98,q,6.2
H,48,1.33,d,6.2
H,49,1.33,d,6.2
H,50,1.33,d,6.2
H,51,,,
H,52,4.86,d,3.2
