C,1,58.95,s,
O,2,,,
C,3,67.4,s,
C,4,75.66,s,
O,5,,,
C,6,77.29,s,
O,7,,,
C,8,35.22,s,
C,9,35.22,s,
C,10,82.97,s,
O,11,,,
C,12,46.95,s,
C,13,27.64,s,
C,14,122.08,s,
C,15,140.45,s,
C,16,39.26,s,
C,17,77.8,s,
O,18,,,
C,19,96.3,s,
C,20,37.3,s,
C,21,67.8,s,
O,22,,,
C,23,86.31,s,
O,24,,,
C,25,101.37,s,
C,26,36.4,s,
C,27,76.51,s,
O,28,,,
C,29,58.9,s,
C,30,72.74,s,
O,31,,,
C,32,73.57,s,
C,33,19.2,s,
O,34,,,
C,35,69.0,s,
C,36,18.2,s,
O,37,,,
C,38,30.18,s,
C,39,37.28,s,
C,40,31.33,s,
C,41,18.57,s,
C,42,41.48,s,
C,43,22.21,s,
C,44,35.28,s,
C,45,41.86,s,
C,46,23.79,s,
H,47,3.35,s,
H,48,3.35,s,
H,49,3.35,s,
H,50,4.05,d,5.5
H,51,4.05,d,5.5
H,52,4.15,t,5.5
H,53,,,
H,54,,,
H,55,1.9,ddd,"12.4,10.5,7.9"
H,56,1.9,ddd,"12.4,11.3,0.3"
H,57,1.9,ddd,"12.4,11.3,7.9"
H,58,1.9,ddd,"12.4,10.5,0.3"
H,59,,,
H,60,2.13,ddd,"12.6,9.4,6.7"
H,61,2.25,ddd,"15.4,6.7,5.3"
H,62,2.25,ddd,"15.4,12.6,2.6"
H,63,5.54,dd,"5.3,2.6"
H,64,2.4,dd,"15.4,9.1"
H,65,2.4,dd,"15.4,2.4"
H,66,3.74,m,
H,67,5.19,dd,"13.3,6.4"
H,68,1.88,ddd,"13.3,12.4,0.3"
H,69,1.88,ddd,"12.4,6.4,1.4"
H,70,3.63,ddd,"1.7,1.4,0.3"
H,71,,,
H,72,3.04,dd,"8.1,1.7"
H,73,4.67,dd,"8.6,6.3"
H,74,1.97,ddd,"12.4,11.7,8.6"
H,75,1.97,ddd,"12.4,6.3,3.8"
H,76,4.61,ddd,"11.7,7.2,3.8"
H,77,3.46,s,
H,78,3.46,s,
H,79,3.46,s,
H,80,3.94,dd,"8.9,7.2"
H,81,,,
H,82,3.86,dq,"8.9,6.1"
H,83,1.32,d,6.1
H,84,1.32,d,6.1
H,85,1.32,d,6.1
H,86,3.39,dq,"8.1,6.1"
H,87,1.32,d,6.1
H,88,1.32,d,6.1
H,89,1.32,d,6.1
H,90,1.94,m,
H,91,1.94,m,
H,92,1.61,ddd,"13.0,12.4,6.0"
H,93,1.61,ddd,"12.4,5.0,2.1"
H,94,1.0,s,
H,95,1.0,s,
H,96,1.0,s,
H,97,1.61,ddd,"10.8,9.4,8.6"
H,98,1.5,m,
H,99,1.5,m,
H,100,1.72,ddd,"12.4,10.4,7.4"
H,101,1.72,ddd,"12.4,9.4,1.6"
H,102,1.13,s,
H,103,1.13,s,
H,104,1.13,s,
