C,1,20.29,s,
C,2,29.4,s,
C,3,20.29,s,
C,4,50.87,s,
C,5,172.96,s,
O,6,,,
O,7,,,
C,8,74.77,s,
C,9,34.43,s,
C,10,53.65,s,
N,11,,,
C,12,62.9,s,
C,13,128.4,s,
C,14,131.7,s,
C,15,62.66,s,
O,16,,,
C,17,172.75,s,
O,18,,,
C,19,77.48,s,
O,20,,,
C,21,71.22,s,
C,22,16.94,s,
O,23,,,
C,24,74.88,s,
O,25,,,
C,26,75.5,s,
H,27,0.88,d,6.4
H,28,0.88,d,6.4
H,29,0.88,d,6.4
H,30,1.87,m,"6.4,5.6"
H,31,0.88,d,6.4
H,32,0.88,d,6.4
H,33,0.88,d,6.4
H,34,3.31,dd,"9.3,5.6"
H,35,5.43,ddd,"11.8,6.5,5.6"
H,36,2.03,tdd,"12.4,11.8,8.5"
H,37,2.03,m,
H,38,3.16,ddd,"9.4,8.5,1.1"
H,39,3.16,ddd,"12.4,9.4,8.4"
H,40,3.72,dd,"9.4,2.8"
H,41,3.72,dd,"9.4,4.6"
H,42,5.99,dd,"4.6,2.8"
H,43,4.63,s,
H,44,4.63,s,
H,45,,,
H,46,4.49,q,6.2
H,47,1.31,d,6.2
H,48,1.31,d,6.2
H,49,1.31,d,6.2
H,50,,,
H,51,3.82,d,9.3
H,52,,,
H,53,4.38,d,6.5
