C,1,55.2,s,
O,2,,,
C,3,157.03,s,
C,4,111.97,s,
C,5,126.82,s,
C,6,134.69,s,
C,7,27.53,s,
C,8,60.2,s,
N,9,,,
C,10,45.25,s,
C,11,45.25,s,
C,12,120.71,s,
C,13,128.32,s,
C,14,36.76,s,
C,15,123.13,s,
C,16,135.0,s,
C,17,23.7,s,
C,18,36.07,s,
C,19,36.29,s,
C,20,128.32,s,
C,21,120.71,s,
C,22,134.69,s,
C,23,27.53,s,
C,24,60.2,s,
N,25,,,
C,26,45.25,s,
C,27,45.25,s,
C,28,126.82,s,
C,29,111.97,s,
C,30,157.03,s,
O,31,,,
C,32,55.2,s,
C,33,40.4,s,
C,34,73.14,s,
C,35,27.64,s,
C,36,27.64,s,
O,37,,,
H,38,3.84,s,
H,39,3.84,s,
H,40,3.84,s,
H,41,7.0,dd,"8.0,0.5"
H,42,6.92,dd,"8.0,1.9"
H,43,2.9,t,6.6
H,44,2.9,t,6.6
H,45,3.34,t,6.6
H,46,3.34,t,6.6
H,47,2.33,s,
H,48,2.33,s,
H,49,2.33,s,
H,50,2.33,s,
H,51,2.33,s,
H,52,2.33,s,
H,53,6.7,dd,"1.9,0.5"
H,54,3.62,dd,"4.8,2.8"
H,55,6.31,d,4.8
H,56,1.75,s,
H,57,1.75,s,
H,58,1.75,s,
H,59,2.2,dd,"15.4,11.6"
H,60,2.2,dd,"15.4,10.2"
H,61,3.31,ddd,"11.6,10.2,8.9"
H,62,6.7,dd,"1.9,0.5"
H,63,2.9,t,6.6
H,64,2.9,t,6.6
H,65,3.34,t,6.6
H,66,3.34,t,6.6
H,67,2.33,s,
H,68,2.33,s,
H,69,2.33,s,
H,70,2.33,s,
H,71,2.33,s,
H,72,2.33,s,
H,73,6.92,dd,"7.5,1.9"
H,74,7.0,dd,"7.5,0.5"
H,75,3.84,s,
H,76,3.84,s,
H,77,3.84,s,
H,78,1.88,dd,"8.9,2.8"
H,79,1.3,s,
H,80,1.3,s,
H,81,1.3,s,
H,82,1.3,s,
H,83,1.3,s,
H,84,1.3,s,
H,85,,,
