C,1,122.29,s,
C,2,135.68,s,
C,3,52.53,s,
C,4,70.43,s,
O,5,,,
C,6,167.16,s,
O,7,,,
C,8,122.7,s,
C,9,144.6,s,
C,10,43.27,s,
C,11,22.17,s,
C,12,52.87,s,
C,13,32.6,s,
C,14,175.2,s,
O,15,,,
O,16,,,
C,17,81.82,s,
C,18,25.61,s,
C,19,25.61,s,
C,20,75.32,s,
O,21,,,
C,22,169.62,s,
C,23,20.56,s,
O,24,,,
C,25,48.25,s,
C,26,12.21,s,
C,27,49.64,s,
C,28,131.83,s,
C,29,125.17,s,
C,30,50.97,s,
N,31,,,
C,32,172.36,s,
O,33,,,
C,34,34.01,s,
C,35,47.3,s,
N,36,,,
N,37,,,
C,38,164.56,s,
O,39,,,
C,40,32.7,s,
C,41,59.47,s,
O,42,,,
C,43,71.3,s,
H,44,5.27,s,
H,45,5.27,s,
H,46,3.43,d,10.6
H,47,4.66,dd,"10.6,1.7"
H,48,6.26,d,12.0
H,49,6.3,d,12.0
H,50,0.99,s,
H,51,0.99,s,
H,52,0.99,s,
H,53,2.29,dd,"13.0,6.2"
H,54,2.6,dd,"18.4,13.0"
H,55,2.6,dd,"18.4,6.2"
H,56,1.34,s,
H,57,1.34,s,
H,58,1.34,s,
H,59,1.34,s,
H,60,1.34,s,
H,61,1.34,s,
H,62,5.38,d,1.7
H,63,2.0,s,
H,64,2.0,s,
H,65,2.0,s,
H,66,1.46,s,
H,67,1.46,s,
H,68,1.46,s,
H,69,2.68,dd,"11.6,5.6"
H,70,5.85,dd,"4.3,3.3"
H,71,4.04,dd,"22.4,4.3"
H,72,4.04,dd,"22.4,3.3"
H,73,2.79,t,6.6
H,74,2.79,t,6.6
H,75,3.52,t,6.6
H,76,3.52,t,6.6
H,77,,,
H,78,,,
H,79,,,
H,80,1.88,ddd,"12.4,11.6,5.8"
H,81,1.88,ddd,"12.4,5.6,0.4"
H,82,3.37,dd,"5.8,0.4"
