C,1,112.6,s,
C,2,147.0,s,
C,3,30.7,s,
C,4,31.21,s,
C,5,43.1,s,
C,6,25.65,s,
C,7,25.5,s,
C,8,133.64,s,
C,9,132.07,s,
C,10,37.99,s,
C,11,28.9,s,
C,12,28.9,s,
C,13,92.26,s,
O,14,,,
C,15,30.5,s,
C,16,140.22,s,
C,17,19.64,s,
C,18,129.72,s,
C,19,69.3,s,
O,20,,,
C,21,44.7,s,
N,22,,,
C,23,165.4,s,
O,24,,,
H,25,5.27,s,
H,26,5.27,s,
H,27,2.36,ddd,"15.4,13.3,0.9"
H,28,2.36,ddd,"15.4,13.1,5.6"
H,29,1.61,m,
H,30,1.61,m,
H,31,1.61,m,
H,32,1.8,m,
H,33,1.8,m,
H,34,2.42,ddd,"15.4,9.7,9.3"
H,35,2.42,ddd,"15.4,8.7,1.6"
H,36,1.25,s,
H,37,1.25,s,
H,38,1.25,s,
H,39,1.25,s,
H,40,1.25,s,
H,41,1.25,s,
H,42,,,
H,43,2.05,s,
H,44,2.05,s,
H,45,1.75,s,
H,46,1.75,s,
H,47,1.75,s,
H,48,5.07,d,11.6
H,49,4.57,ddd,"11.6,8.5,1.6"
H,50,,,
H,51,2.63,dd,"15.4,1.6"
H,52,2.63,dd,"15.4,8.5"
H,53,8.52,s,
