C,1,13.7,s,
C,2,50.7,s,
N,3,,,
C,4,56.35,s,
C,5,38.5,s,
C,6,72.44,s,
O,7,,,
C,8,166.82,s,
O,9,,,
C,10,113.97,s,
C,11,130.62,s,
C,12,120.85,s,
C,13,132.76,s,
C,14,124.0,s,
C,15,145.91,s,
N,16,,,
C,17,162.36,s,
C,18,16.48,s,
O,19,,,
C,20,27.85,s,
C,21,24.85,s,
C,22,78.41,s,
O,23,,,
C,24,57.07,s,
C,25,49.44,s,
C,26,63.5,s,
C,27,85.2,s,
O,28,,,
C,29,76.57,s,
O,30,,,
C,31,57.81,s,
C,32,51.51,s,
C,33,76.45,s,
O,34,,,
C,35,40.59,s,
C,36,82.75,s,
O,37,,,
C,38,56.14,s,
C,39,38.0,s,
C,40,29.6,s,
C,41,43.5,s,
C,42,48.16,s,
C,43,81.34,s,
O,44,,,
C,45,57.68,s,
H,46,1.07,t,6.8
H,47,1.07,t,6.8
H,48,1.07,t,6.8
H,49,3.01,q,6.8
H,50,3.01,q,6.8
H,51,2.65,s,
H,52,2.65,s,
H,53,4.07,s,
H,54,4.07,s,
H,55,7.87,ddd,"7.6,1.4,0.5"
H,56,7.11,ddd,"8.3,7.6,1.4"
H,57,7.51,ddd,"8.3,8.0,1.4"
H,58,7.48,ddd,"8.0,1.4,0.5"
H,59,2.13,s,
H,60,2.13,s,
H,61,2.13,s,
H,62,,,
H,63,2.17,ddd,"12.4,11.3,5.6"
H,64,2.17,ddd,"12.4,11.1,3.0"
H,65,1.79,m,
H,66,1.79,m,
H,67,3.43,dd,"10.2,6.7"
H,68,3.09,s,
H,69,3.09,s,
H,70,3.09,s,
H,71,3.02,s,
H,72,,,
H,73,3.92,d,1.4
H,74,3.41,s,
H,75,3.41,s,
H,76,3.41,s,
H,77,1.72,d,1.4
H,78,,,
H,79,2.69,dd,"12.4,8.1"
H,80,2.69,dd,"12.4,0.8"
H,81,3.31,ddd,"8.1,5.0,0.8"
H,82,3.27,s,
H,83,3.27,s,
H,84,3.27,s,
H,85,2.38,m,
H,86,2.0,ddd,"12.4,7.5,0.6"
H,87,2.0,ddd,"12.4,10.1,9.6"
H,88,1.92,ddd,"10.1,7.5,6.8"
H,89,3.12,dd,"6.8,5.4"
H,90,3.6,dd,"5.4,3.9"
H,91,3.36,s,
H,92,3.36,s,
H,93,3.36,s,
