C,1,57.81,s,
O,2,,,
C,3,73.63,s,
C,4,158.0,s,
N,5,,,
O,6,,,
C,7,30.5,s,
C,8,83.38,s,
O,9,,,
C,10,94.2,s,
C,11,28.8,s,
N,12,,,
C,13,139.5,s,
C,14,113.4,s,
C,15,126.5,s,
C,16,120.8,s,
C,17,127.2,s,
C,18,124.5,s,
C,19,115.87,s,
C,20,130.1,s,
C,21,130.1,s,
C,22,115.87,s,
C,23,124.5,s,
C,24,127.2,s,
C,25,120.8,s,
C,26,126.5,s,
C,27,109.4,s,
C,28,137.8,s,
N,29,,,
C,30,131.5,s,
C,31,130.91,s,
C,32,162.36,s,
O,33,,,
N,34,,,
C,35,167.42,s,
O,36,,,
H,37,3.43,s,
H,38,3.43,s,
H,39,3.43,s,
H,40,4.73,s,
H,41,,,
H,42,3.63,dd,"15.4,10.8"
H,43,3.63,dd,"15.4,7.1"
H,44,7.04,dd,"10.8,7.1"
H,45,2.47,s,
H,46,2.47,s,
H,47,2.47,s,
H,48,8.04,ddd,"8.8,1.4,0.5"
H,49,7.53,ddd,"8.8,6.0,1.4"
H,50,7.34,ddd,"9.1,6.0,1.4"
H,51,9.31,ddd,"9.1,1.4,0.5"
H,52,9.31,ddd,"9.0,1.4,0.5"
H,53,7.34,ddd,"9.0,7.0,1.4"
H,54,7.54,ddd,"8.3,7.0,1.4"
H,55,7.5,ddd,"8.3,1.4,0.5"
H,56,,,
