C,1,18.25,s,
C,2,69.07,s,
O,3,,,
C,4,103.3,s,
O,5,,,
C,6,88.2,s,
C,7,69.75,s,
O,8,,,
C,9,77.82,s,
C,10,62.19,s,
O,11,,,
O,12,,,
C,13,102.83,s,
O,14,,,
C,15,78.29,s,
C,16,30.0,s,
C,17,37.49,s,
C,18,37.5,s,
C,19,19.42,s,
C,20,140.68,s,
C,21,122.0,s,
C,22,32.8,s,
C,23,31.5,s,
C,24,56.6,s,
C,25,31.6,s,
C,26,80.95,s,
O,27,,,
C,28,109.25,s,
C,29,31.65,s,
C,30,29.05,s,
C,31,30.45,s,
C,32,17.25,s,
C,33,66.9,s,
O,34,,,
C,35,41.8,s,
C,36,14.75,s,
C,37,62.65,s,
C,38,40.3,s,
C,39,16.4,s,
C,40,39.8,s,
C,41,20.9,s,
C,42,50.8,s,
C,43,39.1,s,
C,44,74.12,s,
O,45,,,
C,46,72.5,s,
O,47,,,
C,48,71.9,s,
O,49,,,
C,50,73.88,s,
O,51,,,
H,52,1.27,d,6.1
H,53,1.27,d,6.1
H,54,1.27,d,6.1
H,55,4.01,dq,"8.2,6.1"
H,56,5.87,d,5.4
H,57,4.2,dd,"3.1,0.7"
H,58,3.97,dd,"3.1,2.6"
H,59,,,
H,60,3.96,td,"5.4,2.6"
H,61,4.13,d,5.4
H,62,4.13,d,5.4
H,63,,,
H,64,5.09,d,5.1
H,65,3.52,m,
H,66,1.94,m,
H,67,1.94,m,
H,68,1.61,ddd,"12.4,5.3,1.2"
H,69,1.61,ddd,"13.4,12.4,3.5"
H,70,0.99,s,
H,71,0.99,s,
H,72,0.99,s,
H,73,5.34,dd,"4.5,3.0"
H,74,1.79,ddd,"15.4,7.0,4.5"
H,75,1.79,ddd,"15.4,11.2,3.0"
H,76,1.64,tdd,"11.2,10.5,7.0"
H,77,1.1,ddd,"11.9,11.2,4.2"
H,78,1.64,ddd,"12.4,7.2,4.2"
H,79,1.64,ddd,"12.4,11.9,9.4"
H,80,4.38,ddd,"9.4,8.5,7.2"
H,81,1.63,ddd,"13.9,12.4,2.9"
H,82,1.63,ddd,"12.4,4.2,3.4"
H,83,1.53,m,
H,84,1.53,ddt,"12.4,4.2,2.9"
H,85,1.62,m,
H,86,0.87,d,6.4
H,87,0.87,d,6.4
H,88,0.87,d,6.4
H,89,3.42,dd,"9.4,7.1"
H,90,3.42,dd,"9.4,8.9"
H,91,1.87,dq,"11.5,6.7"
H,92,0.98,d,6.7
H,93,0.98,d,6.7
H,94,0.98,d,6.7
H,95,1.78,dd,"11.5,8.5"
H,96,0.78,s,
H,97,0.78,s,
H,98,0.78,s,
H,99,1.46,ddd,"12.4,9.2,1.6"
H,100,1.46,ddd,"12.4,9.5,8.9"
H,101,1.5,m,
H,102,1.5,m,
H,103,0.94,ddd,"10.5,9.6,8.4"
H,104,2.4,dd,"15.4,9.9"
H,105,2.4,dd,"15.4,2.1"
H,106,4.41,dd,"5.1,0.7"
H,107,,,
H,108,4.68,dd,"5.4,2.0"
H,109,,,
H,110,4.05,dd,"2.0,0.9"
H,111,,,
H,112,3.91,dd,"8.2,0.9"
H,113,,,
