C,1,127.89,s,
C,2,134.42,s,
C,3,37.54,s,
C,4,169.1,s,
O,5,,,
O,6,,,
C,7,66.89,s,
C,8,33.7,s,
C,9,59.99,s,
C,10,36.4,s,
C,11,79.1,s,
O,12,,,
C,13,167.0,s,
O,14,,,
C,15,127.5,s,
C,16,20.5,s,
C,17,138.8,s,
C,18,15.61,s,
C,19,59.6,s,
C,20,32.2,s,
N,21,,,
C,22,41.2,s,
C,23,167.65,s,
O,24,,,
O,25,,,
C,26,51.75,s,
H,27,6.03,s,
H,28,6.03,s,
H,29,3.33,s,
H,30,3.33,s,
H,31,5.05,m,
H,32,2.13,ddd,"12.4,9.2,4.7"
H,33,2.13,ddd,"12.4,11.9,1.3"
H,34,3.66,m,
H,35,2.39,ddd,"12.4,9.5,1.7"
H,36,2.39,ddd,"12.4,8.7,1.9"
H,37,5.85,ddd,"8.7,1.7,0.6"
H,38,1.87,s,
H,39,1.87,s,
H,40,1.87,s,
H,41,6.46,q,7.0
H,42,1.9,d,7.0
H,43,1.9,d,7.0
H,44,1.9,d,7.0
H,45,3.35,ddd,"9.7,3.8,0.6"
H,46,2.18,ddd,"12.4,12.1,3.8"
H,47,2.18,ddd,"12.4,9.7,1.9"
H,48,2.82,s,
H,49,2.82,s,
H,50,2.82,s,
H,51,3.73,s,
H,52,3.73,s,
H,53,3.73,s,
