C,1,32.6,s,
N,2,,,
C,3,169.5,s,
O,4,,,
C,5,65.0,s,
C,6,35.29,s,
C,7,111.29,s,
C,8,123.67,s,
N,9,,,
C,10,137.2,s,
C,11,111.19,s,
C,12,124.32,s,
C,13,124.52,s,
C,14,143.45,s,
N,15,,,
O,16,,,
O,17,,,
C,18,118.9,s,
N,19,,,
C,20,32.6,s,
C,21,169.5,s,
O,22,,,
C,23,65.0,s,
C,24,37.1,s,
C,25,133.9,s,
C,26,128.2,s,
C,27,128.58,s,
C,28,126.94,s,
C,29,128.58,s,
C,30,128.2,s,
H,31,2.91,s,
H,32,2.91,s,
H,33,2.91,s,
H,34,4.49,t,6.5
H,35,3.0,d,6.5
H,36,3.0,d,6.5
H,37,7.12,s,
H,38,,,
H,39,7.17,dd,"7.6,1.4"
H,40,7.17,dd,"7.6,6.3"
H,41,7.77,dd,"6.3,1.4"
H,42,2.91,s,
H,43,2.91,s,
H,44,2.91,s,
H,45,4.49,t,6.5
H,46,3.18,d,6.5
H,47,3.18,d,6.5
H,48,7.31,m,
H,49,7.24,m,
H,50,7.22,ddt,"6.8,6.7,1.4"
H,51,7.24,m,
H,52,7.31,m,
