C,1,54.9,s,
O,2,,,
C,3,151.1,s,
C,4,122.1,s,
C,5,41.4,s,
C,6,40.8,s,
C,7,45.4,s,
N,8,,,
C,9,42.2,s,
C,10,60.5,s,
C,11,32.7,s,
C,12,129.2,s,
C,13,110.47,s,
C,14,148.97,s,
O,15,,,
C,16,55.95,s,
C,17,148.7,s,
O,18,,,
C,19,55.84,s,
C,20,108.48,s,
C,21,130.7,s,
C,22,161.4,s,
C,23,118.7,s,
C,24,181.3,s,
O,25,,,
H,26,3.87,s,
H,27,3.87,s,
H,28,3.87,s,
H,29,6.25,s,
H,30,2.18,ddd,"12.4,11.9,6.6"
H,31,2.18,ddd,"12.4,6.4,2.0"
H,32,2.58,ddd,"12.4,6.6,2.0"
H,33,2.58,ddd,"12.4,11.9,6.4"
H,34,2.35,s,
H,35,2.35,s,
H,36,2.35,s,
H,37,4.58,dd,"9.8,1.2"
H,38,3.01,dd,"15.4,1.2"
H,39,3.01,dd,"15.4,9.8"
H,40,6.68,d,0.5
H,41,3.8,s,
H,42,3.8,s,
H,43,3.8,s,
H,44,3.8,s,
H,45,3.8,s,
H,46,3.8,s,
H,47,6.57,d,0.5
H,48,6.22,s,
