C,1,16.8,s,
C,2,32.8,s,
C,3,53.8,s,
C,4,176.9,s,
O,5,,,
O,6,,,
C,7,79.25,s,
C,8,74.22,s,
O,9,,,
C,10,50.23,s,
C,11,50.95,s,
C,12,18.02,s,
C,13,,,
O,14,,,
C,15,127.9,s,
C,16,149.11,s,
C,17,33.95,s,
C,18,19.08,s,
C,19,35.12,s,
C,20,70.48,s,
O,21,,,
C,22,77.86,s,
O,23,,,
C,24,45.62,s,
C,25,20.64,s,
H,26,0.99,d,6.6
H,27,0.99,d,6.6
H,28,0.99,d,6.6
H,29,2.01,qdd,"6.6,3.8,3.2"
H,30,3.08,d,3.2
H,31,4.66,dd,"4.7,3.8"
H,32,4.19,dd,"9.9,4.7"
H,33,,,
H,34,1.95,d,9.9
H,35,1.3,s,
H,36,1.3,s,
H,37,1.3,s,
H,38,6.22,s,
H,39,2.31,dqd,"10.3,6.7,3.5"
H,40,1.42,d,6.7
H,41,1.42,d,6.7
H,42,1.42,d,6.7
H,43,1.88,ddd,"12.4,10.3,9.8"
H,44,1.88,ddd,"12.4,6.2,3.5"
H,45,4.17,ddd,"9.8,6.2,3.8"
H,46,,,
H,47,4.13,d,3.8
H,48,,,
H,49,1.25,s,
H,50,1.25,s,
H,51,1.25,s,
