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,17,124.71,s,
C,18,137.7,s,
C,19,82.4,s,
C,20,24.7,s,
C,21,24.7,s,
O,22,,,
O,23,,,
C,24,117.1,s,
C,25,120.7,s,
H,26,3.7,s,
H,27,3.7,s,
H,28,3.7,s,
H,29,7.56,ddd,"6.3,1.4,0.5"
H,30,7.35,ddd,"8.4,6.3,1.4"
H,31,7.43,ddd,"8.4,7.3,1.4"
H,32,7.32,ddd,"7.3,1.4,0.5"
H,33,1.44,s,
H,34,1.44,s,
H,35,1.44,s,
H,36,2.3,d,7.0
H,37,2.3,d,7.0
H,38,5.78,dt,"15.0,7.0"
H,39,5.62,d,15.0
H,40,1.47,s,
H,41,1.47,s,
H,42,1.47,s,
H,43,1.47,s,
H,44,1.47,s,
H,45,1.47,s,
H,46,,,
H,47,5.99,d,10.6
H,48,6.9,d,10.6
