C,1,15.61,s,
C,2,139.28,s,
C,3,126.82,s,
C,4,20.35,s,
C,5,167.29,s,
O,6,,,
O,7,,,
C,8,73.6,s,
C,9,39.42,s,
C,10,153.03,s,
C,11,58.2,s,
O,12,,,
C,13,140.4,s,
C,14,195.25,s,
O,15,,,
C,16,135.2,s,
C,17,169.85,s,
C,18,18.3,s,
C,19,52.7,s,
C,20,75.65,s,
O,21,,,
C,22,177.5,s,
O,23,,,
C,24,41.4,s,
C,25,15.5,s,
C,26,53.8,s,
H,27,1.9,d,7.0
H,28,1.9,d,7.0
H,29,1.9,d,7.0
H,30,6.46,q,7.0
H,31,1.87,s,
H,32,1.87,s,
H,33,1.87,s,
H,34,5.42,ddd,"6.9,1.9,1.1"
H,35,2.72,dd,"13.4,1.9"
H,36,2.72,dd,"13.4,6.9"
H,37,4.24,s,
H,38,4.24,s,
H,39,,,
H,40,6.2,s,
H,41,2.24,s,
H,42,2.24,s,
H,43,2.24,s,
H,44,3.66,d,10.0
H,45,4.8,dd,"10.0,8.2"
H,46,2.39,dq,"9.2,6.7"
H,47,1.27,d,6.7
H,48,1.27,d,6.7
H,49,1.27,d,6.7
H,50,2.51,ddd,"9.2,8.2,1.1"
