C,1,52.35,s,
O,2,,,
C,3,166.93,s,
O,4,,,
C,5,122.7,s,
C,6,124.2,s,
C,7,114.75,s,
C,8,147.31,s,
O,9,,,
C,10,146.21,s,
O,11,,,
C,12,153.95,s,
C,13,122.0,s,
C,14,124.1,s,
C,15,132.34,s,
C,16,39.3,s,
C,17,58.5,s,
C,18,129.11,s,
C,19,124.1,s,
C,20,110.47,s,
C,21,151.83,s,
O,22,,,
C,23,56.31,s,
C,24,137.25,s,
C,25,145.43,s,
O,26,,,
C,27,148.66,s,
C,28,106.86,s,
C,29,123.2,s,
C,30,133.4,s,
C,31,110.47,s,
C,32,148.66,s,
O,33,,,
C,34,27.6,s,
C,35,47.8,s,
N,36,,,
C,37,34.8,s,
C,38,164.7,s,
O,39,,,
C,40,23.3,s,
C,41,43.1,s,
N,42,,,
C,43,41.9,s,
C,44,124.1,s,
C,45,122.0,s,
C,46,111.29,s,
H,47,3.94,s,
H,48,3.94,s,
H,49,3.94,s,
H,50,7.59,dd,"7.1,1.9"
H,51,6.84,dd,"7.1,0.5"
H,52,,,
H,53,7.09,ddd,"7.8,1.9,0.5"
H,54,7.22,ddd,"7.8,1.9,0.5"
H,55,4.97,d,6.2
H,56,4.97,d,6.2
H,57,4.39,t,6.2
H,58,6.46,s,
H,59,3.87,s,
H,60,3.87,s,
H,61,3.87,s,
H,62,7.87,d,0.5
H,63,6.68,d,0.5
H,64,2.85,ddd,"15.4,4.0,2.5"
H,65,2.85,ddd,"15.4,13.6,4.9"
H,66,3.34,ddd,"13.6,12.4,4.0"
H,67,3.34,ddd,"12.4,4.9,2.5"
H,68,2.86,s,
H,69,2.86,s,
H,70,2.86,s,
H,71,2.85,ddd,"15.4,11.4,5.9"
H,72,2.85,ddd,"15.4,11.6,3.2"
H,73,2.78,ddd,"12.4,11.6,5.9"
H,74,2.78,ddd,"12.4,11.4,3.2"
H,75,2.53,s,
H,76,2.53,s,
H,77,2.53,s,
H,78,7.22,ddd,"7.6,1.9,0.5"
H,79,7.09,ddd,"7.6,1.9,0.5"
H,80,7.57,dd,"1.9,0.5"
