C,1,16.35,s,
C,2,42.4,s,
C,3,26.9,s,
C,4,38.5,s,
C,5,48.3,s,
C,6,180.6,s,
O,7,,,
O,8,,,
C,9,26.3,s,
C,10,29.3,s,
C,11,42.1,s,
C,12,24.65,s,
C,13,140.1,s,
C,14,127.6,s,
C,15,24.2,s,
C,16,47.49,s,
C,17,36.56,s,
C,18,15.24,s,
C,19,38.52,s,
C,20,27.2,s,
C,21,78.78,s,
O,22,,,
C,23,38.55,s,
C,24,21.96,s,
C,25,21.96,s,
C,26,55.05,s,
C,27,17.98,s,
C,28,32.72,s,
C,29,40.4,s,
C,30,17.21,s,
C,31,54.6,s,
C,32,72.65,s,
C,33,27.1,s,
O,34,,,
H,35,1.05,d,6.6
H,36,1.05,d,6.6
H,37,1.05,d,6.6
H,38,1.19,qdd,"6.6,4.9,2.1"
H,39,1.77,m,
H,40,1.77,m,
H,41,1.72,ddd,"12.4,12.2,2.6"
H,42,1.72,ddd,"12.4,3.4,0.8"
H,43,,,
H,44,3.16,ddd,"13.0,12.4,5.1"
H,45,3.16,ddd,"12.4,4.1,2.9"
H,46,1.65,ddd,"12.4,5.1,2.9"
H,47,1.65,ddd,"13.0,12.4,4.1"
H,48,1.41,s,
H,49,1.41,s,
H,50,1.41,s,
H,51,5.52,dd,"4.1,3.3"
H,52,1.93,ddd,"15.4,11.7,4.1"
H,53,1.93,ddd,"15.4,8.9,3.3"
H,54,1.82,dd,"11.7,8.9"
H,55,0.88,s,
H,56,0.88,s,
H,57,0.88,s,
H,58,1.62,ddd,"12.4,6.4,2.4"
H,59,1.62,ddd,"12.4,11.8,7.0"
H,60,1.74,m,
H,61,1.74,m,
H,62,3.32,dd,"6.9,1.6"
H,63,,,
H,64,0.94,s,
H,65,0.94,s,
H,66,0.94,s,
H,67,0.94,s,
H,68,0.94,s,
H,69,0.94,s,
H,70,0.9,dd,"9.8,8.3"
H,71,1.6,m,
H,72,1.6,m,
H,73,1.49,ddd,"12.4,9.4,9.0"
H,74,1.49,ddd,"12.4,10.0,1.2"
H,75,1.08,s,
H,76,1.08,s,
H,77,1.08,s,
H,78,3.05,s,
H,79,1.3,s,
H,80,1.3,s,
H,81,1.3,s,
H,82,,,
