C,1,12.85,s,
C,2,120.71,s,
C,3,142.04,s,
C,4,51.9,s,
N,5,,,
C,6,42.3,s,
C,7,62.1,s,
C,8,38.34,s,
C,9,53.0,s,
C,10,174.7,s,
O,11,,,
N,12,,,
O,13,,,
C,14,63.4,s,
C,15,138.3,s,
C,16,107.2,s,
C,17,128.1,s,
C,18,123.7,s,
C,19,125.5,s,
C,20,132.0,s,
C,21,78.41,s,
C,22,35.12,s,
C,23,42.38,s,
C,24,40.4,s,
C,25,70.43,s,
O,26,,,
H,27,1.65,d,7.0
H,28,1.65,d,7.0
H,29,1.65,d,7.0
H,30,5.45,q,7.0
H,31,3.77,s,
H,32,3.77,s,
H,33,2.61,s,
H,34,2.61,s,
H,35,2.61,s,
H,36,3.6,ddd,"7.7,4.8,3.5"
H,37,2.15,dd,"12.4,4.8"
H,38,2.15,dd,"12.4,3.5"
H,39,3.73,s,
H,40,3.73,s,
H,41,3.73,s,
H,42,7.14,ddd,"8.2,1.4,0.5"
H,43,7.23,ddd,"8.2,7.5,1.4"
H,44,6.94,ddd,"7.5,7.4,1.4"
H,45,7.25,ddd,"7.4,1.4,0.5"
H,46,4.77,dd,"8.5,0.7"
H,47,1.88,ddd,"12.4,9.3,8.5"
H,48,1.88,ddd,"12.4,7.8,0.7"
H,49,2.99,ddd,"9.3,7.8,3.7"
H,50,2.83,m,
H,51,4.04,dd,"9.4,5.4"
H,52,4.04,dd,"9.4,0.7"
