C,1,113.69,s,
C,2,142.2,s,
C,3,80.0,s,
C,4,20.45,s,
O,5,,,
C,6,51.75,s,
C,7,74.36,s,
O,8,,,
C,9,35.12,s,
C,10,47.74,s,
C,11,147.87,s,
C,12,107.71,s,
C,13,36.42,s,
C,14,22.6,s,
C,15,41.24,s,
C,16,31.72,s,
C,17,27.83,s,
C,18,27.83,s,
H,19,5.03,dd,"12.0,2.5"
H,20,5.03,dd,"16.0,2.5"
H,21,6.07,dd,"16.0,12.0"
H,22,1.24,s,
H,23,1.24,s,
H,24,1.24,s,
H,25,3.31,s,
H,26,3.31,s,
H,27,3.31,s,
H,28,4.08,t,5.9
H,29,,,
H,30,1.88,dd,"6.5,5.9"
H,31,1.88,dd,"6.5,5.9"
H,32,2.94,t,6.5
H,33,4.81,s,
H,34,4.81,s,
H,35,2.37,ddd,"15.4,11.6,8.8"
H,36,2.37,ddd,"15.4,7.9,0.2"
H,37,1.55,m,
H,38,1.55,m,
H,39,1.28,ddd,"13.4,12.4,2.6"
H,40,1.28,ddd,"12.4,4.2,3.4"
H,41,1.0,s,
H,42,1.0,s,
H,43,1.0,s,
H,44,1.0,s,
H,45,1.0,s,
H,46,1.0,s,
