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,21,153.49,s,
O,22,,,
C,23,56.23,s,
C,24,139.54,s,
O,25,,,
C,26,60.99,s,
C,27,145.43,s,
O,28,,,
C,29,147.0,s,
C,30,106.86,s,
C,31,123.2,s,
C,32,133.4,s,
C,33,110.47,s,
C,34,146.35,s,
O,35,,,
C,36,55.45,s,
C,37,27.6,s,
C,38,47.8,s,
N,39,,,
C,40,34.8,s,
C,41,164.7,s,
O,42,,,
C,43,23.3,s,
C,44,43.1,s,
N,45,,,
C,46,41.9,s,
C,47,124.1,s,
C,48,122.0,s,
C,49,111.29,s,
H,50,3.94,s,
H,51,3.94,s,
H,52,3.94,s,
H,53,7.59,dd,"7.0,1.9"
H,54,6.84,dd,"7.0,0.5"
H,55,,,
H,56,7.09,ddd,"8.2,1.9,0.5"
H,57,7.22,ddd,"8.2,1.9,0.5"
H,58,4.97,d,6.2
H,59,4.97,d,6.2
H,60,4.39,t,6.2
H,61,6.46,s,
H,62,3.87,s,
H,63,3.87,s,
H,64,3.87,s,
H,65,3.81,s,
H,66,3.81,s,
H,67,3.81,s,
H,68,7.87,d,0.5
H,69,6.68,d,0.5
H,70,3.8,s,
H,71,3.8,s,
H,72,3.8,s,
H,73,2.85,ddd,"15.4,8.9,1.6"
H,74,2.85,dt,"15.4,9.2"
H,75,3.34,ddd,"12.4,9.2,8.9"
H,76,3.34,ddd,"12.4,9.2,1.6"
H,77,2.86,s,
H,78,2.86,s,
H,79,2.86,s,
H,80,2.85,ddd,"15.4,8.9,8.6"
H,81,2.85,ddd,"15.4,9.4,1.4"
H,82,2.78,ddd,"12.4,8.6,1.4"
H,83,2.78,ddd,"12.4,9.4,8.9"
H,84,2.53,s,
H,85,2.53,s,
H,86,2.53,s,
H,87,7.22,ddd,"6.6,1.9,0.5"
H,88,7.09,ddd,"6.6,1.9,0.5"
H,89,7.57,dd,"1.9,0.5"
