C,1,20.79,s,
C,2,169.89,s,
O,3,,,
O,4,,,
C,5,76.9,s,
C,6,79.25,s,
O,7,,,
C,8,171.14,s,
O,9,,,
C,10,41.22,s,
C,11,134.41,s,
C,12,129.16,s,
C,13,128.51,s,
C,14,127.09,s,
C,15,128.51,s,
C,16,129.16,s,
C,17,54.73,s,
C,18,37.9,s,
C,19,35.12,s,
C,20,77.06,s,
O,21,,,
C,22,170.21,s,
C,23,21.23,s,
O,24,,,
C,25,49.79,s,
C,26,36.24,s,
C,27,65.3,s,
N,28,,,
C,29,42.85,s,
C,30,42.85,s,
C,31,23.3,s,
C,32,37.6,s,
C,33,37.66,s,
C,34,17.35,s,
C,35,50.54,s,
C,36,26.26,s,
C,37,27.31,s,
C,38,57.29,s,
C,39,,,
C,40,30.27,s,
O,41,,,
C,42,42.4,s,
C,43,16.87,s,
H,44,2.0,s,
H,45,2.0,s,
H,46,2.0,s,
H,47,4.77,d,8.6
H,48,5.72,dd,"8.6,8.5"
H,49,3.58,s,
H,50,3.58,s,
H,51,7.22,m,
H,52,7.22,m,
H,53,7.22,ddt,"7.7,6.9,1.4"
H,54,7.22,m,
H,55,7.22,m,
H,56,1.86,dd,"11.6,8.5"
H,57,1.59,m,
H,58,1.88,ddd,"12.4,6.9,1.3"
H,59,1.88,ddd,"12.4,10.7,6.1"
H,60,5.07,ddd,"6.1,4.8,1.3"
H,61,2.02,s,
H,62,2.02,s,
H,63,2.02,s,
H,64,2.12,ddd,"12.5,4.8,4.1"
H,65,1.87,ddd,"12.4,5.4,4.1"
H,66,1.87,ddd,"12.5,12.4,11.3"
H,67,3.77,m,
H,68,2.38,s,
H,69,2.38,s,
H,70,2.38,s,
H,71,2.38,s,
H,72,2.38,s,
H,73,2.38,s,
H,74,1.84,m,
H,75,1.84,m,
H,76,1.72,ddd,"12.4,12.2,7.5"
H,77,1.72,ddd,"12.4,8.1,2.1"
H,78,1.04,s,
H,79,1.04,s,
H,80,1.04,s,
H,81,1.61,ddd,"11.4,10.9,6.0"
H,82,1.48,m,
H,83,1.48,m,
H,84,1.58,m,
H,85,1.58,m,
H,86,2.69,dd,"10.8,6.4"
H,87,2.11,s,
H,88,2.11,s,
H,89,2.11,s,
H,90,1.35,s,
H,91,1.35,s,
H,92,1.35,s,
