C,1,16.4,s,
C,2,36.72,s,
C,3,28.78,s,
C,4,37.7,s,
C,5,36.59,s,
C,6,34.98,s,
C,7,138.38,s,
C,8,67.0,s,
O,9,,,
C,10,166.77,s,
O,11,,,
C,12,41.64,s,
C,13,166.77,s,
O,14,,,
O,15,,,
C,16,67.0,s,
C,17,138.38,s,
C,18,129.57,s,
C,19,24.3,s,
C,20,17.55,s,
C,21,45.36,s,
C,22,36.59,s,
C,23,34.98,s,
C,24,37.7,s,
C,25,28.78,s,
C,26,36.72,s,
C,27,16.4,s,
C,28,38.95,s,
C,29,20.86,s,
C,30,35.28,s,
C,31,18.99,s,
C,32,125.46,s,
C,33,111.36,s,
C,34,143.29,s,
O,35,,,
C,36,139.08,s,
C,37,129.57,s,
C,38,24.3,s,
C,39,17.55,s,
C,40,45.36,s,
C,41,38.95,s,
C,42,20.86,s,
C,43,35.28,s,
C,44,18.99,s,
C,45,125.46,s,
C,46,111.36,s,
C,47,143.29,s,
O,48,,,
C,49,139.08,s,
H,50,0.82,d,6.6
H,51,0.82,d,6.6
H,52,0.82,d,6.6
H,53,1.51,qdd,"6.6,3.4,2.5"
H,54,1.49,m,
H,55,1.49,m,
H,56,1.93,ddd,"12.4,12.3,6.2"
H,57,1.93,ddd,"12.4,5.6,3.0"
H,58,1.08,s,
H,59,1.08,s,
H,60,1.08,s,
H,61,4.78,s,
H,62,4.78,s,
H,63,3.41,s,
H,64,3.41,s,
H,65,4.78,s,
H,66,4.78,s,
H,67,5.54,dd,"6.0,3.4"
H,68,2.35,m,
H,69,2.35,m,
H,70,1.58,m,
H,71,1.58,m,
H,72,1.21,dd,"13.3,5.8"
H,73,1.08,s,
H,74,1.08,s,
H,75,1.08,s,
H,76,1.93,td,"12.4,3.0"
H,77,1.93,ddd,"12.4,12.1,2.3"
H,78,1.49,m,
H,79,1.49,tdd,"12.4,7.8,2.3"
H,80,1.51,ddq,"10.4,7.8,6.6"
H,81,0.82,d,6.6
H,82,0.82,d,6.6
H,83,0.82,d,6.6
H,84,0.99,s,
H,85,0.99,s,
H,86,0.99,s,
H,87,1.72,t,6.9
H,88,1.72,t,6.9
H,89,2.42,t,6.9
H,90,2.42,t,6.9
H,91,6.28,dd,"2.0,1.9"
H,92,7.35,d,2.0
H,93,7.23,d,1.9
H,94,5.54,dd,"6.1,2.8"
H,95,2.35,m,
H,96,2.35,m,
H,97,1.58,m,
H,98,1.58,m,
H,99,1.21,dd,"9.3,1.6"
H,100,0.99,s,
H,101,0.99,s,
H,102,0.99,s,
H,103,1.72,t,6.9
H,104,1.72,t,6.9
H,105,2.42,t,6.9
H,106,2.42,t,6.9
H,107,6.28,dd,"2.2,1.9"
H,108,7.35,d,2.2
H,109,7.23,d,1.9
