C,1,55.99,s,
O,2,,,
C,3,145.52,s,
C,4,110.6,s,
C,5,124.7,s,
C,6,129.6,s,
C,7,113.4,s,
C,8,143.4,s,
O,9,,,
C,10,64.4,s,
C,11,40.4,s,
C,12,127.97,s,
C,13,121.5,s,
C,14,111.61,s,
C,15,150.0,s,
O,16,,,
C,17,56.0,s,
C,18,147.0,s,
O,19,,,
C,20,155.6,s,
C,21,116.7,s,
C,22,130.5,s,
C,23,134.0,s,
C,24,39.1,s,
C,25,64.7,s,
C,26,129.88,s,
C,27,110.33,s,
C,28,147.71,s,
O,29,,,
C,30,56.02,s,
C,31,145.64,s,
O,32,,,
C,33,114.6,s,
C,34,124.05,s,
C,35,24.2,s,
C,36,46.9,s,
N,37,,,
C,38,42.39,s,
C,39,130.5,s,
C,40,116.7,s,
C,41,110.67,s,
N,42,,,
C,43,42.27,s,
C,44,46.63,s,
C,45,24.4,s,
H,46,3.86,s,
H,47,3.86,s,
H,48,3.86,s,
H,49,6.65,d,0.5
H,50,6.69,d,0.5
H,51,,,
H,52,4.39,t,6.2
H,53,3.01,d,6.2
H,54,3.01,d,6.2
H,55,6.59,dd,"6.2,1.9"
H,56,6.82,dd,"6.2,0.5"
H,57,3.85,s,
H,58,3.85,s,
H,59,3.85,s,
H,60,7.09,ddd,"7.1,1.9,0.5"
H,61,7.22,ddd,"7.1,1.9,0.5"
H,62,3.66,d,6.2
H,63,3.66,d,6.2
H,64,4.39,t,6.2
H,65,6.64,d,0.5
H,66,3.86,s,
H,67,3.86,s,
H,68,3.86,s,
H,69,,,
H,70,6.63,d,0.5
H,71,2.85,ddd,"15.4,11.0,3.2"
H,72,2.85,ddd,"15.4,11.3,4.7"
H,73,2.78,ddd,"12.4,11.0,4.7"
H,74,2.78,ddd,"12.4,11.3,3.2"
H,75,2.54,s,
H,76,2.54,s,
H,77,2.54,s,
H,78,7.22,ddd,"8.0,1.9,0.5"
H,79,7.09,ddd,"8.0,1.9,0.5"
H,80,4.49,dd,"1.9,0.5"
H,81,2.54,s,
H,82,2.54,s,
H,83,2.54,s,
H,84,2.78,ddd,"12.4,9.9,8.8"
H,85,2.78,ddd,"12.4,8.3,1.1"
H,86,2.85,ddd,"15.4,8.8,1.1"
H,87,2.85,ddd,"15.4,9.9,8.3"
