C,1,56.0,s,
O,2,,,
C,3,150.0,s,
C,4,110.63,s,
C,5,123.9,s,
C,6,122.37,s,
C,7,111.29,s,
C,8,147.0,s,
O,9,,,
C,10,148.66,s,
C,11,111.07,s,
C,12,124.08,s,
C,13,133.62,s,
C,14,114.56,s,
C,15,145.9,s,
O,16,,,
C,17,73.63,s,
O,18,,,
C,19,78.57,s,
S,20,,,
S,21,,,
C,22,78.57,s,
C,23,167.6,s,
O,24,,,
N,25,,,
C,26,28.11,s,
C,27,73.63,s,
O,28,,,
C,29,132.07,s,
C,30,153.07,s,
O,31,,,
C,32,150.18,s,
C,33,102.57,s,
C,34,80.25,s,
O,35,,,
C,36,166.0,s,
O,37,,,
C,38,57.53,s,
N,39,,,
C,40,165.39,s,
O,41,,,
H,42,3.85,s,
H,43,3.85,s,
H,44,3.85,s,
H,45,6.93,dd,"8.6,0.5"
H,46,7.61,dd,"8.6,1.9"
H,47,8.76,dd,"1.9,0.5"
H,48,6.84,dd,"23.3,0.5"
H,49,7.13,dd,"23.3,1.9"
H,50,6.95,dd,"1.9,0.5"
H,51,,,
H,52,4.81,s,
H,53,,,
H,54,3.35,s,
H,55,3.35,s,
H,56,3.35,s,
H,57,5.23,s,
H,58,,,
H,59,6.83,s,
H,60,6.34,d,8.0
H,61,4.99,dd,"8.0,3.2"
H,62,5.34,dd,"8.5,3.2"
H,63,5.38,d,8.5
