C,1,21.45,s,
C,2,38.9,s,
C,3,21.45,s,
C,4,78.6,s,
O,5,,,
C,6,26.7,s,
C,7,38.1,s,
C,8,36.86,s,
C,9,18.69,s,
C,10,54.9,s,
C,11,18.17,s,
C,12,33.77,s,
C,13,40.5,s,
C,14,16.1,s,
C,15,54.77,s,
C,16,134.8,s,
C,17,126.6,s,
C,18,136.8,s,
C,19,143.15,s,
C,20,42.24,s,
C,21,41.86,s,
C,22,23.79,s,
C,23,180.49,s,
O,24,,,
O,25,,,
C,26,75.84,s,
O,27,,,
C,28,42.83,s,
C,29,36.2,s,
C,30,24.6,s,
C,31,36.7,s,
C,32,27.77,s,
C,33,42.0,s,
C,34,19.7,s,
H,35,0.94,s,
H,36,0.94,s,
H,37,0.94,s,
H,38,0.94,s,
H,39,0.94,s,
H,40,0.94,s,
H,41,3.32,dd,"8.6,7.6"
H,42,,,
H,43,1.69,m,
H,44,1.69,m,
H,45,1.61,ddd,"13.2,12.4,5.2"
H,46,1.61,ddd,"12.4,5.1,3.1"
H,47,0.82,s,
H,48,0.82,s,
H,49,0.82,s,
H,50,1.07,dd,"12.6,4.0"
H,51,1.46,m,
H,52,1.46,m,
H,53,1.59,ddd,"12.4,3.9,3.0"
H,54,1.59,ddd,"13.4,12.4,5.9"
H,55,1.02,s,
H,56,1.02,s,
H,57,1.02,s,
H,58,2.83,d,2.6
H,59,6.16,dd,"12.0,2.6"
H,60,6.9,d,12.0
H,61,2.43,s,
H,62,2.43,s,
H,63,1.13,s,
H,64,1.13,s,
H,65,1.13,s,
H,66,,,
H,67,4.12,dd,"6.8,1.6"
H,68,,,
H,69,2.1,dd,"12.4,1.6"
H,70,2.1,dd,"12.4,6.8"
H,71,1.18,s,
H,72,1.18,s,
H,73,1.18,s,
H,74,1.72,ddd,"12.4,6.1,3.1"
H,75,1.72,ddd,"13.2,12.4,4.7"
H,76,1.61,ddd,"13.2,12.4,6.1"
H,77,1.61,ddd,"12.4,4.7,3.1"
H,78,0.99,s,
H,79,0.99,s,
H,80,0.99,s,
