C,1,13.14,s,
C,2,48.08,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,9,47.89,s,
C,10,81.34,s,
O,11,,,
C,12,57.68,s,
C,13,47.72,s,
C,14,53.94,s,
C,15,,,
O,16,,,
C,17,79.9,s,
O,18,,,
C,19,57.81,s,
C,20,77.48,s,
O,21,,,
C,22,37.71,s,
C,23,50.54,s,
C,24,45.18,s,
C,25,76.57,s,
O,26,,,
C,27,166.26,s,
O,28,,,
C,29,123.71,s,
C,30,131.99,s,
C,31,113.7,s,
C,32,163.46,s,
O,33,,,
C,34,55.32,s,
C,35,113.7,s,
C,36,131.99,s,
C,37,50.27,s,
C,38,83.64,s,
O,39,,,
C,40,56.17,s,
C,41,33.59,s,
C,42,71.4,s,
O,43,,,
C,44,61.05,s,
H,45,1.07,t,6.8
H,46,1.07,t,6.8
H,47,1.07,t,6.8
H,48,2.5,q,6.8
H,49,2.5,q,6.8
H,50,2.82,s,
H,51,2.82,s,
H,52,3.61,s,
H,53,3.61,s,
H,54,3.15,s,
H,55,3.15,s,
H,56,3.15,s,
H,57,2.66,d,7.9
H,58,4.6,dd,"7.9,1.9"
H,59,3.31,s,
H,60,3.31,s,
H,61,3.31,s,
H,62,1.24,ddd,"4.1,1.9,0.9"
H,63,3.17,dd,"7.7,4.1"
H,64,4.52,s,
H,65,3.42,s,
H,66,3.42,s,
H,67,3.42,s,
H,68,,,
H,69,1.96,dd,"12.4,10.8"
H,70,1.96,dd,"12.4,5.9"
H,71,1.61,ddd,"10.8,8.0,5.9"
H,72,2.77,ddd,"8.0,7.7,6.6"
H,73,5.19,d,6.6
H,74,7.94,ddd,"6.7,1.9,0.5"
H,75,6.88,ddd,"6.7,1.9,0.5"
H,76,3.76,s,
H,77,3.76,s,
H,78,3.76,s,
H,79,6.88,ddd,"7.0,1.9,0.5"
H,80,7.94,ddd,"7.0,1.9,0.5"
H,81,3.13,dd,"5.6,1.6"
H,82,3.19,s,
H,83,3.19,s,
H,84,3.19,s,
H,85,2.11,ddd,"12.4,5.6,2.9"
H,86,2.11,ddd,"12.4,2.0,1.6"
H,87,3.78,dd,"2.9,2.0"
H,88,,,
H,89,3.54,d,0.9
