C,1,20.2,s,
C,2,133.12,s,
C,3,132.74,s,
C,4,33.73,s,
C,5,20.81,s,
C,6,35.12,s,
C,7,69.34,s,
C,8,20.55,s,
O,9,,,
C,10,171.36,s,
O,11,,,
C,12,60.62,s,
C,13,68.56,s,
C,14,20.14,s,
O,15,,,
N,16,,,
C,17,171.56,s,
O,18,,,
C,19,61.57,s,
C,20,35.65,s,
C,21,128.1,s,
C,22,126.82,s,
C,23,114.7,s,
C,24,152.9,s,
O,25,,,
C,26,85.8,s,
I,27,,,
C,28,139.73,s,
N,29,,,
C,30,33.32,s,
C,31,169.5,s,
O,32,,,
C,33,53.3,s,
C,34,61.3,s,
O,35,,,
N,36,,,
C,37,175.06,s,
O,38,,,
C,39,35.32,s,
C,40,15.77,s,
C,41,33.14,s,
H,42,1.75,s,
H,43,1.75,s,
H,44,1.75,s,
H,45,5.92,d,8.5
H,46,2.47,m,
H,47,0.98,d,6.7
H,48,0.98,d,6.7
H,49,0.98,d,6.7
H,50,1.88,ddd,"12.4,9.1,0.6"
H,51,1.88,ddd,"12.4,11.7,2.2"
H,52,5.09,dqd,"9.1,6.1,2.2"
H,53,1.26,d,6.1
H,54,1.26,d,6.1
H,55,1.26,d,6.1
H,56,4.68,dd,"7.0,5.1"
H,57,4.03,qd,"6.1,5.1"
H,58,0.99,d,6.1
H,59,0.99,d,6.1
H,60,0.99,d,6.1
H,61,,,
H,62,7.4,d,7.0
H,63,4.75,t,6.5
H,64,3.18,d,6.5
H,65,3.18,d,6.5
H,66,6.92,dd,"9.2,1.9"
H,67,6.91,dd,"9.2,0.5"
H,68,,,
H,69,7.84,dd,"1.9,0.5"
H,70,2.96,s,
H,71,2.96,s,
H,72,2.96,s,
H,73,4.33,dt,"7.0,5.9"
H,74,3.6,d,5.9
H,75,3.6,d,5.9
H,76,,,
H,77,7.4,d,7.0
H,78,2.8,qdd,"6.7,5.8,4.9"
H,79,1.26,d,6.7
H,80,1.26,d,6.7
H,81,1.26,d,6.7
H,82,2.44,dd,"15.4,5.8"
H,83,2.44,dd,"15.4,4.9"
