C,1,25.27,s,
C,2,72.42,s,
C,3,25.27,s,
O,4,,,
C,5,79.9,s,
O,6,,,
C,7,76.56,s,
C,8,29.09,s,
C,9,35.28,s,
C,10,45.19,s,
C,11,17.82,s,
C,12,79.92,s,
O,13,,,
C,14,35.22,s,
C,15,26.76,s,
C,16,43.45,s,
C,17,33.89,s,
C,18,108.8,s,
C,19,140.19,s,
N,20,,,
C,21,137.2,s,
C,22,111.49,s,
C,23,127.92,s,
C,24,133.83,s,
C,25,141.45,s,
C,26,126.5,s,
C,27,33.89,s,
C,28,46.95,s,
C,29,59.92,s,
C,30,,,
O,31,,,
C,32,81.82,s,
C,33,25.61,s,
C,34,25.61,s,
O,35,,,
C,36,84.7,s,
C,37,23.95,s,
C,38,23.95,s,
C,39,41.86,s,
C,40,23.79,s,
C,41,173.4,s,
C,42,127.9,s,
C,43,197.79,s,
O,44,,,
H,45,1.3,s,
H,46,1.3,s,
H,47,1.3,s,
H,48,1.3,s,
H,49,1.3,s,
H,50,1.3,s,
H,51,,,
H,52,4.52,s,
H,53,5.61,dd,"12.1,5.4"
H,54,1.88,m,
H,55,1.88,m,
H,56,1.72,ddd,"12.4,5.0,2.9"
H,57,1.72,ddd,"12.7,12.4,6.8"
H,58,1.13,s,
H,59,1.13,s,
H,60,1.13,s,
H,61,,,
H,62,1.9,ddd,"12.4,7.1,2.2"
H,63,1.9,ddd,"12.4,11.9,7.9"
H,64,1.78,m,
H,65,1.78,m,
H,66,1.61,m,
H,67,3.01,dd,"12.7,12.4"
H,68,3.01,dd,"12.4,5.2"
H,69,,,
H,70,7.37,d,6.7
H,71,7.56,d,6.7
H,72,3.01,dd,"15.4,12.5"
H,73,3.01,dd,"15.4,2.8"
H,74,2.13,ddd,"12.5,11.2,2.8"
H,75,2.83,d,11.2
H,76,1.34,s,
H,77,1.34,s,
H,78,1.34,s,
H,79,1.34,s,
H,80,1.34,s,
H,81,1.34,s,
H,82,1.34,s,
H,83,1.34,s,
H,84,1.34,s,
H,85,1.34,s,
H,86,1.34,s,
H,87,1.34,s,
H,88,1.13,s,
H,89,1.13,s,
H,90,1.13,s,
H,91,6.22,s,
