C,1,28.2,s,
N,2,,,
C,3,161.0,s,
O,4,,,
C,5,105.85,s,
C,6,163.15,s,
C,7,116.83,s,
C,8,123.0,s,
C,9,122.51,s,
C,10,130.99,s,
C,11,114.6,s,
C,12,139.63,s,
O,13,,,
C,14,81.42,s,
C,15,26.63,s,
C,16,37.62,s,
C,17,131.87,s,
C,18,144.6,s,
C,19,44.7,s,
C,20,24.46,s,
C,21,24.46,s,
C,22,180.49,s,
O,23,,,
O,24,,,
C,25,117.1,s,
C,26,120.7,s,
H,27,3.7,s,
H,28,3.7,s,
H,29,3.7,s,
H,30,7.56,ddd,"7.1,1.4,0.5"
H,31,7.35,ddd,"7.1,6.9,1.4"
H,32,7.43,ddd,"9.1,6.9,1.4"
H,33,7.32,ddd,"9.1,1.4,0.5"
H,34,1.44,s,
H,35,1.44,s,
H,36,1.44,s,
H,37,2.3,d,7.0
H,38,2.3,d,7.0
H,39,5.86,dt,"15.0,7.0"
H,40,5.62,d,15.0
H,41,1.34,s,
H,42,1.34,s,
H,43,1.34,s,
H,44,1.34,s,
H,45,1.34,s,
H,46,1.34,s,
H,47,,,
H,48,5.99,d,11.0
H,49,6.9,d,11.0
