C,1,18.25,s,
C,2,70.4,s,
O,3,,,
C,4,99.8,s,
O,5,,,
C,6,77.7,s,
C,7,27.0,s,
C,8,30.5,s,
C,9,35.4,s,
C,10,23.8,s,
C,11,35.7,s,
C,12,21.02,s,
C,13,41.2,s,
C,14,50.9,s,
C,15,16.3,s,
C,16,52.1,s,
C,17,178.4,s,
C,18,117.8,s,
C,19,176.32,s,
O,20,,,
O,21,,,
C,22,75.4,s,
C,23,27.9,s,
C,24,33.4,s,
C,25,86.3,s,
O,26,,,
C,27,41.33,s,
C,28,24.85,s,
C,29,26.9,s,
C,30,36.7,s,
C,31,30.3,s,
C,32,72.9,s,
O,33,,,
C,34,72.9,s,
O,35,,,
C,36,72.83,s,
O,37,,,
H,38,1.27,d,6.1
H,39,1.27,d,6.1
H,40,1.27,d,6.1
H,41,4.01,qd,"6.1,1.8"
H,42,5.09,d,7.5
H,43,3.98,m,
H,44,1.74,m,
H,45,1.74,m,
H,46,1.37,ddd,"14.1,12.4,4.5"
H,47,1.37,ddd,"12.4,4.4,3.0"
H,48,0.88,s,
H,49,0.88,s,
H,50,0.88,s,
H,51,1.61,ddd,"11.2,10.6,5.5"
H,52,1.47,m,
H,53,1.47,m,
H,54,1.48,ddd,"12.4,8.4,2.3"
H,55,1.48,ddd,"12.4,10.9,7.2"
H,56,1.01,s,
H,57,1.01,s,
H,58,1.01,s,
H,59,2.79,dd,"9.8,1.9"
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,"12.4,11.1,8.5"
H,66,2.13,ddd,"12.4,9.7,1.1"
H,67,,,
H,68,2.13,ddd,"11.2,10.6,3.0"
H,69,1.48,m,
H,70,1.48,m,
H,71,1.48,m,
H,72,1.48,m,
H,73,1.09,m,
H,74,1.51,ddd,"12.4,10.0,2.3"
H,75,1.51,ddd,"12.4,8.4,3.7"
H,76,3.79,dd,"10.0,7.5"
H,77,,,
H,78,4.05,dd,"10.0,7.0"
H,79,,,
H,80,3.51,dd,"7.0,1.8"
H,81,,,
