C,1,15.35,s,
C,2,60.43,s,
O,3,,,
C,4,82.84,s,
C,5,37.66,s,
C,6,82.6,s,
O,7,,,
C,8,55.6,s,
C,9,44.7,s,
C,10,28.4,s,
C,11,39.0,s,
C,12,43.6,s,
C,13,75.4,s,
O,14,,,
C,15,169.7,s,
C,16,21.83,s,
O,17,,,
C,18,49.0,s,
C,19,78.41,s,
O,20,,,
C,21,57.07,s,
C,22,24.85,s,
C,23,27.85,s,
C,24,38.5,s,
C,25,72.44,s,
O,26,,,
C,27,58.89,s,
C,28,56.35,s,
N,29,,,
C,30,48.4,s,
C,31,13.0,s,
C,32,63.7,s,
C,33,39.1,s,
C,34,23.7,s,
C,35,41.1,s,
H,36,1.24,t,6.7
H,37,1.24,t,6.7
H,38,1.24,t,6.7
H,39,3.66,q,6.7
H,40,3.66,q,6.7
H,41,2.91,dd,"12.4,3.6"
H,42,2.91,dd,"12.4,10.0"
H,43,3.32,ddd,"10.0,5.6,3.6"
H,44,3.27,s,
H,45,3.27,s,
H,46,3.27,s,
H,47,2.42,m,
H,48,2.3,ddd,"12.4,7.1,1.1"
H,49,2.3,ddd,"12.4,10.7,9.1"
H,50,2.29,dt,"10.7,7.1"
H,51,2.52,dd,"7.1,1.9"
H,52,4.85,dd,"1.9,0.5"
H,53,2.04,s,
H,54,2.04,s,
H,55,2.04,s,
H,56,4.77,dd,"9.8,8.1"
H,57,3.11,s,
H,58,3.11,s,
H,59,3.11,s,
H,60,1.83,m,
H,61,1.83,m,
H,62,1.89,ddd,"12.4,4.2,2.6"
H,63,1.89,ddd,"12.7,12.4,4.0"
H,64,3.62,s,
H,65,3.62,s,
H,66,3.3,s,
H,67,3.3,s,
H,68,3.3,s,
H,69,2.65,s,
H,70,2.65,s,
H,71,2.5,q,6.8
H,72,2.5,q,6.8
H,73,1.07,t,6.8
H,74,1.07,t,6.8
H,75,1.07,t,6.8
H,76,3.54,d,0.9
H,77,5.28,ddd,"10.2,0.9,0.6"
H,78,1.66,ddd,"12.4,10.0,0.6"
H,79,1.66,ddd,"12.4,10.2,1.9"
H,80,2.11,dd,"10.0,1.9"
