C,1,56.79,s,
O,2,,,
C,3,146.5,s,
C,4,113.93,s,
C,5,123.0,s,
C,6,124.58,s,
C,7,134.28,s,
C,8,131.53,s,
N,9,,,
C,10,169.14,s,
O,11,,,
C,12,42.49,s,
C,13,77.06,s,
O,14,,,
C,15,67.4,s,
C,16,60.85,s,
O,17,,,
C,18,77.48,s,
C,19,60.58,s,
N,20,,,
C,21,45.14,s,
C,22,53.9,s,
C,23,38.94,s,
C,24,41.86,s,
C,25,,,
O,26,,,
C,27,43.37,s,
C,28,46.95,s,
C,29,49.9,s,
C,30,61.05,s,
H,31,3.85,s,
H,32,3.85,s,
H,33,3.85,s,
H,34,6.98,dd,"7.6,1.4"
H,35,6.9,dd,"7.9,7.6"
H,36,7.25,dd,"7.9,1.4"
H,37,2.86,dd,"15.4,9.0"
H,38,2.86,dd,"15.4,7.8"
H,39,4.88,ddd,"11.2,9.0,7.8"
H,40,4.05,d,12.4
H,41,4.05,dd,"12.4,5.2"
H,42,3.08,d,5.2
H,43,3.05,s,
H,44,3.05,s,
H,45,2.28,s,
H,46,2.28,s,
H,47,2.28,s,
H,48,3.15,ddd,"12.4,6.5,1.1"
H,49,3.15,ddd,"12.4,11.4,0.6"
H,50,2.18,ddd,"12.4,11.4,1.1"
H,51,2.18,ddd,"12.4,6.5,0.6"
H,52,2.74,dd,"15.4,9.1"
H,53,2.74,dd,"15.4,0.9"
H,54,2.13,ddd,"9.1,6.0,0.9"
H,55,2.18,ddd,"11.2,9.4,6.0"
H,56,3.54,d,9.4
