C,1,55.99,s,
O,2,,,
C,3,146.17,s,
C,4,110.47,s,
C,5,138.21,s,
C,6,46.7,s,
C,7,58.42,s,
N,8,,,
C,9,40.72,s,
C,10,24.9,s,
C,11,127.4,s,
C,12,111.8,s,
C,13,147.6,s,
O,14,,,
C,15,55.95,s,
C,16,146.9,s,
O,17,,,
C,18,55.78,s,
C,19,111.2,s,
C,20,130.4,s,
C,21,137.26,s,
C,22,20.01,s,
C,23,115.3,s,
C,24,145.9,s,
O,25,,,
H,26,3.86,s,
H,27,3.86,s,
H,28,3.86,s,
H,29,6.68,d,0.5
H,30,3.01,d,6.2
H,31,3.01,d,6.2
H,32,4.13,t,6.2
H,33,,,
H,34,3.08,ddd,"12.4,3.5,3.1"
H,35,3.08,ddd,"13.4,12.4,2.3"
H,36,2.78,ddd,"15.4,13.4,3.5"
H,37,2.78,ddd,"15.4,3.1,2.3"
H,38,6.55,d,0.5
H,39,3.8,s,
H,40,3.8,s,
H,41,3.8,s,
H,42,3.8,s,
H,43,3.8,s,
H,44,3.8,s,
H,45,6.64,d,0.5
H,46,2.36,s,
H,47,2.36,s,
H,48,2.36,s,
H,49,6.94,d,0.5
H,50,,,
