C,1,56.0,s,
O,2,,,
C,3,150.0,s,
C,4,111.61,s,
C,5,126.82,s,
C,6,134.69,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,17,64.5,s,
C,18,129.8,s,
C,19,111.9,s,
C,20,147.0,s,
C,21,146.35,s,
O,22,,,
C,23,55.45,s,
C,24,112.5,s,
C,25,127.3,s,
C,26,25.52,s,
C,27,47.8,s,
N,28,,,
C,29,42.39,s,
O,30,,,
C,31,153.21,s,
C,32,167.77,s,
O,33,,,
C,34,157.5,s,
O,35,,,
C,36,56.44,s,
C,37,105.31,s,
C,38,133.27,s,
C,39,121.8,s,
C,40,142.79,s,
N,41,,,
C,42,47.61,s,
C,43,133.43,s,
C,44,126.45,s,
C,45,30.5,s,
H,46,3.85,s,
H,47,3.85,s,
H,48,3.85,s,
H,49,6.77,dd,"9.5,0.5"
H,50,6.45,dd,"9.5,1.9"
H,51,6.18,dd,"1.9,0.5"
H,52,7.09,ddd,"21.4,1.9,0.5"
H,53,7.22,ddd,"21.4,1.9,0.5"
H,54,7.22,ddd,"23.1,1.9,0.5"
H,55,7.09,ddd,"23.1,1.9,0.5"
H,56,3.66,dd,"15.4,5.2"
H,57,3.66,dd,"15.4,4.2"
H,58,4.39,dd,"5.2,4.2"
H,59,6.64,d,0.5
H,60,3.8,s,
H,61,3.8,s,
H,62,3.8,s,
H,63,6.55,d,0.5
H,64,2.85,ddd,"15.4,10.9,7.5"
H,65,2.85,ddd,"15.4,9.3,1.9"
H,66,2.78,ddd,"12.4,10.9,1.9"
H,67,2.78,ddd,"12.4,9.3,7.5"
H,68,2.54,s,
H,69,2.54,s,
H,70,2.54,s,
H,71,3.85,s,
H,72,3.85,s,
H,73,3.85,s,
H,74,7.45,dd,"1.4,0.5"
H,75,8.2,dd,"4.5,1.4"
H,76,8.5,dd,"4.5,0.5"
H,77,4.34,s,
H,78,4.34,s,
H,79,4.34,s,
H,80,4.58,s,
H,81,4.58,s,
