C,1,21.8,s,
C,2,73.23,s,
O,3,,,
C,4,194.75,s,
O,5,,,
C,6,55.58,s,
N,7,,,
C,8,61.8,s,
C,9,36.0,s,
C,10,25.85,s,
C,11,28.9,s,
C,12,61.2,s,
C,13,50.7,s,
N,14,,,
C,15,151.85,s,
C,16,106.25,s,
C,17,139.43,s,
C,18,116.63,s,
C,19,163.97,s,
O,20,,,
H,21,1.31,d,6.2
H,22,1.31,d,6.2
H,23,1.31,d,6.2
H,24,4.52,q,6.2
H,25,,,
H,26,5.03,s,
H,27,5.03,s,
H,28,3.31,dd,"12.4,10.1"
H,29,3.31,dd,"12.4,5.4"
H,30,2.91,m,
H,31,1.95,ddd,"12.4,2.8,2.6"
H,32,1.95,ddd,"12.4,5.2,2.4"
H,33,2.34,m,
H,34,3.31,dd,"12.4,1.3"
H,35,3.31,dd,"12.4,8.0"
H,36,3.97,dd,"12.4,2.8"
H,37,3.97,dd,"12.4,11.1"
H,38,6.0,dd,"7.3,1.4"
H,39,7.3,dd,"7.3,6.7"
H,40,6.39,dd,"6.7,1.4"
