C,1,18.25,s,
C,2,70.4,s,
O,3,,,
C,4,97.05,s,
O,5,,,
C,6,76.92,s,
C,7,28.55,s,
C,8,35.28,s,
C,9,49.87,s,
C,10,180.49,s,
O,11,,,
O,12,,,
C,13,50.54,s,
C,14,21.4,s,
C,15,41.2,s,
C,16,50.9,s,
C,17,16.3,s,
C,18,52.1,s,
C,19,178.4,s,
C,20,117.8,s,
C,21,176.32,s,
O,22,,,
O,23,,,
C,24,75.4,s,
C,25,27.9,s,
C,26,33.4,s,
C,27,86.3,s,
O,28,,,
C,29,41.33,s,
C,30,24.85,s,
C,31,28.51,s,
C,32,43.47,s,
C,33,34.05,s,
C,34,74.02,s,
O,35,,,
C,36,71.35,s,
O,37,,,
C,38,73.04,s,
O,39,,,
H,40,1.27,d,6.1
H,41,1.27,d,6.1
H,42,1.27,d,6.1
H,43,4.01,qd,"6.1,2.6"
H,44,5.03,d,3.6
H,45,3.9,m,
H,46,1.7,m,
H,47,1.7,m,
H,48,1.72,ddd,"12.4,6.3,1.6"
H,49,1.72,ddd,"13.2,12.4,3.0"
H,50,,,
H,51,1.61,ddd,"11.9,10.8,4.0"
H,52,1.47,m,
H,53,1.47,m,
H,54,1.48,ddd,"12.4,9.3,1.6"
H,55,1.48,ddd,"12.4,9.3,9.0"
H,56,1.01,s,
H,57,1.01,s,
H,58,1.01,s,
H,59,2.79,dd,"9.3,1.4"
H,60,5.95,s,
H,61,5.07,s,
H,62,5.07,s,
H,63,2.06,m,
H,64,2.06,m,
H,65,2.13,ddd,"12.4,10.8,9.2"
H,66,2.13,ddd,"12.4,8.9,0.6"
H,67,,,
H,68,2.13,ddd,"11.9,10.9,4.1"
H,69,1.48,m,
H,70,1.48,m,
H,71,1.48,m,
H,72,1.48,m,
H,73,1.44,m,
H,74,1.51,ddd,"12.4,6.1,5.0"
H,75,1.51,ddd,"12.4,10.6,2.2"
H,76,3.62,dd,"7.1,3.6"
H,77,,,
H,78,3.49,dd,"7.1,3.2"
H,79,,,
H,80,3.24,dd,"3.2,2.6"
H,81,,,
