C,1,15.61,s,
C,2,138.8,s,
C,3,127.5,s,
C,4,20.5,s,
C,5,167.0,s,
O,6,,,
O,7,,,
C,8,79.1,s,
C,9,36.4,s,
C,10,65.5,s,
C,11,33.7,s,
C,12,66.89,s,
O,13,,,
C,14,166.9,s,
O,15,,,
C,16,120.68,s,
C,17,145.75,s,
C,18,20.45,s,
C,19,169.39,s,
O,20,,,
O,21,,,
C,22,51.81,s,
C,23,32.2,s,
C,24,59.6,s,
N,25,,,
C,26,39.2,s,
H,27,1.9,d,7.0
H,28,1.9,d,7.0
H,29,1.9,d,7.0
H,30,6.46,q,7.0
H,31,1.87,s,
H,32,1.87,s,
H,33,1.87,s,
H,34,5.85,ddd,"9.8,3.2,0.3"
H,35,2.39,ddd,"12.4,8.8,3.2"
H,36,2.39,ddd,"12.4,9.8,0.9"
H,37,3.38,m,
H,38,2.25,ddd,"12.4,8.5,6.3"
H,39,2.25,ddd,"12.4,11.4,1.1"
H,40,5.16,m,
H,41,5.87,s,
H,42,2.06,s,
H,43,2.06,s,
H,44,2.06,s,
H,45,3.72,s,
H,46,3.72,s,
H,47,3.72,s,
H,48,2.18,ddd,"12.4,12.1,4.0"
H,49,2.18,ddd,"12.4,10.3,3.1"
H,50,3.35,ddd,"10.3,4.0,0.3"
H,51,2.59,s,
H,52,2.59,s,
H,53,2.59,s,
