C,1,55.87,s,
O,2,,,
C,3,153.0,s,
C,4,110.3,s,
C,5,123.9,s,
C,6,122.37,s,
C,7,166.0,s,
O,8,,,
O,9,,,
C,10,64.8,s,
C,11,36.7,s,
C,12,58.7,s,
C,13,25.05,s,
C,14,25.05,s,
C,15,58.7,s,
C,16,36.7,s,
N,17,,,
C,18,50.06,s,
C,19,50.06,s,
N,20,,,
C,21,58.7,s,
C,22,25.05,s,
C,23,25.05,s,
C,24,58.7,s,
C,25,36.7,s,
C,26,64.8,s,
O,27,,,
C,28,166.0,s,
O,29,,,
C,30,122.37,s,
C,31,123.9,s,
C,32,110.3,s,
C,33,153.0,s,
O,34,,,
C,35,55.87,s,
C,36,148.6,s,
O,37,,,
C,38,55.87,s,
C,39,112.0,s,
C,40,36.7,s,
C,41,112.0,s,
C,42,148.6,s,
O,43,,,
C,44,55.87,s,
H,45,3.85,s,
H,46,3.85,s,
H,47,3.85,s,
H,48,6.86,dd,"7.5,0.5"
H,49,7.61,dd,"7.5,1.9"
H,50,5.14,m,
H,51,2.14,ddd,"12.4,10.1,2.8"
H,52,2.14,ddd,"12.4,7.2,2.4"
H,53,3.34,m,
H,54,2.14,m,
H,55,2.14,m,
H,56,2.14,m,
H,57,2.14,m,
H,58,3.34,m,
H,59,2.14,ddd,"12.4,11.6,2.8"
H,60,2.14,ddd,"12.4,6.3,3.8"
H,61,3.17,t,6.2
H,62,3.17,t,6.2
H,63,3.17,t,6.2
H,64,3.17,t,6.2
H,65,3.34,m,
H,66,2.14,m,
H,67,2.14,m,
H,68,2.14,m,
H,69,2.14,m,
H,70,3.34,m,
H,71,2.14,dt,"12.4,2.1"
H,72,2.14,ddd,"12.4,6.2,2.3"
H,73,5.14,m,
H,74,7.61,dd,"7.2,1.9"
H,75,6.86,dd,"7.2,0.5"
H,76,3.85,s,
H,77,3.85,s,
H,78,3.85,s,
H,79,3.8,s,
H,80,3.8,s,
H,81,3.8,s,
H,82,7.56,dd,"1.9,0.5"
H,83,2.14,ddd,"12.4,3.2,1.6"
H,84,2.14,ddd,"12.4,5.5,2.5"
H,85,7.56,dd,"1.9,0.5"
H,86,3.8,s,
H,87,3.8,s,
H,88,3.8,s,
