C,1,51.6,s,
O,2,,,
C,3,172.5,s,
O,4,,,
C,5,51.6,s,
C,6,42.9,s,
C,7,38.62,s,
C,8,71.6,s,
C,9,143.45,s,
N,10,,,
C,11,136.93,s,
C,12,94.8,s,
C,13,157.15,s,
O,14,,,
C,15,55.34,s,
C,16,110.1,s,
C,17,119.7,s,
C,18,127.08,s,
C,19,108.8,s,
C,20,28.05,s,
C,21,66.54,s,
N,22,,,
O,23,,,
C,24,65.13,s,
C,25,40.4,s,
C,26,35.12,s,
C,27,77.7,s,
O,28,,,
C,29,165.0,s,
O,30,,,
C,31,124.9,s,
C,32,106.7,s,
C,33,152.78,s,
O,34,,,
C,35,56.13,s,
C,36,142.38,s,
O,37,,,
C,38,60.79,s,
C,39,152.78,s,
O,40,,,
C,41,56.13,s,
C,42,106.7,s,
C,43,77.8,s,
O,44,,,
C,45,60.5,s,
H,46,3.74,s,
H,47,3.74,s,
H,48,3.74,s,
H,49,3.31,dd,"11.4,4.9"
H,50,2.12,m,
H,51,2.31,ddd,"12.4,10.6,8.8"
H,52,2.31,ddd,"12.4,8.4,7.5"
H,53,4.86,dd,"8.8,8.4"
H,54,,,
H,55,6.85,dd,"1.9,0.5"
H,56,3.88,s,
H,57,3.88,s,
H,58,3.88,s,
H,59,6.84,dd,"7.8,1.9"
H,60,7.55,dd,"7.8,0.5"
H,61,3.01,ddd,"15.4,10.3,1.5"
H,62,3.01,ddd,"15.4,9.9,7.9"
H,63,3.65,ddd,"12.4,9.9,1.5"
H,64,3.65,ddd,"12.4,10.3,7.9"
H,65,4.28,dd,"12.4,1.4"
H,66,4.28,dd,"12.4,8.4"
H,67,2.83,m,
H,68,1.88,ddd,"12.8,12.4,10.2"
H,69,1.88,ddd,"12.4,2.6,1.3"
H,70,4.61,ddd,"11.1,10.2,1.3"
H,71,7.28,s,
H,72,3.87,s,
H,73,3.87,s,
H,74,3.87,s,
H,75,3.85,s,
H,76,3.85,s,
H,77,3.85,s,
H,78,3.87,s,
H,79,3.87,s,
H,80,3.87,s,
H,81,7.28,s,
H,82,4.66,dd,"11.4,11.1"
H,83,3.46,s,
H,84,3.46,s,
H,85,3.46,s,
