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,18,141.3,s,
C,19,70.66,s,
C,20,29.77,s,
C,21,29.77,s,
O,22,,,
C,23,117.1,s,
C,24,120.7,s,
H,25,3.7,s,
H,26,3.7,s,
H,27,3.7,s,
H,28,7.56,ddd,"7.1,1.4,0.5"
H,29,7.35,ddd,"7.1,6.4,1.4"
H,30,7.43,ddd,"7.0,6.4,1.4"
H,31,7.32,ddd,"7.0,1.4,0.5"
H,32,1.44,s,
H,33,1.44,s,
H,34,1.44,s,
H,35,2.3,d,7.0
H,36,2.3,d,7.0
H,37,5.78,dt,"15.0,7.0"
H,38,5.94,d,15.0
H,39,1.55,s,
H,40,1.55,s,
H,41,1.55,s,
H,42,1.55,s,
H,43,1.55,s,
H,44,1.55,s,
H,45,,,
H,46,5.99,d,10.6
H,47,6.9,d,10.6
