C,1,7.24,s,
C,2,46.55,s,
C,3,172.96,s,
O,4,,,
O,5,,,
C,6,64.45,s,
C,7,41.3,s,
C,8,29.9,s,
C,9,58.25,s,
N,10,,,
C,11,54.85,s,
C,12,33.14,s,
C,13,76.59,s,
O,14,,,
C,15,172.96,s,
O,16,,,
C,17,46.55,s,
C,18,7.24,s,
C,19,77.48,s,
C,20,25.81,s,
O,21,,,
C,22,65.95,s,
H,23,1.22,d,6.8
H,24,1.22,d,6.8
H,25,1.22,d,6.8
H,26,2.71,q,6.8
H,27,4.46,dd,"9.4,0.7"
H,28,4.46,dd,"9.4,7.4"
H,29,2.78,m,
H,30,2.15,m,
H,31,2.15,m,
H,32,2.8,ddd,"10.5,9.4,2.3"
H,33,2.8,ddd,"10.3,9.4,8.6"
H,34,3.05,ddd,"10.2,9.4,0.5"
H,35,3.05,ddd,"11.3,9.4,6.3"
H,36,2.11,m,
H,37,2.11,m,
H,38,4.89,ddd,"9.5,8.0,2.3"
H,39,2.71,q,6.8
H,40,1.22,d,6.8
H,41,1.22,d,6.8
H,42,1.22,d,6.8
H,43,1.4,s,
H,44,1.4,s,
H,45,1.4,s,
H,46,,,
H,47,3.18,dd,"10.3,8.0"
