C,1,22.13,s,
C,2,138.93,s,
C,3,22.13,s,
C,4,119.57,s,
C,5,65.38,s,
O,6,,,
C,7,161.0,s,
C,8,115.01,s,
C,9,129.14,s,
C,10,127.7,s,
C,11,37.1,s,
C,12,65.0,s,
C,13,169.5,s,
O,14,,,
N,15,,,
C,16,37.35,s,
C,17,196.26,s,
S,18,,,
C,19,167.36,s,
O,20,,,
N,21,,,
C,22,31.45,s,
C,23,129.14,s,
C,24,115.01,s,
H,25,1.77,s,
H,26,1.77,s,
H,27,1.77,s,
H,28,1.77,s,
H,29,1.77,s,
H,30,1.77,s,
H,31,5.6,t,7.0
H,32,4.57,d,7.0
H,33,4.57,d,7.0
H,34,6.85,ddd,"8.2,1.9,0.5"
H,35,7.22,ddd,"8.2,1.9,0.5"
H,36,3.18,d,6.5
H,37,3.18,d,6.5
H,38,4.49,t,6.5
H,39,3.01,s,
H,40,3.01,s,
H,41,3.01,s,
H,42,2.91,s,
H,43,2.91,s,
H,44,2.91,s,
H,45,7.22,ddd,"9.1,1.9,0.5"
H,46,6.85,ddd,"9.1,1.9,0.5"
