C,1,56.98,s,
O,2,,,
C,3,155.87,s,
C,4,107.15,s,
C,5,129.3,s,
C,6,124.41,s,
C,7,145.43,s,
C,8,139.54,s,
O,9,,,
C,10,60.99,s,
O,11,,,
C,12,145.43,s,
C,13,144.25,s,
O,14,,,
C,15,118.5,s,
C,16,125.66,s,
C,17,126.3,s,
C,18,129.11,s,
C,19,56.7,s,
C,20,36.5,s,
N,21,,,
C,22,42.4,s,
C,23,47.5,s,
C,24,26.0,s,
H,25,3.86,s,
H,26,3.86,s,
H,27,3.86,s,
H,28,6.6,d,9.0
H,29,6.9,d,9.0
H,30,3.81,s,
H,31,3.81,s,
H,32,3.81,s,
H,33,,,
H,34,6.8,d,8.4
H,35,6.87,d,8.4
H,36,4.39,dd,"12.3,3.0"
H,37,3.01,dd,"13.4,12.3"
H,38,3.01,dd,"13.4,3.0"
H,39,2.53,s,
H,40,2.53,s,
H,41,2.53,s,
H,42,2.78,ddd,"12.4,6.8,1.8"
H,43,2.78,ddd,"12.4,12.0,7.2"
H,44,2.85,ddd,"15.4,7.2,1.8"
H,45,2.85,ddd,"15.4,12.0,6.8"
