C,1,18.44,s,
C,2,31.27,s,
C,3,18.44,s,
C,4,57.43,s,
N,5,,,
C,6,49.05,s,
C,7,105.64,s,
O,8,,,
O,9,,,
C,10,63.11,s,
C,11,69.19,s,
O,12,,,
C,13,69.65,s,
O,14,,,
C,15,76.45,s,
O,16,,,
C,17,171.86,s,
O,18,,,
N,19,,,
C,20,51.0,s,
C,21,26.1,s,
C,22,29.8,s,
C,23,174.12,s,
O,24,,,
O,25,,,
C,26,175.3,s,
O,27,,,
O,28,,,
H,29,0.96,d,6.4
H,30,0.96,d,6.4
H,31,0.96,d,6.4
H,32,2.03,m,"6.4,5.3"
H,33,0.96,d,6.4
H,34,0.96,d,6.4
H,35,0.96,d,6.4
H,36,4.45,d,5.3
H,37,,,
H,38,3.58,s,
H,39,3.58,s,
H,40,,,
H,41,3.82,dd,"9.4,1.4"
H,42,3.82,dd,"9.4,8.3"
H,43,3.95,ddd,"8.3,1.6,1.4"
H,44,,,
H,45,3.85,dd,"5.1,1.6"
H,46,,,
H,47,4.0,d,5.1
H,48,,,
H,49,8.11,d,7.0
H,50,4.17,dt,"7.0,6.2"
H,51,1.86,td,"6.8,6.2"
H,52,1.86,td,"6.8,6.2"
H,53,2.31,t,6.8
H,54,2.31,t,6.8
H,55,,,
H,56,,,
