C,1,55.95,s,
O,2,,,
C,3,147.21,s,
C,4,109.33,s,
C,5,126.57,s,
C,6,129.5,s,
C,7,110.27,s,
C,8,147.3,s,
O,9,,,
C,10,55.78,s,
C,11,59.08,s,
C,12,36.04,s,
C,13,138.21,s,
C,14,114.6,s,
C,15,152.36,s,
O,16,,,
C,17,137.88,s,
O,18,,,
C,19,61.43,s,
C,20,140.4,s,
O,21,,,
C,22,60.98,s,
C,23,127.6,s,
C,24,53.8,s,
N,25,,,
C,26,51.3,s,
C,27,28.9,s,
H,28,3.8,s,
H,29,3.8,s,
H,30,3.8,s,
H,31,6.61,s,
H,32,6.61,s,
H,33,3.8,s,
H,34,3.8,s,
H,35,3.8,s,
H,36,2.2,dd,"9.2,8.7"
H,37,2.9,dd,"15.4,9.2"
H,38,2.9,dd,"15.4,8.7"
H,39,6.63,s,
H,40,,,
H,41,3.95,s,
H,42,3.95,s,
H,43,3.95,s,
H,44,3.84,s,
H,45,3.84,s,
H,46,3.84,s,
H,47,4.25,s,
H,48,4.25,s,
H,49,3.05,ddd,"13.1,12.4,4.9"
H,50,3.05,ddd,"12.4,5.9,1.2"
H,51,3.09,ddd,"15.4,13.1,5.9"
H,52,3.09,ddd,"15.4,4.9,1.2"
