C,1,13.14,s,
C,2,48.08,s,
N,3,,,
C,4,62.58,s,
C,5,41.86,s,
C,6,23.79,s,
C,7,35.28,s,
C,8,24.85,s,
C,9,78.41,s,
O,10,,,
C,11,57.07,s,
C,12,50.27,s,
C,13,39.0,s,
C,14,28.4,s,
C,15,44.7,s,
C,16,82.6,s,
O,17,,,
C,18,55.6,s,
C,19,37.66,s,
C,20,82.84,s,
O,21,,,
C,22,48.6,s,
C,23,43.6,s,
C,24,75.4,s,
O,25,,,
C,26,169.7,s,
C,27,21.83,s,
O,28,,,
C,29,48.5,s,
C,30,81.34,s,
O,31,,,
C,32,170.26,s,
C,33,21.83,s,
O,34,,,
C,35,51.51,s,
C,36,61.2,s,
H,37,1.07,t,6.8
H,38,1.07,t,6.8
H,39,1.07,t,6.8
H,40,2.5,q,6.8
H,41,2.5,q,6.8
H,42,3.17,s,
H,43,3.17,s,
H,44,0.85,s,
H,45,0.85,s,
H,46,0.85,s,
H,47,1.72,ddd,"13.0,12.4,5.0"
H,48,1.72,ddd,"12.4,4.0,1.6"
H,49,1.83,m,
H,50,1.83,m,
H,51,3.24,dd,"11.8,5.4"
H,52,3.09,s,
H,53,3.09,s,
H,54,3.09,s,
H,55,2.29,ddd,"10.7,8.1,5.2"
H,56,2.3,ddd,"12.4,5.2,1.1"
H,57,2.3,ddd,"12.4,10.7,8.9"
H,58,2.42,m,
H,59,3.32,ddd,"9.4,4.7,1.5"
H,60,3.27,s,
H,61,3.27,s,
H,62,3.27,s,
H,63,2.91,dd,"12.4,9.4"
H,64,2.91,dd,"12.4,4.7"
H,65,3.31,s,
H,66,3.31,s,
H,67,3.31,s,
H,68,2.52,dd,"8.1,5.2"
H,69,4.85,dd,"5.2,4.6"
H,70,2.04,s,
H,71,2.04,s,
H,72,2.04,s,
H,73,2.42,t,1.9
H,74,4.6,dd,"7.7,1.9"
H,75,2.04,s,
H,76,2.04,s,
H,77,2.04,s,
H,78,2.9,d,7.7
H,79,2.83,d,1.9
