C,1,55.45,s,
O,2,,,
C,3,146.35,s,
C,4,112.5,s,
C,5,126.03,s,
C,6,129.88,s,
C,7,111.9,s,
C,8,147.0,s,
O,9,,,
C,10,145.43,s,
C,11,139.54,s,
O,12,,,
C,13,60.99,s,
C,14,153.49,s,
O,15,,,
C,16,56.23,s,
C,17,110.47,s,
C,18,138.21,s,
C,19,130.1,s,
C,20,71.6,s,
C,21,31.68,s,
C,22,134.69,s,
C,23,126.82,s,
C,24,116.48,s,
C,25,151.86,s,
O,26,,,
C,27,126.71,s,
C,28,131.33,s,
C,29,127.5,s,
C,30,131.33,s,
C,31,139.8,s,
C,32,126.82,s,
C,33,111.4,s,
C,34,154.7,s,
O,35,,,
C,36,56.1,s,
C,37,40.92,s,
C,38,65.13,s,
N,39,,,
C,40,42.27,s,
C,41,46.63,s,
C,42,25.52,s,
N,43,,,
C,44,58.89,s,
O,45,,,
C,46,66.54,s,
C,47,28.05,s,
H,48,3.8,s,
H,49,3.8,s,
H,50,3.8,s,
H,51,6.55,d,0.5
H,52,6.64,d,0.5
H,53,3.81,s,
H,54,3.81,s,
H,55,3.81,s,
H,56,3.87,s,
H,57,3.87,s,
H,58,3.87,s,
H,59,6.68,s,
H,60,4.86,dd,"11.6,5.5"
H,61,3.45,dd,"15.4,11.6"
H,62,3.45,dd,"15.4,5.5"
H,63,6.92,dd,"7.3,1.9"
H,64,6.72,dd,"7.3,0.5"
H,65,,,
H,66,7.61,dt,"1.9,0.5"
H,67,7.61,dt,"1.9,0.5"
H,68,6.92,dd,"6.9,1.9"
H,69,7.0,dd,"6.9,0.5"
H,70,3.7,s,
H,71,3.7,s,
H,72,3.7,s,
H,73,3.01,dd,"15.4,8.3"
H,74,3.01,dd,"15.4,8.8"
H,75,4.39,dd,"8.8,8.3"
H,76,2.54,s,
H,77,2.54,s,
H,78,2.54,s,
H,79,2.78,ddd,"12.4,10.7,1.7"
H,80,2.78,ddd,"12.4,11.1,5.2"
H,81,2.85,ddd,"15.4,11.1,1.7"
H,82,2.85,ddd,"15.4,10.7,5.2"
H,83,3.14,s,
H,84,3.14,s,
H,85,3.14,s,
H,86,3.65,ddd,"12.7,12.4,4.2"
H,87,3.65,ddd,"12.4,3.0,1.9"
H,88,3.01,ddd,"15.4,4.2,1.9"
H,89,3.01,ddd,"15.4,12.7,3.0"
