C,1,13.0,s,
C,2,48.4,s,
N,3,,,
C,4,56.5,s,
C,5,37.9,s,
C,6,68.4,s,
O,7,,,
C,8,26.2,s,
C,9,29.8,s,
C,10,72.1,s,
O,11,,,
C,12,49.0,s,
C,13,39.0,s,
C,14,28.4,s,
C,15,44.7,s,
C,16,82.6,s,
O,17,,,
C,18,55.6,s,
C,19,37.66,s,
C,20,82.84,s,
O,21,,,
C,22,165.89,s,
O,23,,,
C,24,126.75,s,
C,25,130.1,s,
C,26,127.7,s,
C,27,131.17,s,
C,28,116.11,s,
C,29,142.35,s,
N,30,,,
C,31,175.6,s,
O,32,,,
C,33,28.6,s,
C,34,28.6,s,
C,35,175.6,s,
O,36,,,
C,37,43.6,s,
C,38,75.4,s,
O,39,,,
C,40,169.7,s,
C,41,21.83,s,
O,42,,,
C,43,39.1,s,
C,44,23.7,s,
C,45,41.1,s,
C,46,63.7,s,
H,47,1.07,t,6.8
H,48,1.07,t,6.8
H,49,1.07,t,6.8
H,50,2.5,q,6.8
H,51,2.5,q,6.8
H,52,2.65,s,
H,53,2.65,s,
H,54,3.97,s,
H,55,3.97,s,
H,56,,,
H,57,1.89,ddd,"12.4,8.2,1.0"
H,58,1.89,ddd,"12.4,10.5,9.7"
H,59,1.79,m,
H,60,1.79,m,
H,61,4.12,dd,"4.4,2.7"
H,62,,,
H,63,2.29,ddd,"9.9,8.3,6.3"
H,64,2.3,ddd,"12.4,8.3,0.3"
H,65,2.3,dt,"12.4,9.9"
H,66,2.42,m,
H,67,3.32,ddd,"12.0,5.1,0.4"
H,68,3.27,s,
H,69,3.27,s,
H,70,3.27,s,
H,71,2.91,dd,"12.4,12.0"
H,72,2.91,dd,"12.4,5.1"
H,73,8.04,ddd,"7.3,1.4,0.5"
H,74,7.71,ddd,"8.4,7.3,1.4"
H,75,7.43,ddd,"8.4,7.3,1.4"
H,76,7.32,ddd,"7.3,1.4,0.5"
H,77,2.7,ddd,"18.4,9.8,0.8"
H,78,2.7,ddd,"18.4,11.5,9.6"
H,79,2.7,ddd,"18.4,11.5,9.8"
H,80,2.7,ddd,"18.4,9.6,0.8"
H,81,2.52,dd,"6.3,4.6"
H,82,4.85,dd,"5.1,4.6"
H,83,2.04,s,
H,84,2.04,s,
H,85,2.04,s,
H,86,5.28,dd,"8.5,2.1"
H,87,1.66,dd,"12.4,10.0"
H,88,1.66,ddd,"12.4,8.5,4.4"
H,89,2.11,dd,"10.0,4.4"
H,90,3.54,d,2.1
