C,1,13.2,s,
C,2,47.94,s,
N,3,,,
C,4,48.06,s,
C,5,43.11,s,
C,6,77.1,s,
O,7,,,
C,8,58.53,s,
C,9,71.4,s,
O,10,,,
C,11,34.1,s,
C,12,83.7,s,
O,13,,,
C,14,56.17,s,
C,15,50.1,s,
C,16,41.4,s,
C,17,36.2,s,
C,18,74.2,s,
O,19,,,
C,20,79.1,s,
O,21,,,
C,22,165.9,s,
O,23,,,
C,24,130.2,s,
C,25,129.11,s,
C,26,128.88,s,
C,27,133.32,s,
C,28,128.88,s,
C,29,129.11,s,
C,30,48.16,s,
C,31,77.48,s,
O,32,,,
C,33,74.89,s,
O,34,,,
C,35,90.3,s,
O,36,,,
C,37,60.9,s,
C,38,46.79,s,
C,39,82.2,s,
O,40,,,
C,41,58.31,s,
C,42,47.89,s,
C,43,60.94,s,
H,44,1.07,t,6.8
H,45,1.07,t,6.8
H,46,1.07,t,6.8
H,47,2.5,q,6.8
H,48,2.5,q,6.8
H,49,2.82,s,
H,50,2.82,s,
H,51,3.61,s,
H,52,3.61,s,
H,53,3.15,s,
H,54,3.15,s,
H,55,3.15,s,
H,56,3.78,dd,"16.8,9.3"
H,57,,,
H,58,2.11,ddd,"16.8,12.4,0.4"
H,59,2.11,ddd,"12.4,9.3,8.0"
H,60,3.13,dd,"8.0,0.4"
H,61,3.19,s,
H,62,3.19,s,
H,63,3.19,s,
H,64,2.08,ddd,"16.1,11.0,1.7"
H,65,1.96,dd,"16.1,12.4"
H,66,1.96,dd,"12.4,11.0"
H,67,,,
H,68,4.96,d,15.2
H,69,8.03,m,
H,70,7.46,m,
H,71,7.57,tt,"7.5,1.4"
H,72,7.46,tdd,"7.5,1.4,0.5"
H,73,8.03,m,
H,74,2.52,dd,"15.2,1.7"
H,75,,,
H,76,4.12,d,8.6
H,77,,,
H,78,4.76,d,8.6
H,79,3.42,s,
H,80,3.42,s,
H,81,3.42,s,
H,82,2.42,dd,"10.1,4.9"
H,83,4.08,dd,"10.1,7.1"
H,84,3.2,s,
H,85,3.2,s,
H,86,3.2,s,
H,87,3.02,d,7.1
H,88,2.83,d,4.9
