C,1,57.31,s,
O,2,,,
C,3,162.25,s,
S,4,,,
N,5,,,
C,6,50.28,s,
C,7,139.29,s,
C,8,125.95,s,
C,9,114.5,s,
C,10,157.92,s,
O,11,,,
C,12,100.28,s,
O,13,,,
C,14,68.9,s,
C,15,18.17,s,
C,16,75.52,s,
O,17,,,
C,18,171.09,s,
C,19,20.86,s,
O,20,,,
C,21,70.66,s,
O,22,,,
C,23,170.1,s,
C,24,20.61,s,
O,25,,,
C,26,70.07,s,
O,27,,,
C,28,170.04,s,
C,29,20.7,s,
O,30,,,
C,31,114.5,s,
C,32,125.95,s,
H,33,4.01,s,
H,34,4.01,s,
H,35,4.01,s,
H,36,,,
H,37,4.61,s,
H,38,4.61,s,
H,39,7.0,ddd,"7.4,1.9,0.5"
H,40,6.98,ddd,"7.4,1.9,0.5"
H,41,5.38,d,9.0
H,42,3.92,dq,"6.6,6.1"
H,43,1.18,d,6.1
H,44,1.18,d,6.1
H,45,1.18,d,6.1
H,46,4.81,dd,"6.6,5.7"
H,47,2.1,s,
H,48,2.1,s,
H,49,2.1,s,
H,50,5.45,dd,"10.5,5.7"
H,51,2.03,s,
H,52,2.03,s,
H,53,2.03,s,
H,54,5.37,dd,"10.5,9.0"
H,55,1.99,s,
H,56,1.99,s,
H,57,1.99,s,
H,58,6.98,ddd,"6.9,1.9,0.5"
H,59,7.0,ddd,"6.9,1.9,0.5"
