C,1,56.0,s,
O,2,,,
C,3,150.0,s,
C,4,111.61,s,
C,5,121.5,s,
C,6,127.97,s,
C,7,110.67,s,
C,8,147.0,s,
O,9,,,
C,10,155.6,s,
C,11,116.7,s,
C,12,130.5,s,
C,13,134.0,s,
C,14,130.5,s,
C,15,116.7,s,
C,16,39.1,s,
C,17,64.7,s,
C,18,129.88,s,
C,19,110.33,s,
C,20,148.66,s,
C,21,148.66,s,
C,22,110.47,s,
C,23,126.18,s,
C,24,25.2,s,
C,25,47.8,s,
N,26,,,
C,27,42.39,s,
O,28,,,
C,29,137.25,s,
C,30,151.83,s,
O,31,,,
C,32,56.31,s,
C,33,110.47,s,
C,34,124.1,s,
C,35,129.11,s,
C,36,145.43,s,
O,37,,,
C,38,59.05,s,
C,39,41.4,s,
N,40,,,
C,41,42.23,s,
C,42,43.84,s,
C,43,23.3,s,
H,44,3.85,s,
H,45,3.85,s,
H,46,3.85,s,
H,47,6.82,dd,"8.4,0.5"
H,48,6.59,dd,"8.4,1.9"
H,49,4.49,dd,"1.9,0.5"
H,50,7.09,ddd,"21.4,1.9,0.5"
H,51,7.22,ddd,"21.4,1.9,0.5"
H,52,7.22,ddd,"23.6,1.9,0.5"
H,53,7.09,ddd,"23.6,1.9,0.5"
H,54,3.66,dd,"15.4,5.2"
H,55,3.66,dd,"15.4,10.7"
H,56,4.39,dd,"10.7,5.2"
H,57,6.64,d,0.5
H,58,6.68,d,0.5
H,59,2.85,dd,"15.4,7.5"
H,60,2.85,ddd,"15.4,11.5,8.4"
H,61,2.78,ddd,"12.4,11.5,7.5"
H,62,2.78,dd,"12.4,8.4"
H,63,2.54,s,
H,64,2.54,s,
H,65,2.54,s,
H,66,3.87,s,
H,67,3.87,s,
H,68,3.87,s,
H,69,6.46,s,
H,70,4.39,dd,"6.0,4.3"
H,71,3.01,dd,"15.4,6.0"
H,72,3.01,dd,"15.4,4.3"
H,73,2.53,s,
H,74,2.53,s,
H,75,2.53,s,
H,76,2.78,ddd,"12.4,11.0,5.7"
H,77,2.78,ddd,"12.4,11.0,2.7"
H,78,2.85,ddd,"15.4,11.0,5.7"
H,79,2.85,ddd,"15.4,11.0,2.7"
