C,1,21.0,s,
C,2,170.2,s,
O,3,,,
O,4,,,
C,5,72.56,s,
C,6,17.64,s,
C,7,75.46,s,
C,8,130.07,s,
C,9,132.07,s,
C,10,133.0,s,
C,11,144.23,s,
C,12,21.17,s,
C,13,157.99,s,
N,14,,,
C,15,48.69,s,
C,16,31.28,s,
C,17,60.94,s,
O,18,,,
C,19,77.48,s,
O,20,,,
C,21,176.11,s,
O,22,,,
C,23,34.98,s,
C,24,18.44,s,
C,25,18.44,s,
H,26,2.04,s,
H,27,2.04,s,
H,28,2.04,s,
H,29,3.91,qd,"6.2,5.0"
H,30,1.3,d,6.2
H,31,1.3,d,6.2
H,32,1.3,d,6.2
H,33,4.98,dd,"7.0,5.0"
H,34,5.77,d,7.0
H,35,7.39,s,
H,36,2.22,s,
H,37,2.22,s,
H,38,2.22,s,
H,39,3.5,ddd,"12.8,12.4,1.9"
H,40,3.5,ddd,"12.4,4.6,2.5"
H,41,2.08,m,
H,42,2.08,ddd,"12.8,12.4,4.6"
H,43,3.37,d,5.5
H,44,2.54,m,6.6
H,45,1.14,d,6.6
H,46,1.14,d,6.6
H,47,1.14,d,6.6
H,48,1.14,d,6.6
H,49,1.14,d,6.6
H,50,1.14,d,6.6
