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,11,38.62,s,
C,12,75.84,s,
O,13,,,
C,14,49.44,s,
C,15,41.4,s,
C,16,36.2,s,
C,17,74.2,s,
O,18,,,
C,19,79.1,s,
O,20,,,
C,21,165.9,s,
O,22,,,
C,23,130.2,s,
C,24,129.11,s,
C,25,128.88,s,
C,26,133.32,s,
C,27,128.88,s,
C,28,129.11,s,
C,29,45.2,s,
C,30,92.2,s,
O,31,,,
C,32,172.2,s,
C,33,21.3,s,
O,34,,,
C,35,44.5,s,
C,36,82.2,s,
O,37,,,
C,38,58.31,s,
C,39,51.55,s,
C,40,60.94,s,
C,41,78.9,s,
O,42,,,
C,43,90.3,s,
O,44,,,
C,45,60.9,s,
H,46,1.07,t,6.8
H,47,1.07,t,6.8
H,48,1.07,t,6.8
H,49,2.5,q,6.8
H,50,2.5,q,6.8
H,51,2.82,s,
H,52,2.82,s,
H,53,3.61,s,
H,54,3.61,s,
H,55,3.15,s,
H,56,3.15,s,
H,57,3.15,s,
H,58,3.78,dd,"11.5,5.0"
H,59,,,
H,60,2.13,ddd,"12.4,5.0,3.8"
H,61,2.13,ddd,"12.4,12.2,11.5"
H,62,4.12,dd,"12.2,3.8"
H,63,,,
H,64,2.08,ddd,"11.3,8.4,4.0"
H,65,1.96,dd,"12.4,11.3"
H,66,1.96,dd,"12.4,4.0"
H,67,,,
H,68,4.96,d,0.9
H,69,8.03,m,
H,70,7.46,m,
H,71,7.57,ddt,"6.9,6.4,1.4"
H,72,7.46,m,
H,73,8.03,m,
H,74,2.52,dd,"8.4,0.9"
H,75,2.14,s,
H,76,2.14,s,
H,77,2.14,s,
H,78,2.42,dd,"0.9,0.7"
H,79,4.08,dd,"8.7,0.9"
H,80,3.2,s,
H,81,3.2,s,
H,82,3.2,s,
H,83,2.66,d,8.7
H,84,2.83,d,0.7
H,85,4.12,d,2.3
H,86,,,
H,87,4.76,d,2.3
H,88,3.42,s,
H,89,3.42,s,
H,90,3.42,s,
