C,1,53.0,s,
O,2,,,
C,3,171.45,s,
O,4,,,
C,5,61.74,s,
C,6,34.93,s,
C,7,35.7,s,
C,8,36.6,s,
C,9,34.4,s,
C,10,17.5,s,
C,11,46.5,s,
N,12,,,
C,13,53.0,s,
C,14,54.8,s,
C,15,,,
O,16,,,
C,17,43.0,s,
C,18,59.2,s,
C,19,134.28,s,
C,20,120.6,s,
C,21,111.07,s,
C,22,148.66,s,
C,23,137.53,s,
C,24,133.41,s,
N,25,,,
O,26,,,
C,27,101.47,s,
O,28,,,
C,29,68.6,s,
H,30,3.6,s,
H,31,3.6,s,
H,32,3.6,s,
H,33,1.99,ddd,"12.4,11.3,8.6"
H,34,1.99,ddd,"12.4,7.8,1.4"
H,35,1.72,ddd,"12.4,11.3,7.8"
H,36,1.72,ddd,"12.4,8.6,1.4"
H,37,1.72,ddd,"12.4,10.4,8.6"
H,38,1.72,ddd,"12.4,9.8,1.3"
H,39,1.61,m,
H,40,1.61,m,
H,41,2.66,ddd,"12.4,10.8,5.2"
H,42,2.66,ddd,"12.4,10.8,2.5"
H,43,3.31,dd,"9.4,7.9"
H,44,3.31,dd,"9.4,0.8"
H,45,2.83,dd,"7.9,0.8"
H,46,2.57,s,
H,47,2.57,s,
H,48,7.56,d,6.5
H,49,6.84,d,6.5
H,50,,,
H,51,5.94,s,
H,52,5.94,s,
H,53,2.67,s,
