C,1,21.75,s,
C,2,137.7,s,
C,3,127.35,s,
C,4,131.05,s,
C,5,115.2,s,
C,6,156.3,s,
O,7,,,
C,8,166.77,s,
O,9,,,
C,10,114.38,s,
C,11,163.15,s,
C,12,114.6,s,
O,13,,,
C,14,87.86,s,
C,15,25.04,s,
C,16,25.04,s,
C,17,149.8,s,
C,18,132.07,s,
C,19,75.0,s,
O,20,,,
C,21,77.48,s,
C,22,25.81,s,
O,23,,,
C,24,35.22,s,
C,25,31.9,s,
H,26,2.36,s,
H,27,2.36,s,
H,28,2.36,s,
H,29,7.18,dd,"7.1,1.4"
H,30,7.19,dd,"7.5,7.1"
H,31,6.95,dd,"7.5,1.4"
H,32,1.16,s,
H,33,1.16,s,
H,34,1.16,s,
H,35,1.16,s,
H,36,1.16,s,
H,37,1.16,s,
H,38,4.01,s,
H,39,,,
H,40,1.4,s,
H,41,1.4,s,
H,42,1.4,s,
H,43,,,
H,44,1.9,ddd,"12.4,11.1,1.6"
H,45,1.9,ddd,"12.4,10.8,7.0"
H,46,2.37,ddd,"15.4,11.1,7.0"
H,47,2.37,ddd,"15.4,10.8,1.6"
