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,7,35.28,s,
C,8,41.86,s,
C,9,144.6,s,
C,10,124.8,s,
C,11,50.66,s,
N,12,,,
C,13,53.0,s,
C,14,54.8,s,
C,15,,,
O,16,,,
C,17,49.84,s,
C,18,59.2,s,
C,19,134.28,s,
C,20,124.58,s,
C,21,123.0,s,
C,22,110.31,s,
C,23,143.48,s,
O,24,,,
C,25,55.76,s,
C,26,133.41,s,
N,27,,,
C,28,71.28,s,
H,29,3.6,s,
H,30,3.6,s,
H,31,3.6,s,
H,32,1.99,ddd,"12.4,10.0,8.6"
H,33,1.99,ddd,"12.4,8.8,1.6"
H,34,1.72,ddd,"12.4,10.0,8.8"
H,35,1.72,ddd,"12.4,8.6,1.6"
H,36,6.3,d,9.7
H,37,5.59,ddd,"9.7,4.8,3.0"
H,38,4.04,dd,"15.4,3.0"
H,39,4.04,dd,"15.4,4.8"
H,40,3.31,dd,"9.4,8.4"
H,41,3.31,dd,"9.4,0.8"
H,42,2.83,dd,"8.4,0.8"
H,43,2.57,s,
H,44,2.57,s,
H,45,7.25,dd,"6.6,1.4"
H,46,6.9,dd,"9.0,6.6"
H,47,6.77,dd,"9.0,1.4"
H,48,3.83,s,
H,49,3.83,s,
H,50,3.83,s,
H,51,,,
H,52,2.67,s,
