C,1,20.56,s,
C,2,69.52,s,
O,3,,,
C,4,53.83,s,
C,5,102.94,s,
O,6,,,
C,7,99.82,s,
O,8,,,
C,9,78.14,s,
C,10,62.29,s,
O,11,,,
C,12,71.15,s,
O,13,,,
C,14,77.8,s,
O,15,,,
C,16,74.56,s,
O,17,,,
O,18,,,
C,19,152.85,s,
C,20,110.35,s,
C,21,164.7,s,
O,22,,,
O,23,,,
C,24,68.1,s,
C,25,27.2,s,
C,26,33.48,s,
H,27,1.2,d,6.1
H,28,1.2,d,6.1
H,29,1.2,d,6.1
H,30,3.98,qd,"6.1,5.1"
H,31,,,
H,32,3.05,ddd,"9.9,5.4,5.1"
H,33,5.23,d,9.9
H,34,4.66,d,8.5
H,35,3.26,td,"5.4,4.9"
H,36,4.04,d,5.4
H,37,4.04,d,5.4
H,38,,,
H,39,3.66,dd,"7.9,4.9"
H,40,,,
H,41,3.32,dd,"10.6,7.9"
H,42,,,
H,43,3.23,dd,"10.6,8.5"
H,44,,,
H,45,7.5,s,
H,46,4.46,ddd,"9.4,5.4,2.5"
H,47,4.46,ddd,"13.3,9.4,3.7"
H,48,1.76,m,
H,49,1.76,m,
H,50,3.09,ddd,"11.9,5.4,1.6"
