O,1,,,
C,2,169.35,s,
N,3,,,
C,4,137.69,s,
C,5,121.11,s,
C,6,132.44,s,
C,7,124.77,s,
C,8,127.85,s,
C,9,120.06,s,
C,10,166.39,s,
O,11,,,
N,12,,,
C,13,124.64,s,
C,14,111.29,s,
C,15,129.8,s,
C,16,118.88,s,
C,17,121.72,s,
C,18,125.54,s,
C,19,116.25,s,
C,20,135.72,s,
C,21,31.68,s,
C,22,71.6,s,
N,23,,,
O,24,,,
O,25,,,
C,26,167.36,s,
O,27,,,
N,28,,,
C,29,47.03,s,
C,30,23.93,s,
C,31,28.9,s,
C,32,60.27,s,
H,33,9.48,s,
H,34,7.15,ddd,"9.8,1.4,0.5"
H,35,7.22,ddd,"9.8,7.5,1.4"
H,36,7.41,ddd,"8.3,7.5,1.4"
H,37,8.1,ddd,"8.3,1.4,0.5"
H,38,7.26,d,0.5
H,39,7.54,ddt,"7.5,1.4,0.5"
H,40,7.21,ddd,"7.5,6.7,1.4"
H,41,7.34,ddd,"6.8,6.7,1.4"
H,42,8.41,ddd,"6.8,1.4,0.5"
H,43,3.45,dd,"15.4,1.3"
H,44,3.45,dd,"15.4,11.5"
H,45,4.86,dd,"11.5,1.3"
H,46,3.7,ddd,"12.4,11.8,5.2"
H,47,3.7,ddd,"12.4,11.0,3.3"
H,48,1.87,m,
H,49,1.87,m,
H,50,2.03,m,
H,51,2.03,m,
H,52,4.49,dd,"7.3,1.7"
