C,1,15.61,s,
C,2,139.01,s,
C,3,127.36,s,
C,4,18.81,s,
C,5,167.45,s,
O,6,,,
O,7,,,
C,8,78.41,s,
C,9,36.69,s,
C,10,78.41,s,
O,11,,,
C,12,170.18,s,
C,13,21.24,s,
O,14,,,
C,15,42.73,s,
C,16,20.29,s,
C,17,72.44,s,
O,18,,,
C,19,79.25,s,
C,20,53.43,s,
C,21,44.06,s,
C,22,12.18,s,
C,23,48.76,s,
C,24,33.0,s,
C,25,174.0,s,
O,26,,,
O,27,,,
C,28,52.1,s,
C,29,45.62,s,
C,30,20.64,s,
C,31,141.82,s,
C,32,139.32,s,
C,33,15.85,s,
C,34,38.0,s,
C,35,129.97,s,
C,36,133.5,s,
C,37,101.13,s,
O,38,,,
O,39,,,
C,40,166.77,s,
O,41,,,
C,42,35.12,s,
C,43,76.56,s,
O,44,,,
C,45,76.9,s,
H,46,1.9,d,7.0
H,47,1.9,d,7.0
H,48,1.9,d,7.0
H,49,6.46,q,7.0
H,50,1.87,s,
H,51,1.87,s,
H,52,1.87,s,
H,53,4.99,dd,"9.6,8.3"
H,54,2.2,ddd,"12.4,9.6,7.9"
H,55,2.2,ddd,"12.4,8.3,8.2"
H,56,4.68,dd,"8.2,7.9"
H,57,2.01,s,
H,58,2.01,s,
H,59,2.01,s,
H,60,1.2,s,
H,61,1.2,s,
H,62,1.2,s,
H,63,3.55,s,
H,64,3.55,s,
H,65,3.95,dd,"9.6,6.3"
H,66,2.91,d,9.6
H,67,0.92,s,
H,68,0.92,s,
H,69,0.92,s,
H,70,2.73,t,6.5
H,71,2.33,d,6.5
H,72,2.33,d,6.5
H,73,3.61,s,
H,74,3.61,s,
H,75,3.61,s,
H,76,1.27,s,
H,77,1.27,s,
H,78,1.27,s,
H,79,1.68,s,
H,80,1.68,s,
H,81,1.68,s,
H,82,4.09,dd,"13.2,5.1"
H,83,6.44,d,3.7
H,84,5.7,d,3.7
H,85,,,
H,86,1.88,ddd,"13.2,12.4,12.0"
H,87,1.88,ddd,"12.4,6.5,5.1"
H,88,5.53,dd,"12.0,6.5"
H,89,4.25,d,6.3
