C,1,29.3,s,
C,2,32.23,s,
C,3,29.3,s,
C,4,44.6,s,
C,5,45.2,s,
C,6,140.9,s,
C,7,125.1,s,
C,8,23.77,s,
C,9,47.45,s,
C,10,38.35,s,
C,11,17.05,s,
C,12,46.6,s,
C,13,68.6,s,
O,14,,,
C,15,83.4,s,
O,16,,,
C,17,39.4,s,
C,18,22.7,s,
C,19,22.7,s,
C,20,54.35,s,
C,21,18.17,s,
C,22,32.72,s,
C,23,40.03,s,
C,24,16.93,s,
C,25,39.7,s,
C,26,24.9,s,
C,27,25.1,s,
C,28,26.6,s,
C,29,41.75,s,
C,30,10.65,s,
C,31,76.5,s,
O,32,,,
C,33,42.83,s,
H,34,1.09,s,
H,35,1.09,s,
H,36,1.09,s,
H,37,1.09,s,
H,38,1.09,s,
H,39,1.09,s,
H,40,1.34,dd,"12.4,12.3"
H,41,1.34,dd,"12.4,7.5"
H,42,2.94,dd,"12.3,7.5"
H,43,5.48,dd,"5.2,3.0"
H,44,2.03,ddd,"15.4,8.1,5.2"
H,45,2.03,ddd,"15.4,10.4,3.0"
H,46,1.63,dd,"10.4,8.1"
H,47,1.49,s,
H,48,1.49,s,
H,49,1.49,s,
H,50,2.35,dd,"12.4,7.3"
H,51,2.35,dd,"12.4,8.1"
H,52,4.43,ddd,"8.8,8.1,7.3"
H,53,,,
H,54,3.44,d,8.8
H,55,,,
H,56,1.29,s,
H,57,1.29,s,
H,58,1.29,s,
H,59,1.29,s,
H,60,1.29,s,
H,61,1.29,s,
H,62,1.07,dd,"12.5,3.6"
H,63,1.46,m,
H,64,1.46,m,
H,65,1.49,ddd,"13.2,12.4,4.9"
H,66,1.49,ddd,"12.4,4.7,2.9"
H,67,1.08,s,
H,68,1.08,s,
H,69,1.08,s,
H,70,1.31,s,
H,71,1.31,s,
H,72,1.31,s,
H,73,1.61,ddd,"12.7,12.4,7.0"
H,74,1.61,ddd,"12.4,4.1,2.9"
H,75,1.72,ddd,"12.7,12.4,4.1"
H,76,1.72,ddd,"12.4,7.0,2.9"
H,77,1.13,s,
H,78,1.13,s,
H,79,1.13,s,
H,80,4.12,dd,"3.3,2.2"
H,81,,,
H,82,2.1,dd,"12.4,3.3"
H,83,2.1,dd,"12.4,2.2"
