C,1,61.8,s,
O,2,,,
C,3,85.36,s,
C,4,72.39,s,
O,5,,,
C,6,102.83,s,
O,7,,,
C,8,77.6,s,
C,9,27.0,s,
C,10,30.5,s,
C,11,35.4,s,
C,12,23.8,s,
C,13,35.7,s,
C,14,21.4,s,
C,15,35.28,s,
C,16,41.86,s,
C,17,72.44,s,
O,18,,,
C,19,88.15,s,
C,20,71.31,s,
O,21,,,
C,22,172.75,s,
O,23,,,
C,24,43.16,s,
C,25,52.87,s,
C,26,20.59,s,
C,27,34.24,s,
C,28,82.97,s,
O,29,,,
C,30,41.33,s,
C,31,24.85,s,
C,32,26.9,s,
C,33,36.7,s,
C,34,30.3,s,
O,35,,,
C,36,70.4,s,
C,37,18.26,s,
C,38,82.85,s,
O,39,,,
C,40,104.9,s,
O,41,,,
C,42,78.18,s,
C,43,62.49,s,
O,44,,,
C,45,71.65,s,
O,46,,,
C,47,78.06,s,
O,48,,,
C,49,75.64,s,
O,50,,,
H,51,3.88,s,
H,52,3.88,s,
H,53,3.88,s,
H,54,3.47,dd,"5.4,1.4"
H,55,3.43,dd,"6.4,1.4"
H,56,,,
H,57,4.82,d,6.4
H,58,3.98,m,
H,59,1.74,m,
H,60,1.74,m,
H,61,1.37,ddd,"12.4,11.7,6.4"
H,62,1.37,ddd,"12.4,6.6,2.3"
H,63,0.88,s,
H,64,0.88,s,
H,65,0.88,s,
H,66,1.61,ddd,"12.8,9.6,5.4"
H,67,1.47,m,
H,68,1.47,m,
H,69,1.72,ddd,"12.4,8.1,1.7"
H,70,1.72,ddd,"12.4,10.3,10.0"
H,71,4.13,s,
H,72,4.13,s,
H,73,4.31,s,
H,74,4.31,s,
H,75,3.01,s,
H,76,3.01,s,
H,77,2.29,dd,"10.2,6.5"
H,78,2.51,m,
H,79,2.51,m,
H,80,1.83,ddd,"12.4,11.6,2.7"
H,81,1.83,ddd,"12.4,11.2,6.4"
H,82,,,
H,83,2.13,ddd,"12.0,9.6,6.4"
H,84,1.48,m,
H,85,1.48,m,
H,86,1.48,dq,"12.4,3.4"
H,87,1.48,m,
H,88,1.09,m,
H,89,1.51,ddd,"12.4,6.4,6.3"
H,90,1.51,ddd,"12.4,2.2,1.8"
H,91,3.62,qd,"6.1,5.4"
H,92,1.6,d,6.1
H,93,1.6,d,6.1
H,94,1.6,d,6.1
H,95,3.38,t,5.4
H,96,4.85,d,0.2
H,97,3.63,dt,"5.8,5.4"
H,98,4.04,d,5.4
H,99,4.04,d,5.4
H,100,,,
H,101,3.82,dd,"5.8,3.1"
H,102,,,
H,103,3.85,dd,"6.0,3.1"
H,104,,,
H,105,3.53,dd,"6.0,0.2"
H,106,,,
