C,1,29.38,s,
N,2,,,
C,3,164.56,s,
O,4,,,
C,5,105.6,s,
C,6,157.8,s,
C,7,116.83,s,
C,8,123.0,s,
C,9,122.51,s,
C,10,130.99,s,
C,11,114.6,s,
C,12,139.63,s,
O,13,,,
C,14,81.1,s,
C,15,23.65,s,
C,16,23.65,s,
C,17,44.5,s,
C,18,21.05,s,
C,19,34.9,s,
C,20,73.7,s,
C,21,24.74,s,
O,22,,,
C,23,74.88,s,
O,24,,,
C,25,39.18,s,
H,26,3.7,s,
H,27,3.7,s,
H,28,3.7,s,
H,29,7.56,ddd,"8.2,1.4,0.5"
H,30,7.35,ddd,"8.2,6.8,1.4"
H,31,7.43,ddd,"7.9,6.8,1.4"
H,32,7.32,ddd,"7.9,1.4,0.5"
H,33,1.34,s,
H,34,1.34,s,
H,35,1.34,s,
H,36,1.34,s,
H,37,1.34,s,
H,38,1.34,s,
H,39,2.13,ddd,"11.1,10.9,1.4"
H,40,1.95,m,
H,41,1.95,m,
H,42,1.9,ddd,"12.4,10.5,9.5"
H,43,1.9,ddd,"12.4,9.1,1.1"
H,44,1.36,s,
H,45,1.36,s,
H,46,1.36,s,
H,47,,,
H,48,3.82,d,7.0
H,49,,,
H,50,2.75,dd,"10.9,7.0"
