C,1,31.3,s,
N,2,,,
C,3,58.37,s,
C,4,33.99,s,
C,5,56.63,s,
N,6,,,
C,7,75.26,s,
O,8,,,
C,9,75.52,s,
O,10,,,
C,11,102.46,s,
O,12,,,
C,13,82.65,s,
C,14,62.05,s,
O,15,,,
C,16,75.52,s,
O,17,,,
C,18,100.22,s,
O,19,,,
C,20,75.55,s,
C,21,43.6,s,
N,22,,,
C,23,72.17,s,
O,24,,,
C,25,72.66,s,
O,26,,,
C,27,56.1,s,
N,28,,,
C,29,81.0,s,
O,30,,,
C,31,78.37,s,
O,32,,,
C,33,100.22,s,
O,34,,,
C,35,70.8,s,
C,36,60.5,s,
O,37,,,
C,38,67.8,s,
O,39,,,
C,40,67.8,s,
O,41,,,
C,42,56.1,s,
N,43,,,
H,44,2.94,s,
H,45,2.94,s,
H,46,2.94,s,
H,47,,,
H,48,3.7,ddd,"12.3,10.1,3.7"
H,49,2.42,ddd,"12.4,12.3,10.9"
H,50,2.42,ddd,"12.4,6.9,3.7"
H,51,3.54,ddd,"10.9,6.9,5.6"
H,52,,,
H,53,,,
H,54,4.06,dd,"5.6,3.4"
H,55,,,
H,56,4.7,dd,"3.4,1.4"
H,57,5.18,d,6.8
H,58,4.03,td,"5.4,4.9"
H,59,4.87,d,5.4
H,60,4.87,d,5.4
H,61,,,
H,62,4.7,dd,"4.9,2.5"
H,63,5.07,d,1.8
H,64,4.4,td,"5.6,1.3"
H,65,2.75,d,5.6
H,66,2.75,d,5.6
H,67,,,
H,68,,,
H,69,3.77,dd,"1.5,1.3"
H,70,,,
H,71,3.79,dd,"2.1,1.5"
H,72,,,
H,73,3.23,dd,"2.1,1.8"
H,74,,,
H,75,,,
H,76,4.78,dd,"6.8,2.5"
H,77,,,
H,78,4.91,dd,"10.1,1.4"
H,79,5.07,d,3.8
H,80,3.67,dt,"9.7,5.4"
H,81,3.87,d,5.4
H,82,3.87,d,5.4
H,83,,,
H,84,3.48,dd,"9.7,9.6"
H,85,,,
H,86,3.79,dd,"9.6,6.2"
H,87,,,
H,88,3.23,dd,"6.2,3.8"
H,89,,,
H,90,,,
